File SKIP_SPECIES.TXT lists species and minerals omitted from the calculations due to given T, P, option switches, or suppression in CHIMRUN, or are suppressed in the SOLTHERM database. It also lists minerals for which density is not specified in SOLTHERM. This is an extended P(to 5 kB), T(to 600 C) run (CON_FLAG = 1). methanol,aq is suppressed in SOLTHERM data file. methanol,aq is suppressed in SOLTHERM data file. CuCl4-3 is suppressed in SOLTHERM data file. H2BO3- is suppressed in SOLTHERM data file. UO2CO3,aq is suppressed in SOLTHERM data file. UO2SO4,aq is suppressed in SOLTHERM data file. UO2Cl2,aq is suppressed in SOLTHERM data file. UO2F2,aq is suppressed in SOLTHERM data file. PO4-3 is suppressed in SOLTHERM data file. H2PO4- is suppressed in SOLTHERM data file. H3PO4 is suppressed in SOLTHERM data file. O2,gas is suppressed in THIS RUN. O2,gas is suppressed in THIS RUN. amesite is suppressed in SOLTHERM data file. antigorite is suppressed in SOLTHERM data file. goethite is suppressed in THIS RUN. goethite is suppressed in THIS RUN. riebeckite is suppressed in THIS RUN. riebeckite is suppressed in THIS RUN. sapphirine-Fe(221) is suppressed in SOLTHERM data file. sapphirine(221) is suppressed in SOLTHERM data file. talc-prl is suppressed in SOLTHERM data file. PrO1.833(s) is suppressed in SOLTHERM data file. niter-NH4 is suppressed in SOLTHERM data file. FMQ_HS-1 is suppressed in THIS RUN. kf-ab-equil is suppressed in THIS RUN. ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Species No. Charge Tot.moles Trial molality Gamma Mixing solution H+ 1 1. -0.11414E-01 0.25629E-09 0.8303 0.00000000E+00 H2O 2 0. 0.49912E+02 0.10000E+01 1.0000 0.00000000E+00 Cl- 3 -1. 0.60983E-03 0.67483E-03 0.8246 0.00000000E+00 SO4-- 4 -2. 0.36697E-03 0.40757E-03 0.4938 0.00000000E+00 HCO3- 5 -1. 0.57963E-02 0.38163E-02 0.8260 0.00000000E+00 HS- 6 -1. 0.16023E-02 0.17804E-02 0.8247 0.00000000E+00 Al+++ 7 3. 0.47754E-05 0.22142E-27 0.2058 0.00000000E+00 H4SiO4 8 0. 0.12153E-01 0.10246E-02 1.0000 0.00000000E+00 Ca++ 9 2. 0.20808E-06 0.24929E-07 0.4896 0.00000000E+00 Mg++ 10 2. 0.83683E-10 0.22168E-10 0.4870 0.00000000E+00 Fe++ 11 2. 0.32592E-07 0.23183E-12 0.4876 0.00000000E+00 K+ 12 1. 0.14123E-03 0.15627E-03 0.8262 0.00000000E+00 Na+ 13 1. 0.20032E-01 0.20973E-01 0.8244 0.00000000E+00 Mn++ 14 2. 0.22519E-08 0.11887E-09 0.4881 0.00000000E+00 F- 15 -1. 0.32096E-04 0.35567E-04 0.8226 0.00000000E+00 HPO4-- 16 -2. 0.41688E-07 0.45844E-07 0.4938 0.00000000E+00 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6098E-07 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 50.0000 SLIM = 0.200000E+00 TEMP = 100.0000 SINC = 0.4000E-02 TEMPC = 0.0000 TOTMIX = 0.799900E-01 ENTH = 0.0000 SENTH = 0.0000 DENTH = 0.0000 TOTWAT = 90.0000 SOLMIN = 0.0000E+00 RM = 0.0000 AQGRM = 1000.0103 SUPRNT = 0.1000E-19 VBOX-1 = 400.9996 RHOFRS = 0.0000 RHOROC = 2.5000 The following options were selected: CONFLG = 1 C = 3 IFRAC = 0 IPUNCH = 2 NLOOP = 400 ISTEP = 2 LIMSOL = 1 LOOC = 0 IENTH = 0 ITREF = 0 IDEAL = 0 IPSAT = 1 INCREM = 0 INCP = 0 MINSOL = 3 NEUT = 0 AWAT = 0 CHGF = 0 Of the derived species, only those with molality > 0.10E-19 will appear in the output Species No. Charge Log K(diss) Species No. Charge Log K(diss) SiF6-2 17 -2. -24.5019 Mn+3 70 3. 19.1453 HSiO3- 18 -1. 9.0298 MnF+ 71 1. -1.2264 Ca(HSiO3)+ 19 1. 7.6723 MnO,aq 72 0. 17.9848 Mg(HSiO3)+ 20 1. 7.5773 MnOH+ 73 1. 8.5194 NaHSiO3,aq 21 0. 7.8210 MnO2-2 74 -2. 40.4638 AlO+ 22 1. 6.8663 HMnO2- 75 -1. 29.1232 AlOH+2 23 2. 3.1691 MnO4- 76 -1. 83.3111 HAlO2,aq 24 0. 10.5671 MnO4-2 77 -2. 81.3005 AlO2- 25 -1. 16.2221 MnCl+ 78 1. -0.7894 CH4,aq 26 0. 6.0126 MnSO4,aq 79 0. -2.4604 C2H6,aq 27 0. 12.3733 NaCl,aq 80 0. 0.4796 C3H8,aq 28 0. 17.3707 NaF,aq 81 0. 0.6306 C4H10,aq 29 0. 22.3757 NaOH,aq 82 0. 12.3669 ethanol,aq 30 0. 15.3258 O2,aq 83 0. 53.5502 CO,aq 31 0. 4.6892 OH- 84 -1. 12.2382 CO2,aq 32 0. -6.3298 HO2- 85 -1. 50.8010 CO3-2 33 -2. 10.0588 H2O2,aq 86 0. 40.0166 CaCO3,aq 34 0. 5.9605 H3PO2,aq 87 0. 24.3066 Ca(HCO3)+ 35 1. -1.4070 H2PO2- 88 -1. 26.5366 CaCl+ 36 1. -0.2091 HPO3-2 89 -2. 11.9254 CaCl2,aq 37 0. 0.4151 H3PO3,aq 90 0. 3.5792 CaF+ 38 1. -1.1644 H2PO3- 91 -1. 5.6232 CaOH+ 39 1. 10.1471 H3PO4,aq 92 0. -9.8447 CaSO4,aq 40 0. -2.5018 H2PO4- 93 -1. -7.2659 HCl,aq 41 0. 0.7370 PO4-3 94 -3. 12.0884 HClO,aq 42 0. 32.4260 H4P2O7,aq 95 0. -17.8095 ClO- 43 -1. 39.6530 H3P2O7- 96 -1. -15.9156 HClO2,aq 44 0. 70.1812 H2P2O7-2 97 -2. -13.4262 HF,aq 45 0. -3.8354 HP2O7-3 98 -3. -6.7266 HF2- 46 -1. -3.3639 P2O7-4 99 -4. 2.8952 Fe+3 47 3. 8.3809 H2S,aq 100 0. -6.4900 FeCl+ 48 1. -0.1994 S2-2 101 -2. 1.2355 FeCl2,aq 49 0. 4.3001 S3-2 102 -2. -8.8031 FeCl+2 50 2. 6.5269 S3- 103 -1. -16.3389 FeF+ 51 1. -1.7084 S4-2 104 -2. -18.6615 FeF+2 52 2. 1.4309 S5-2 105 -2. -28.3439 FeO,aq 53 0. 16.4104 SO2,aq 106 0. -0.2309 FeOH+ 54 1. 7.4874 SO3-2 107 -2. 10.3052 HFeO2- 55 -1. 24.3908 HSO3- 108 -1. 2.5086 FeO+ 56 1. 11.4004 HSO4- 109 -1. -2.9839 FeOH+2 57 2. 9.1194 HSO5- 110 -1. 38.8366 FeO2- 58 -1. 24.0895 S2O3-2 111 -2. -4.5600 HFeO2,aq 59 0. 15.9850 HS2O3- 112 -1. -6.8123 H2,aq 60 0. 9.4190 H2S2O3,aq 113 0. -8.0173 KCl,aq 61 0. 1.7417 S2O4-2 114 -2. 10.5541 KHSO4,aq 62 0. -0.4514 HS2O4- 115 -1. 7.6551 KOH,aq 63 0. 12.3695 H2S2O4,aq 116 0. 6.6259 KSO4- 64 -1. -1.1908 S2O5-2 117 -2. 10.0741 MgCO3,aq 65 0. 6.5614 S2O6-2 118 -2. 11.5521 Mg(HCO3)+ 66 1. -1.4164 S2O8-2 119 -2. 42.0620 MgCl+ 67 1. -0.1664 S3O6-2 120 -2. 3.7866 MgF+ 68 1. -1.7331 S4O6-2 121 -2. -17.8657 MgOH+ 69 1. 9.4041 S5O6-2 122 -2. -14.1333 For mixed gases (JSOLS=6), log K(hydrol) = log (K*P) Log K Trial Log K Trial Mineral No. hydrol Moles Mineral No. hydrol Moles H2O,gas 1 1.696 0.0000E+00 osumilite(1) 126 21.717 0.0000E+00 CO2,gas 2 -6.660 0.0000E+00 osumilite(2) 127 20.667 0.0000E+00 CH4,gas 3 4.544 0.0000E+00 osumilite-Fe 128 14.390 0.0000E+00 H2,gas 4 8.000 0.0000E+00 pargasite 129 65.092 0.0000E+00 H2S,gas 5 -6.230 0.0000E+00 periclase 130 16.138 0.0000E+00 S2,gas 6 -7.335 0.0000E+00 periclase-Fe 131 11.627 0.0000E+00 CO,gas 7 3.215 0.0000E+00 perovskite-Al 132 12.344 0.0000E+00 SO3,gas 8 17.121 0.0000E+00 perovskite-Ca 133 23.807 0.0000E+00 SO2,gas 9 0.832 0.0000E+00 perovskite-Fe 134 21.143 0.0000E+00 HF,gas 10 0.473 0.0000E+00 perovskite-Mg 135 23.119 0.0000E+00 HCl,gas 11 5.189 0.0000E+00 phase_A 136 80.189 0.0000E+00 acmite 12 7.710 0.0000E+00 phlogopite-Na 137 29.647 0.0000E+00 akermanite 13 36.442 0.0000E+00 piemontite(ordered) 138 33.776 0.0000E+00 akimotoite 14 16.591 0.0000E+00 prehnite 139 19.372 0.0000E+00 akimotoite-Fe 15 13.067 0.0000E+00 prehnite-Fe 140 22.498 0.0000E+00 albite-high 16 0.693 0.0000E+00 pumpellyite-Fe 141 46.269 0.0000E+00 albite 17 -0.384 0.3319E-05 pumpellyite-Mg 142 48.995 0.0000E+00 almandine 18 24.442 0.0000E+00 px-Mg-tschermaks 143 19.616 0.0000E+00 pyrope 19 37.248 0.0000E+00 px-Ca-tschermaks 144 18.610 0.0000E+00 spessartine 20 24.457 0.0000E+00 pyrite 145 -21.247 0.2677E-07 analcite 21 3.322 0.0000E+00 pyrrhotite 146 -4.260 0.0000E+00 andalusite 22 5.002 0.0000E+00 pyrrhotiteFe0.875 147 -6.017 0.0000E+00 andradite 23 39.009 0.0000E+00 pyroxmangite 148 7.399 0.0000E+00 grossular 24 32.731 0.0000E+00 pyrophyllite 149 -6.176 0.0000E+00 anhydrite 25 -5.317 0.0000E+00 quartz 150 -2.989 0.5187E-02 ankerite 26 -2.135 0.0000E+00 rankinite 151 40.713 0.0000E+00 annite 27 20.123 0.0000E+00 ringwoodite-Fe 152 15.456 0.0000E+00 phlogopite 28 27.065 0.0000E+00 ringwoodite-Mg 153 27.575 0.0000E+00 biotite-Mn 29 32.960 0.0000E+00 rhodochrosite 154 -0.976 0.0000E+00 anorthite 30 12.710 0.0000E+00 rhodonite 155 7.446 0.0000E+00 anthophyllite 31 51.852 0.0000E+00 sanidine 156 -1.275 0.0000E+00 anthophyllite-Fe 32 29.306 0.0000E+00 sapphirine(351) 157 78.899 0.0000E+00 apatite-OH 33 -18.153 0.0000E+00 siderite 158 -2.608 0.0000E+00 apatite-F 34 -34.301 0.0000E+00 sillimanite 159 5.262 0.0000E+00 apatite-OH-zs 35 -12.736 0.0000E+00 sodalite 160 49.976 0.0000E+00 apatite-F-zs 36 -27.774 0.0000E+00 spinel 161 20.870 0.0000E+00 apatite-Cl-zs 37 -16.674 0.0000E+00 spurrite 162 59.482 0.0000E+00 aragonite 38 0.967 0.0000E+00 staurolite-Fe 163 73.598 0.0000E+00 brucite 39 12.569 0.0000E+00 staurolite-Mg 164 89.802 0.0000E+00 calcite 40 0.812 0.0000E+00 staurolite-Mn 165 83.909 0.0000E+00 carnegieite-low 41 9.023 0.0000E+00 stilbite 166 -7.522 0.0000E+00 carnegieite-high 42 10.093 0.0000E+00 stilpnomelane-Fe 167 13.017 0.0000E+00 carpholite-Mg 43 8.582 0.0000E+00 stilpnomelane-Mg 168 27.441 0.0000E+00 carpholite-Fe 44 6.713 0.0000E+00 stishovite 169 2.720 0.0000E+00 celadonite 45 5.342 0.0000E+00 sudoite-Fe 170 18.296 0.0000E+00 celadonite-Fe 46 3.877 0.0000E+00 sudoite 171 21.077 0.0000E+00 chrysotile 47 23.892 0.0000E+00 sulfur 172 -9.152 0.0000E+00 chondrodite 48 56.475 0.0000E+00 sylvite 173 1.338 0.0000E+00 clinochlore 49 39.070 0.0000E+00 talc 174 16.491 0.0000E+00 daphnite 50 28.965 0.0000E+00 talc-Fe 175 13.448 0.0000E+00 chlorite-Mn 51 46.869 0.0000E+00 talc-tschermaks 176 19.091 0.0000E+00 chlorite-Al-free 52 47.173 0.0000E+00 tephroite 177 18.086 0.0000E+00 chloritoid-Mg 53 13.198 0.0000E+00 tilleyite 178 41.377 0.0000E+00 chloritoid-Fe 54 9.174 0.0000E+00 titanite-CaSi 179 15.479 0.0000E+00 chloritoid-Mn 55 11.401 0.0000E+00 topaz-H 180 4.618 0.0000E+00 clinohumite 56 97.128 0.0000E+00 tridymite 181 -2.626 0.0000E+00 coesite 57 -2.376 0.0000E+00 tremolite 182 47.869 0.0000E+00 cordierite-H 58 23.715 0.0000E+00 ferroactinolite 183 38.452 0.0000E+00 cordierite 59 24.049 0.0000E+00 troilite-low 184 -4.411 0.0000E+00 cordierite-Fe 60 20.450 0.0000E+00 tschermakite 185 48.210 0.0000E+00 cordierite-Mn 61 25.066 0.0000E+00 vesuvianite 186 223.471 0.0000E+00 corundum 62 8.383 0.0000E+00 wadeite-Si 187 20.216 0.0000E+00 corundum-MgSi 63 18.891 0.0000E+00 wadsleyite-Fe 188 15.680 0.0000E+00 cristobalite 64 -2.560 0.0000E+00 wadsleyite-Mg 189 25.850 0.0000E+00 cummingtonite 65 52.099 0.0000E+00 wairakite 190 3.950 0.0000E+00 cymrite-K 66 1.685 0.0000E+00 walstromite 191 11.509 0.0000E+00 deerite 67 95.671 0.0000E+00 wollastonite 192 10.461 0.0000E+00 diaspore 68 2.874 0.0000E+00 pseudo-wollastonite 193 11.000 0.0000E+00 diamond 69 -3.102 0.0000E+00 zoisite 194 22.849 0.0000E+00 diopside 70 16.181 0.0000E+00 akaganeite 195 7.755 0.0000E+00 hedenbergite 71 14.208 0.0000E+00 beidellite-Ca 196 -1.646 0.0000E+00 dolomite,ordered 72 0.546 0.0000E+00 beidellite-H 197 -2.326 0.0000E+00 eastonite 73 28.489 0.0000E+00 beidellite-K 198 -1.520 0.0000E+00 enstatite 74 17.265 0.0000E+00 beidellite-Mg 199 -1.790 0.0000E+00 clinoenstatite-HiP 75 18.354 0.0000E+00 beidellite-Na 200 -1.342 0.0000E+00 clinoenstatite 76 17.166 0.0000E+00 calcium 201 84.026 0.0000E+00 protoenstatite 77 17.824 0.0000E+00 chalcedony 202 -2.802 0.0000E+00 epidote 78 24.670 0.0000E+00 dawsonite 203 1.682 0.0000E+00 clinozoisite 79 22.806 0.0000E+00 montmorillonite-Ca 204 -2.291 0.0000E+00 epidote-Fe 80 29.841 0.0000E+00 montmorillonite-K 205 -2.237 0.0000E+00 fayalite 81 14.046 0.0000E+00 montmorillonite-Mg 206 -2.480 0.0000E+00 ferrosilite 82 11.149 0.0000E+00 montmorillonite-Na 207 -2.038 0.0000E+00 forsterite 83 21.016 0.0000E+00 nontronite-Ca 208 3.215 0.0000E+00 gedrite 84 50.522 0.0000E+00 nontronite-H 209 2.533 0.0000E+00 gehlenite 85 36.628 0.0000E+00 nontronite-K 210 3.341 0.0000E+00 gibbsite 86 4.079 0.0000E+00 nontronite-Mg 211 3.075 0.0000E+00 glaucophane 87 22.975 0.0000E+00 nontronite-Na 212 3.520 0.0000E+00 glaucophane-Fe 88 17.276 0.0000E+00 sepiolite 213 24.118 0.0000E+00 graphite 89 -3.546 0.0000E+00 topaz 214 -16.546 0.0000E+00 greenalite 90 16.140 0.0000E+00 alite 215 57.999 0.0000E+00 grunerite 91 31.215 0.0000E+00 belite 216 30.433 0.0000E+00 halite 92 1.575 0.0000E+00 ettringite 217 43.232 0.0000E+00 hematite 93 12.566 0.0000E+00 gypsum 218 -4.955 0.0000E+00 heulandite 94 -5.827 0.0000E+00 hemicarboaluminate 219 70.954 0.0000E+00 hercynite 95 17.279 0.0000E+00 hydrogarnet 220 60.662 0.0000E+00 hollandite 96 25.673 0.0000E+00 hydrogarnet-Si 221 50.586 0.0000E+00 iron 97 19.086 0.0000E+00 jennite 222 24.367 0.0000E+00 jadeite 98 4.215 0.0000E+00 monosulfoaluminate 223 53.400 0.0000E+00 julgoldite 99 70.427 0.0000E+00 monocarboaluminate 224 61.898 0.0000E+00 kalsilite 100 7.584 0.0000E+00 portlandite 225 18.272 0.0000E+00 kaolinite 101 -1.333 0.0000E+00 stratlingite 226 36.502 0.0000E+00 kyanite 102 4.876 0.0000E+00 tricarboaluminate 227 70.370 0.0000E+00 larnite-bredigite 103 30.686 0.0000E+00 tobermorite 228 9.823 0.0000E+00 laumontite 104 2.883 0.0000E+00 C4AH13 229 81.816 0.0000E+00 lawsonite 105 9.616 0.0000E+00 C2AH8 230 45.203 0.0000E+00 leucite 106 4.119 0.0000E+00 C3A 231 86.953 0.0000E+00 lime 107 25.998 0.0000E+00 C4AF 232 117.416 0.0000E+00 lizardite 108 23.244 0.0000E+00 CAH10 233 28.335 0.0000E+00 magnesite 109 0.691 0.0000E+00 alabandite 234 -0.978 0.0000E+00 magnetite 110 20.087 0.0000E+00 alunite 235 -10.435 0.0000E+00 minnesotaite 111 10.388 0.0000E+00 artinite 236 15.121 0.0000E+00 minnesotaite-Mg 112 20.602 0.0000E+00 boehmite 237 4.406 0.0000E+00 magnesioferrite 113 26.212 0.0000E+00 dolomite,disordered 238 1.247 0.0000E+00 majorite 114 53.251 0.0000E+00 ferrous-oxide 239 9.812 0.0000E+00 manganosite 115 14.058 0.0000E+00 fluorite 240 -9.931 0.0000E+00 margarite 116 17.324 0.0000E+00 huntite 241 3.770 0.0000E+00 meionite 117 44.874 0.0000E+00 hydromagnesite 242 19.995 0.0000E+00 merwinite 118 55.930 0.0000E+00 nesquehonite 243 4.723 0.0000E+00 microcline 119 -2.486 0.0000E+00 potassium-oxide 244 69.038 0.0000E+00 monticellite 120 24.339 0.0000E+00 silica-amorphous 245 -2.091 0.0000E+00 mullite-Al 121 363.148 0.0000E+00 sodium-oxide 246 55.169 0.0000E+00 mullite-Si 122 7.264 0.0000E+00 an20ab80 247 2.018 0.0000E+00 muscovite 123 2.582 0.0000E+00 an25ab75 248 2.646 0.0000E+00 paragonite 124 4.239 0.0000E+00 an30ab70 249 3.279 0.0000E+00 nepheline 125 8.339 0.0000E+00 tr.625ac.25prg.125 250 45.165 0.0000E+00 Initial composition of reactant (mole%): H2O 88.87 HCl 0.5900 CO2 7.070 CO 0.1600 H2 1.540 S2 0.8000E-01 SO2 1.150 HF 0.4000E-01 H2S 1.120 0.000 Sum of wt% of reactants: 100.6200 Reactant consumed: 0.0799900 moles log = -1.0970 Original solution: 1000.0103000 g Original solution / Rock added: 12501.69 (Water/Rock Ratio), log = 4.0970 The following minerals and/or gases with identical index are in solid solution: H2O,gas 6 CO2,gas 6 CH4,gas 6 H2,gas 6 H2S,gas 6 S2,gas 6 CO,gas 6 SO3,gas 6 SO2,gas 6 HF,gas 6 HCl,gas 6 almandine 16 pyrope 16 spessartine 16 andradite 8 grossular 8 annite 15 phlogopite 15 biotite-Mn 15 clinochlore 1 daphnite 1 chlorite-Mn 1 diopside 5 hedenbergite 5 epidote 3 clinozoisite 3 iron 9 magnetite 14 talc 7 talc-Fe 7 tremolite 2 ferroactinolite 2 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 11 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0799900 Water: Moles liquid = 0.4993E+02 kg liquid = 0.8994E+00 Moles total = 0.4991E+02 kg total = 0.8992E+00 Activity = 1.0000 Stoichiometric ionic strength = .1650748E-01 Osmotic coef. = 0.9260 True ionic strength = .2416375E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6098E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.25629E-09 -9.5913 0.21281E-09 -9.6720 0.83033E+00 -0.0808 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.67483E-03 -3.1708 0.55643E-03 -3.2546 0.82455E+00 -0.0838 4 SO4-- 0.40757E-03 -3.3898 0.20124E-03 -3.6963 0.49377E+00 -0.3065 5 HCO3- 0.38163E-02 -2.4184 0.31521E-02 -2.5014 0.82595E+00 -0.0830 6 HS- 0.17804E-02 -2.7495 0.14683E-02 -2.8332 0.82469E+00 -0.0837 7 Al+++ 0.22142E-27 -27.6548 0.45562E-28 -28.3414 0.20577E+00 -0.6866 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24929E-07 -7.6033 0.12204E-07 -7.9135 0.48956E+00 -0.3102 10 Mg++ 0.22168E-10 -10.6543 0.10795E-10 -10.9668 0.48697E+00 -0.3125 11 Fe++ 0.23183E-12 -12.6348 0.11304E-12 -12.9468 0.48759E+00 -0.3119 12 K+ 0.15627E-03 -3.8061 0.12911E-03 -3.8890 0.82617E+00 -0.0829 13 Na+ 0.20973E-01 -1.6783 0.17290E-01 -1.7622 0.82437E+00 -0.0839 14 Mn++ 0.11887E-09 -9.9249 0.58017E-10 -10.2364 0.48805E+00 -0.3115 15 F- 0.35567E-04 -4.4490 0.29257E-04 -4.5338 0.82260E+00 -0.0848 16 HPO4-- 0.45844E-07 -7.3387 0.22640E-07 -7.6451 0.49385E+00 -0.3064 18 HSiO3- 0.54524E-02 -2.2634 0.44958E-02 -2.3472 0.82455E+00 -0.0838 19 Ca(HSiO3)+ 0.15121E-08 -8.8204 0.12495E-08 -8.9033 0.82638E+00 -0.0828 20 Mg(HSiO3)+ 0.16645E-11 -11.7787 0.13755E-11 -11.8615 0.82638E+00 -0.0828 21 NaHSiO3,aq 0.12572E-02 -2.9006 0.12572E-02 -2.9006 0.10000E+01 0.0000 22 AlO+ 0.16562E-15 -15.7809 0.13687E-15 -15.8637 0.82638E+00 -0.0828 24 HAlO2,aq 0.12808E-09 -9.8925 0.12808E-09 -9.8925 0.10000E+01 0.0000 25 AlO2- 0.16191E-05 -5.7907 0.13323E-05 -5.8754 0.82284E+00 -0.0847 26 CH4,aq 0.22451E-07 -7.6488 0.22339E-07 -7.6509 0.99501E+00 -0.0022 27 C2H6,aq 0.52291E-18 -18.2816 0.52030E-18 -18.2837 0.99501E+00 -0.0022 31 CO,aq 0.59038E-14 -14.2289 0.59038E-14 -14.2289 0.10000E+01 0.0000 32 CO2,aq 0.14405E-05 -5.8415 0.14333E-05 -5.8437 0.99501E+00 -0.0022 33 CO3-2 0.26266E-02 -2.5806 0.12937E-02 -2.8882 0.49256E+00 -0.3075 34 CaCO3,aq 0.19798E-06 -6.7034 0.19798E-06 -6.7034 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.11882E-08 -8.9251 0.98194E-09 -9.0079 0.82638E+00 -0.0828 36 CaCl+ 0.13299E-10 -10.8762 0.10990E-10 -10.9590 0.82638E+00 -0.0828 37 CaCl2,aq 0.14528E-14 -14.8378 0.14528E-14 -14.8378 0.10000E+01 0.0000 38 CaF+ 0.63083E-11 -11.2001 0.52131E-11 -11.2829 0.82638E+00 -0.0828 39 CaOH+ 0.49459E-08 -8.3058 0.40872E-08 -8.3886 0.82638E+00 -0.0828 40 CaSO4,aq 0.77990E-09 -9.1080 0.77990E-09 -9.1080 0.10000E+01 0.0000 41 HCl,aq 0.21699E-13 -13.6636 0.21699E-13 -13.6636 0.10000E+01 0.0000 45 HF,aq 0.42622E-10 -10.3704 0.42622E-10 -10.3704 0.10000E+01 0.0000 46 HF2- 0.51060E-15 -15.2919 0.42102E-15 -15.3757 0.82455E+00 -0.0838 48 FeCl+ 0.12048E-15 -15.9191 0.99558E-16 -16.0019 0.82638E+00 -0.0828 51 FeF+ 0.20451E-15 -15.6893 0.16900E-15 -15.7721 0.82638E+00 -0.0828 53 FeO,aq 0.97010E-10 -10.0132 0.97010E-10 -10.0132 0.10000E+01 0.0000 54 FeOH+ 0.20923E-10 -10.6794 0.17290E-10 -10.7622 0.82638E+00 -0.0828 55 HFeO2- 0.57846E-08 -8.2377 0.47697E-08 -8.3215 0.82455E+00 -0.0838 56 FeO+ 0.12325E-15 -15.9092 0.10185E-15 -15.9920 0.82638E+00 -0.0828 58 FeO2- 0.55809E-09 -9.2533 0.46018E-09 -9.3371 0.82455E+00 -0.0838 59 HFeO2,aq 0.12455E-10 -10.9047 0.12455E-10 -10.9047 0.10000E+01 0.0000 60 H2,aq 0.16479E-06 -6.7831 0.16397E-06 -6.7852 0.99501E+00 -0.0022 61 KCl,aq 0.13021E-08 -8.8854 0.13021E-08 -8.8854 0.10000E+01 0.0000 62 KHSO4,aq 0.15633E-16 -16.8059 0.15633E-16 -16.8059 0.10000E+01 0.0000 63 KOH,aq 0.25909E-06 -6.5865 0.25909E-06 -6.5865 0.10000E+01 0.0000 64 KSO4- 0.48897E-06 -6.3107 0.40318E-06 -6.3945 0.82455E+00 -0.0838 65 MgCO3,aq 0.43895E-10 -10.3576 0.43895E-10 -10.3576 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.10740E-11 -11.9690 0.88752E-12 -12.0518 0.82638E+00 -0.0828 67 MgCl+ 0.10661E-13 -13.9722 0.88104E-14 -14.0550 0.82638E+00 -0.0828 68 MgF+ 0.20670E-13 -13.6847 0.17081E-13 -13.7675 0.82638E+00 -0.0828 69 MgOH+ 0.24208E-10 -10.6160 0.20005E-10 -10.6989 0.82638E+00 -0.0828 71 MnF+ 0.34597E-13 -13.4610 0.28590E-13 -13.5438 0.82638E+00 -0.0828 72 MnO,aq 0.13267E-08 -8.8772 0.13267E-08 -8.8772 0.10000E+01 0.0000 73 MnOH+ 0.99760E-09 -9.0010 0.82439E-09 -9.0839 0.82638E+00 -0.0828 74 MnO2-2 0.19738E-11 -11.7047 0.97223E-12 -12.0122 0.49256E+00 -0.3075 75 HMnO2- 0.54973E-10 -10.2599 0.45328E-10 -10.3436 0.82455E+00 -0.0838 78 MnCl+ 0.24056E-12 -12.6188 0.19879E-12 -12.7016 0.82638E+00 -0.0828 79 MnSO4,aq 0.33707E-11 -11.4723 0.33707E-11 -11.4723 0.10000E+01 0.0000 80 NaCl,aq 0.31883E-05 -5.4964 0.31883E-05 -5.4964 0.10000E+01 0.0000 81 NaF,aq 0.11843E-06 -6.9265 0.11843E-06 -6.9265 0.10000E+01 0.0000 82 NaOH,aq 0.34907E-04 -4.4571 0.34907E-04 -4.4571 0.10000E+01 0.0000 84 OH- 0.32996E-02 -2.4815 0.27150E-02 -2.5662 0.82284E+00 -0.0847 89 HPO3-2 0.23487E-16 -16.6292 0.11568E-16 -16.9367 0.49256E+00 -0.3075 92 H3PO4,aq 0.71709E-17 -17.1444 0.71709E-17 -17.1444 0.10000E+01 0.0000 93 H2PO4- 0.10767E-09 -9.9679 0.88878E-10 -10.0512 0.82546E+00 -0.0833 94 PO4-3 0.39853E-09 -9.3995 0.86800E-10 -10.0615 0.21780E+00 -0.6619 98 HP2O7-3 0.28209E-17 -17.5496 0.58117E-18 -18.2357 0.20602E+00 -0.6861 99 P2O7-4 0.10348E-16 -16.9851 0.65241E-18 -18.1855 0.63048E-01 -1.2003 100 H2S,aq 0.97054E-06 -6.0130 0.96570E-06 -6.0152 0.99501E+00 -0.0022 101 S2-2 0.59147E-09 -9.2281 0.29133E-09 -9.5356 0.49256E+00 -0.3075 102 S3-2 0.46932E-14 -14.3285 0.23117E-14 -14.6361 0.49256E+00 -0.3075 103 S3- 0.98763E-18 -18.0054 0.81436E-18 -18.0892 0.82455E+00 -0.0838 104 S4-2 0.24599E-19 -19.6091 0.12117E-19 -19.9166 0.49256E+00 -0.3075 107 SO3-2 0.85623E-11 -11.0674 0.42880E-11 -11.3677 0.50080E+00 -0.3003 108 HSO3- 0.69292E-13 -13.1593 0.57135E-13 -13.2431 0.82455E+00 -0.0838 109 HSO4- 0.49887E-10 -10.3020 0.41273E-10 -10.3843 0.82732E+00 -0.0823 111 S2O3-2 0.46348E-11 -11.3340 0.22829E-11 -11.6415 0.49256E+00 -0.3075 112 HS2O3- 0.10535E-18 -18.9774 0.86865E-19 -19.0612 0.82455E+00 -0.0838 Charge balance for all species = -.6123E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2562941E-09 -.1267520E-01 -.1275414E+02 0.0000 2 H2O 0.1000000E+01 0.5550488E+02 0.9982382E+06 0.0000 3 Cl- 0.6748297E-03 0.6780193E-03 0.2399698E+02 6.4174 4 SO4-- 0.4075697E-03 0.4079961E-03 0.3912617E+02 15.6477 5 HCO3- 0.3816269E-02 0.6444528E-02 0.3925590E+03 7.1706 6 HS- 0.1780385E-02 0.1781420E-02 0.5881503E+02 6.8388 7 Al+++ 0.2214217E-27 0.1619267E-05 0.4361604E-01 0.6746 8 H4SiO4 0.1024625E-02 0.7734167E-02 0.7421096E+03 -2.9894 9 Ca++ 0.2492887E-07 0.2313526E-06 0.9256396E-02 11.4305 10 Mg++ 0.2216803E-10 0.9304122E-10 0.2258175E-05 8.3773 11 Fe++ 0.2318336E-12 0.6473278E-08 0.3608990E-03 6.3973 12 K+ 0.1562731E-03 0.1570225E-03 0.6129462E+01 5.7830 13 Na+ 0.2097317E-01 0.2226857E-01 0.5110802E+03 7.9098 14 Mn++ 0.1188744E-09 0.2503764E-08 0.1373181E-03 9.1076 15 F- 0.3556668E-04 0.3568516E-04 0.6767948E+00 5.1382 16 HPO4-- 0.4584380E-07 0.4635000E-07 0.4441069E-02 11.6989 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1141362E-01 -.1140035E-01 -.1326910E-04 0.0000000E+00 2 H2O 0.4991190E+02 0.4992228E+02 -.1038688E-01 0.0000000E+00 3 Cl- 0.6098252E-03 0.6098252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.3669672E-03 0.3669605E-03 0.6692516E-08 0.0000000E+00 5 HCO3- 0.5796347E-02 0.5796347E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.1602294E-02 0.1602247E-02 0.4684761E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1456404E-05 0.3318948E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.6956277E-02 0.5196743E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.5822205E-08 0.2677006E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002883E-01 0.3318948E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3209600E-04 0.3209600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.900952E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3319E-05 -5.479 0.8703E-03 -3.060 0.2785 0.3341E-03 pyrite 0.2677E-07 -7.572 0.3212E-05 -5.493 0.1028E-02 0.6408E-06 quartz 0.5187E-02 -2.285 0.3116 -0.506 99.72 0.1177 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.312496 g Volume = 0.118017 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0799900 moles log = -1.0970 Original solution: 1000.0103000 g Original solution / Rock added: 12501.69 (Water/Rock Ratio), log = 4.0970 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0207 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9996E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1492E-03 1.0071 0.1533E-03 0.1523E-03 CH4,gas 0.3182E-04 1.0125 0.3288E-04 0.3247E-04 H2,gas 0.2108E-03 1.0005 0.2153E-03 0.2152E-03 H2S,gas 0.2611E-04 0.9960 0.2655E-04 0.2665E-04 S2,gas 0.5592E-21 1.0000 0.5708E-21 0.5708E-21 CO,gas 0.8619E-11 1.0000 0.8798E-11 0.8798E-11 SO3,gas 0.3376E-38 1.0000 0.3446E-38 0.3446E-38 SO2,gas 0.2827E-19 1.0000 0.2886E-19 0.2886E-19 HF,gas 0.1025E-12 1.0000 0.1047E-12 0.1047E-12 HCl,gas 0.3751E-16 1.0000 0.3829E-16 0.3829E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.13080E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.17 -5.51 -1.838 0.94138E+04 -3.814 3 CH4,gas 4.54 -1.64 -6.18 -1.546 0.10556E+05 -4.483 4 H2,gas 8.00 2.63 -5.37 -3.066 0.91623E+04 -3.667 5 H2S,gas -6.23 -12.51 -6.27 -3.137 0.10714E+05 -4.576 6 S2,gas -7.34 -30.28 -22.94 -3.530 0.39174E+05 -21.244 7 CO,gas 3.21 -9.54 -12.75 -3.924 0.21778E+05 -11.056 8 SO3,gas 17.12 -23.04 -40.16 -10.040 0.68575E+05 -38.463 9 SO2,gas 0.83 -20.41 -21.24 -5.664 0.36264E+05 -19.540 10 HF,gas 0.47 -14.21 -14.68 -7.340 0.25064E+05 -12.980 11 HCl,gas 5.19 -12.93 -18.12 -9.058 0.30932E+05 -16.417 12 acmite 7.71 7.01 -0.70 -0.073 0.11925E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.70 -4.75 -0.238 0.81167E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 23 andradite 39.01 35.48 -3.52 -0.183 0.60184E+04 26 ankerite -2.14 -6.52 -4.38 -0.731 0.74855E+04 27 annite 20.12 16.68 -3.44 -0.191 0.58777E+04 28 phlogopite 27.06 22.62 -4.44 -0.247 0.75872E+04 34 apatite-F -34.30 -38.02 -3.72 -0.310 0.63511E+04 38 aragonite 0.97 -0.74 -1.71 -0.570 0.29188E+04 39 brucite 12.57 8.38 -4.19 -0.838 0.71566E+04 40 calcite 0.81 -0.74 -1.55 -0.518 0.26545E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.75 -4.83 -0.322 0.82547E+04 44 carpholite-Fe 6.71 1.77 -4.94 -0.330 0.84434E+04 45 celadonite 5.34 2.88 -2.46 -0.145 0.42080E+04 46 celadonite-Fe 3.88 0.90 -2.98 -0.175 0.50873E+04 47 chrysotile 23.89 19.15 -4.74 -0.395 0.80926E+04 49 clinochlore 39.07 34.27 -4.80 -0.150 0.81998E+04 50 daphnite 28.97 24.37 -4.60 -0.144 0.78510E+04 54 chloritoid-Fe 9.17 4.76 -4.42 -0.294 0.75411E+04 55 chloritoid-Mn 11.40 7.47 -3.93 -0.262 0.67166E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.51 -4.20 -0.350 0.71647E+04 68 diaspore 2.87 0.67 -2.20 -0.367 0.37548E+04 69 diamond -3.10 -6.91 -3.80 -1.087 0.64943E+04 70 diopside 16.18 13.83 -2.35 -0.235 0.40167E+04 71 hedenbergite 14.21 11.85 -2.36 -0.236 0.40285E+04 78 epidote 24.67 20.32 -4.35 -0.211 0.74233E+04 81 fayalite 14.05 9.81 -4.24 -0.606 0.72408E+04 82 ferrosilite 11.15 6.82 -4.33 -0.433 0.73999E+04 86 gibbsite 4.08 0.67 -3.40 -0.486 0.58134E+04 87 glaucophane 22.97 18.39 -4.59 -0.124 0.78367E+04 88 glaucophane-Fe 17.28 12.45 -4.83 -0.131 0.82482E+04 89 graphite -3.55 -6.91 -3.36 -0.960 0.57366E+04 90 greenalite 16.14 13.21 -2.93 -0.244 0.49971E+04 93 hematite 12.57 10.16 -2.41 -0.292 0.41072E+04 94 heulandite -5.83 -8.15 -2.32 -0.105 0.39596E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.47 -4.12 -0.588 0.70275E+04 101 kaolinite -1.33 -4.63 -3.30 -0.300 0.56292E+04 104 laumontite 2.88 0.82 -2.06 -0.137 0.35197E+04 105 lawsonite 9.62 6.80 -2.82 -0.188 0.48068E+04 106 leucite 4.12 0.48 -3.64 -0.364 0.62154E+04 108 lizardite 23.24 19.15 -4.09 -0.341 0.69852E+04 109 magnesite 0.69 -3.80 -4.49 -1.496 0.76610E+04 110 magnetite 20.09 16.56 -3.53 -0.288 0.60264E+04 111 minnesotaite 10.39 7.23 -3.15 -0.186 0.53855E+04 115 manganosite 14.06 9.11 -4.95 -1.238 0.84529E+04 119 microcline -2.49 -2.51 -0.02 -0.002 0.41329E+02 123 muscovite 2.58 -1.16 -3.74 -0.220 0.63925E+04 124 paragonite 4.24 0.97 -3.27 -0.193 0.55903E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 137 phlogopite-Na 29.65 24.75 -4.90 -0.272 0.83647E+04 139 prehnite 19.37 15.24 -4.13 -0.243 0.70516E+04 140 prehnite-Fe 22.50 19.65 -2.85 -0.171 0.48665E+04 146 pyrrhotite -4.26 -6.11 -1.85 -0.616 0.31548E+04 147 pyrrhotiteFe0.875 -6.02 -7.23 -1.22 -0.448 0.20784E+04 148 pyroxmangite 7.40 6.12 -1.28 -0.256 0.21865E+04 149 pyrophyllite -6.18 -10.61 -4.43 -0.277 0.75687E+04 154 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.35678E+04 155 rhodonite 7.45 6.12 -1.33 -0.266 0.22667E+04 156 sanidine -1.28 -2.51 -1.24 -0.095 0.21091E+04 158 siderite -2.61 -5.78 -3.17 -1.056 0.54093E+04 166 stilbite -7.52 -8.15 -0.62 -0.030 0.10658E+04 167 stilpnomelane-Fe 13.02 12.31 -0.71 -0.021 0.12045E+04 174 talc 16.49 13.17 -3.32 -0.195 0.56638E+04 177 tephroite 18.09 15.23 -2.86 -0.409 0.48835E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.11 -1.70 -0.566 0.28976E+04 190 wairakite 3.95 0.82 -3.13 -0.184 0.53416E+04 191 walstromite 11.51 8.44 -3.07 -0.614 0.52387E+04 192 wollastonite 10.46 8.44 -2.02 -0.404 0.34492E+04 193 pseudo-wollastonite 11.00 8.44 -2.56 -0.512 0.43690E+04 195 akaganeite 7.75 5.08 -2.67 -0.578 0.45662E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 204 montmorillonite-Ca -2.29 -6.18 -3.89 -0.241 0.66418E+04 205 montmorillonite-K -2.24 -6.16 -3.92 -0.240 0.66959E+04 206 montmorillonite-Mg -2.48 -6.68 -4.20 -0.260 0.71790E+04 207 montmorillonite-Na -2.04 -5.46 -3.42 -0.209 0.58371E+04 208 nontronite-Ca 3.21 1.30 -1.92 -0.124 0.32721E+04 209 nontronite-H 2.53 -0.59 -3.12 -0.209 0.53283E+04 210 nontronite-K 3.34 1.32 -2.02 -0.130 0.34494E+04 211 nontronite-Mg 3.07 0.79 -2.28 -0.148 0.38934E+04 212 nontronite-Na 3.52 2.02 -1.50 -0.096 0.25566E+04 228 tobermorite 9.82 6.53 -3.29 -0.898 0.56190E+04 234 alabandite -0.98 -3.40 -2.42 -0.807 0.41317E+04 237 boehmite 4.41 0.67 -3.73 -0.622 0.63718E+04 239 ferrous-oxide 9.81 6.40 -3.41 -0.854 0.58299E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.96 -0.074 0.16472E+04 248 an25ab75 2.65 1.41 -1.23 -0.095 0.21059E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25743E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.0799900 MOLES New total amount of reactant added: 0.0839900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0839900 Water: Moles liquid = 0.4993E+02 kg liquid = 0.8995E+00 Moles total = 0.4992E+02 kg total = 0.8992E+00 Activity = 1.0000 Stoichiometric ionic strength = .1676683E-01 Osmotic coef. = 0.9254 True ionic strength = .2429255E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6334E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.27067E-09 -9.5676 0.22467E-09 -9.6485 0.83004E+00 -0.0809 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.70089E-03 -3.1544 0.57770E-03 -3.2383 0.82425E+00 -0.0839 4 SO4-- 0.42875E-03 -3.3678 0.21139E-03 -3.6749 0.49304E+00 -0.3071 5 HCO3- 0.40926E-02 -2.3880 0.33791E-02 -2.4712 0.82565E+00 -0.0832 6 HS- 0.18670E-02 -2.7289 0.15391E-02 -2.8127 0.82439E+00 -0.0839 7 Al+++ 0.27528E-27 -27.5602 0.56453E-28 -28.2483 0.20508E+00 -0.6881 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24658E-07 -7.6080 0.12053E-07 -7.9189 0.48883E+00 -0.3108 10 Mg++ 0.22336E-10 -10.6510 0.10860E-10 -10.9642 0.48623E+00 -0.3132 11 Fe++ 0.20835E-12 -12.6812 0.10144E-12 -12.9938 0.48685E+00 -0.3126 12 K+ 0.15625E-03 -3.8062 0.12904E-03 -3.8893 0.82587E+00 -0.0831 13 Na+ 0.21036E-01 -1.6770 0.17335E-01 -1.7611 0.82406E+00 -0.0840 14 Mn++ 0.12921E-09 -9.8887 0.62967E-10 -10.2009 0.48731E+00 -0.3122 15 F- 0.37337E-04 -4.4279 0.30701E-04 -4.5128 0.82228E+00 -0.0850 16 HPO4-- 0.45855E-07 -7.3386 0.22612E-07 -7.6457 0.49312E+00 -0.3070 18 HSiO3- 0.51664E-02 -2.2868 0.42584E-02 -2.3708 0.82425E+00 -0.0839 19 Ca(HSiO3)+ 0.14150E-08 -8.8492 0.11689E-08 -8.9322 0.82608E+00 -0.0830 20 Mg(HSiO3)+ 0.15868E-11 -11.7995 0.13108E-11 -11.8825 0.82608E+00 -0.0830 21 NaHSiO3,aq 0.11939E-02 -2.9230 0.11939E-02 -2.9230 0.10000E+01 0.0000 22 AlO+ 0.18418E-15 -15.7347 0.15215E-15 -15.8177 0.82608E+00 -0.0830 24 HAlO2,aq 0.13487E-09 -9.8701 0.13487E-09 -9.8701 0.10000E+01 0.0000 25 AlO2- 0.16155E-05 -5.7917 0.13288E-05 -5.8765 0.82252E+00 -0.0849 26 CH4,aq 0.24020E-07 -7.6194 0.23898E-07 -7.6216 0.99493E+00 -0.0022 27 C2H6,aq 0.60699E-18 -18.2168 0.60392E-18 -18.2190 0.99493E+00 -0.0022 31 CO,aq 0.65883E-14 -14.1812 0.65883E-14 -14.1812 0.10000E+01 0.0000 32 CO2,aq 0.16304E-05 -5.7877 0.16222E-05 -5.7899 0.99493E+00 -0.0022 33 CO3-2 0.26711E-02 -2.5733 0.13137E-02 -2.8815 0.49183E+00 -0.3082 34 CaCO3,aq 0.19855E-06 -6.7021 0.19855E-06 -6.7021 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.12585E-08 -8.9001 0.10396E-08 -8.9831 0.82608E+00 -0.0830 36 CaCl+ 0.13641E-10 -10.8651 0.11269E-10 -10.9481 0.82608E+00 -0.0830 37 CaCl2,aq 0.15466E-14 -14.8106 0.15466E-14 -14.8106 0.10000E+01 0.0000 38 CaF+ 0.65403E-11 -11.1844 0.54028E-11 -11.2674 0.82608E+00 -0.0830 39 CaOH+ 0.46285E-08 -8.3346 0.38235E-08 -8.4175 0.82608E+00 -0.0830 40 CaSO4,aq 0.80910E-09 -9.0920 0.80910E-09 -9.0920 0.10000E+01 0.0000 41 HCl,aq 0.23784E-13 -13.6237 0.23784E-13 -13.6237 0.10000E+01 0.0000 45 HF,aq 0.47219E-10 -10.3259 0.47219E-10 -10.3259 0.10000E+01 0.0000 46 HF2- 0.59381E-15 -15.2263 0.48945E-15 -15.3103 0.82425E+00 -0.0839 48 FeCl+ 0.11228E-15 -15.9497 0.92753E-16 -16.0327 0.82608E+00 -0.0830 51 FeF+ 0.19265E-15 -15.7152 0.15914E-15 -15.7982 0.82608E+00 -0.0830 53 FeO,aq 0.78103E-10 -10.1073 0.78103E-10 -10.1073 0.10000E+01 0.0000 54 FeOH+ 0.17791E-10 -10.7498 0.14696E-10 -10.8328 0.82608E+00 -0.0830 55 HFeO2- 0.44129E-08 -8.3553 0.36373E-08 -8.4392 0.82425E+00 -0.0839 56 FeO+ 0.10553E-15 -15.9766 0.87180E-16 -16.0596 0.82608E+00 -0.0830 58 FeO2- 0.42876E-09 -9.3678 0.35341E-09 -9.4517 0.82425E+00 -0.0839 59 HFeO2,aq 0.10098E-10 -10.9957 0.10098E-10 -10.9957 0.10000E+01 0.0000 60 H2,aq 0.16250E-06 -6.7892 0.16167E-06 -6.7914 0.99493E+00 -0.0022 61 KCl,aq 0.13511E-08 -8.8693 0.13511E-08 -8.8693 0.10000E+01 0.0000 62 KHSO4,aq 0.17328E-16 -16.7612 0.17328E-16 -16.7612 0.10000E+01 0.0000 63 KOH,aq 0.24529E-06 -6.6103 0.24529E-06 -6.6103 0.10000E+01 0.0000 64 KSO4- 0.51356E-06 -6.2894 0.42330E-06 -6.3734 0.82425E+00 -0.0839 65 MgCO3,aq 0.44842E-10 -10.3483 0.44842E-10 -10.3483 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.11587E-11 -11.9360 0.95720E-12 -12.0190 0.82608E+00 -0.0830 67 MgCl+ 0.11140E-13 -13.9531 0.92026E-14 -14.0361 0.82608E+00 -0.0830 68 MgF+ 0.21830E-13 -13.6610 0.18033E-13 -13.7439 0.82608E+00 -0.0830 69 MgOH+ 0.23077E-10 -10.6368 0.19064E-10 -10.7198 0.82608E+00 -0.0830 71 MnF+ 0.39417E-13 -13.4043 0.32561E-13 -13.4873 0.82608E+00 -0.0830 72 MnO,aq 0.12919E-08 -8.8888 0.12919E-08 -8.8888 0.10000E+01 0.0000 73 MnOH+ 0.10259E-08 -8.9889 0.84748E-09 -9.0719 0.82608E+00 -0.0830 74 MnO2-2 0.17270E-11 -11.7627 0.84937E-12 -12.0709 0.49183E+00 -0.3082 75 HMnO2- 0.50722E-10 -10.2948 0.41807E-10 -10.3787 0.82425E+00 -0.0839 78 MnCl+ 0.27116E-12 -12.5668 0.22400E-12 -12.6498 0.82608E+00 -0.0830 79 MnSO4,aq 0.38427E-11 -11.4154 0.38427E-11 -11.4154 0.10000E+01 0.0000 80 NaCl,aq 0.33189E-05 -5.4790 0.33189E-05 -5.4790 0.10000E+01 0.0000 81 NaF,aq 0.12460E-06 -6.9045 0.12460E-06 -6.9045 0.10000E+01 0.0000 82 NaOH,aq 0.33151E-04 -4.4795 0.33151E-04 -4.4795 0.10000E+01 0.0000 84 OH- 0.31266E-02 -2.5049 0.25717E-02 -2.5898 0.82252E+00 -0.0849 89 HPO3-2 0.23164E-16 -16.6352 0.11393E-16 -16.9434 0.49183E+00 -0.3082 92 H3PO4,aq 0.79828E-17 -17.0978 0.79828E-17 -17.0978 0.10000E+01 0.0000 93 H2PO4- 0.11358E-09 -9.9447 0.93717E-10 -10.0282 0.82515E+00 -0.0835 94 PO4-3 0.37821E-09 -9.4223 0.82116E-10 -10.0856 0.21712E+00 -0.6633 98 HP2O7-3 0.29808E-17 -17.5257 0.61205E-18 -18.2132 0.20533E+00 -0.6875 99 P2O7-4 0.10383E-16 -16.9837 0.65081E-18 -18.1865 0.62680E-01 -1.2029 100 H2S,aq 0.10742E-05 -5.9689 0.10687E-05 -5.9711 0.99493E+00 -0.0022 101 S2-2 0.66010E-09 -9.1804 0.32466E-09 -9.4886 0.49183E+00 -0.3082 102 S3-2 0.58787E-14 -14.2307 0.28913E-14 -14.5389 0.49183E+00 -0.3082 103 S3- 0.13138E-17 -17.8815 0.10829E-17 -17.9654 0.82425E+00 -0.0839 104 S4-2 0.34584E-19 -19.4611 0.17009E-19 -19.7693 0.49183E+00 -0.3082 107 SO3-2 0.88808E-11 -11.0515 0.44412E-11 -11.3525 0.50010E+00 -0.3009 108 HSO3- 0.75797E-13 -13.1203 0.62476E-13 -13.2043 0.82425E+00 -0.0839 109 HSO4- 0.55344E-10 -10.2569 0.45770E-10 -10.3394 0.82702E+00 -0.0825 111 S2O3-2 0.53958E-11 -11.2679 0.26538E-11 -11.5761 0.49183E+00 -0.3082 112 HS2O3- 0.12934E-18 -18.8883 0.10661E-18 -18.9722 0.82425E+00 -0.0839 Charge balance for all species = -.6123E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2706731E-09 -.1219541E-01 -.1227141E+02 0.0000 2 H2O 0.1000000E+01 0.5550505E+02 0.9982458E+06 0.0000 3 Cl- 0.7008853E-03 0.7042056E-03 0.2492390E+02 6.4102 4 SO4-- 0.4287494E-03 0.4291994E-03 0.4115972E+02 15.6220 5 HCO3- 0.4092642E-02 0.6765560E-02 0.4121160E+03 7.1773 6 HS- 0.1866971E-02 0.1868111E-02 0.6167747E+02 6.8357 7 Al+++ 0.2752756E-27 0.1615634E-05 0.4351836E-01 0.6970 8 H4SiO4 0.1024625E-02 0.7385000E-02 0.7086095E+03 -2.9894 9 Ca++ 0.2465764E-07 0.2313352E-06 0.9255744E-02 11.3780 10 Mg++ 0.2233629E-10 0.9303424E-10 0.2258016E-05 8.3328 11 Fe++ 0.2083526E-12 0.4947879E-08 0.2758560E-03 6.3031 12 K+ 0.1562505E-03 0.1570107E-03 0.6129030E+01 5.7592 13 Na+ 0.2103635E-01 0.2226690E-01 0.5110441E+03 7.8874 14 Mn++ 0.1292112E-09 0.2503576E-08 0.1373084E-03 9.0960 15 F- 0.3733661E-04 0.3746127E-04 0.7104833E+00 5.1356 16 HPO4-- 0.4585473E-07 0.4634652E-07 0.4440756E-02 11.6513 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1098292E-01 -.1096964E-01 -.1328139E-04 0.0000000E+00 2 H2O 0.4991517E+02 0.4992619E+02 -.1101397E-01 0.0000000E+00 3 Cl- 0.6334252E-03 0.6334252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.3860672E-03 0.3860602E-03 0.7035427E-08 0.0000000E+00 5 HCO3- 0.6085547E-02 0.6085547E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.1680394E-02 0.1680345E-02 0.4924799E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1453245E-05 0.3322107E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.6642726E-02 0.5510294E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.4450563E-08 0.2814171E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002883E-01 0.3322107E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3369600E-04 0.3369600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.901016E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0839900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3322E-05 -5.479 0.8711E-03 -3.060 0.2629 0.3344E-03 pyrite 0.2814E-07 -7.551 0.3376E-05 -5.472 0.1019E-02 0.6737E-06 quartz 0.5500E-02 -2.260 0.3305 -0.481 99.74 0.1248 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.331334 g Volume = 0.125131 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0839900 moles log = -1.0758 Original solution: 1000.0103000 g Original solution / Rock added: 11906.30 (Water/Rock Ratio), log = 4.0758 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0208 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9996E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1688E-03 1.0071 0.1736E-03 0.1723E-03 CH4,gas 0.3404E-04 1.0125 0.3518E-04 0.3474E-04 H2,gas 0.2078E-03 1.0005 0.2123E-03 0.2121E-03 H2S,gas 0.2890E-04 0.9960 0.2938E-04 0.2949E-04 S2,gas 0.7044E-21 1.0000 0.7191E-21 0.7191E-21 CO,gas 0.9618E-11 1.0000 0.9818E-11 0.9818E-11 SO3,gas 0.3952E-38 1.0000 0.4034E-38 0.4034E-38 SO2,gas 0.3264E-19 1.0000 0.3332E-19 0.3332E-19 HF,gas 0.1136E-12 1.0000 0.1159E-12 0.1159E-12 HCl,gas 0.4111E-16 1.0000 0.4197E-16 0.4197E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.12 -5.46 -1.820 0.93220E+04 -3.761 3 CH4,gas 4.54 -1.61 -6.15 -1.538 0.10506E+05 -4.454 4 H2,gas 8.00 2.63 -5.37 -3.070 0.91727E+04 -3.673 5 H2S,gas -6.23 -12.46 -6.23 -3.115 0.10639E+05 -4.532 6 S2,gas -7.34 -30.18 -22.84 -3.514 0.39002E+05 -21.143 7 CO,gas 3.21 -9.49 -12.71 -3.910 0.21697E+05 -11.008 8 SO3,gas 17.12 -22.97 -40.09 -10.023 0.68458E+05 -38.394 9 SO2,gas 0.83 -20.34 -21.18 -5.647 0.36158E+05 -19.477 10 HF,gas 0.47 -14.16 -14.63 -7.317 0.24988E+05 -12.936 11 HCl,gas 5.19 -12.89 -18.08 -9.038 0.30864E+05 -16.377 12 acmite 7.71 6.90 -0.81 -0.084 0.13863E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.71 -4.74 -0.237 0.80994E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 23 andradite 39.01 35.14 -3.86 -0.201 0.65985E+04 26 ankerite -2.14 -6.56 -4.42 -0.737 0.75524E+04 27 annite 20.12 16.40 -3.73 -0.207 0.63623E+04 28 phlogopite 27.06 22.49 -4.58 -0.254 0.78174E+04 34 apatite-F -34.30 -38.10 -3.80 -0.316 0.64849E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29166E+04 39 brucite 12.57 8.33 -4.24 -0.847 0.72325E+04 40 calcite 0.81 -0.74 -1.55 -0.518 0.26524E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.75 -4.83 -0.322 0.82541E+04 44 carpholite-Fe 6.71 1.72 -4.99 -0.333 0.85276E+04 45 celadonite 5.34 2.83 -2.51 -0.148 0.42863E+04 46 celadonite-Fe 3.88 0.80 -3.07 -0.181 0.52503E+04 47 chrysotile 23.89 19.02 -4.87 -0.406 0.83205E+04 49 clinochlore 39.07 34.09 -4.98 -0.156 0.85031E+04 54 chloritoid-Fe 9.17 4.71 -4.47 -0.298 0.76253E+04 55 chloritoid-Mn 11.40 7.50 -3.90 -0.260 0.66598E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.51 -4.20 -0.350 0.71670E+04 68 diaspore 2.87 0.70 -2.18 -0.363 0.37166E+04 69 diamond -3.10 -6.86 -3.76 -1.075 0.64234E+04 70 diopside 16.18 13.73 -2.45 -0.245 0.41824E+04 71 hedenbergite 14.21 11.70 -2.51 -0.251 0.42790E+04 78 epidote 24.67 20.17 -4.50 -0.218 0.76816E+04 81 fayalite 14.05 9.62 -4.43 -0.633 0.75623E+04 82 ferrosilite 11.15 6.63 -4.52 -0.452 0.77214E+04 86 gibbsite 4.08 0.70 -3.38 -0.483 0.57751E+04 87 glaucophane 22.97 18.25 -4.72 -0.128 0.80646E+04 89 graphite -3.55 -6.86 -3.32 -0.948 0.56657E+04 90 greenalite 16.14 12.93 -3.21 -0.267 0.54794E+04 93 hematite 12.57 9.98 -2.59 -0.314 0.44183E+04 94 heulandite -5.83 -8.15 -2.33 -0.106 0.39727E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.47 -4.12 -0.588 0.70298E+04 101 kaolinite -1.33 -4.58 -3.25 -0.296 0.55527E+04 104 laumontite 2.88 0.81 -2.07 -0.138 0.35328E+04 105 lawsonite 9.62 6.79 -2.82 -0.188 0.48199E+04 106 leucite 4.12 0.48 -3.64 -0.364 0.62177E+04 108 lizardite 23.24 19.02 -4.22 -0.352 0.72131E+04 109 magnesite 0.69 -3.79 -4.48 -1.492 0.76452E+04 110 magnetite 20.09 16.28 -3.81 -0.311 0.64982E+04 111 minnesotaite 10.39 6.95 -3.44 -0.202 0.58678E+04 115 manganosite 14.06 9.10 -4.96 -1.241 0.84726E+04 119 microcline -2.49 -2.51 -0.03 -0.002 0.43660E+02 123 muscovite 2.58 -1.12 -3.70 -0.218 0.63183E+04 124 paragonite 4.24 1.01 -3.23 -0.190 0.55138E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 15.18 -4.19 -0.246 0.71544E+04 140 prehnite-Fe 22.50 19.47 -3.02 -0.182 0.51631E+04 146 pyrrhotite -4.26 -6.16 -1.90 -0.633 0.32404E+04 147 pyrrhotiteFe0.875 -6.02 -7.27 -1.25 -0.462 0.21426E+04 148 pyroxmangite 7.40 6.11 -1.29 -0.258 0.22062E+04 149 pyrophyllite -6.18 -10.56 -4.39 -0.274 0.74921E+04 154 rhodochrosite -0.98 -3.02 -2.05 -0.682 0.34957E+04 155 rhodonite 7.45 6.11 -1.34 -0.268 0.22865E+04 156 sanidine -1.28 -2.51 -1.24 -0.095 0.21114E+04 158 siderite -2.61 -5.82 -3.21 -1.069 0.54783E+04 166 stilbite -7.52 -8.15 -0.63 -0.030 0.10789E+04 167 stilpnomelane-Fe 13.02 11.87 -1.14 -0.034 0.19521E+04 174 talc 16.49 13.04 -3.45 -0.203 0.58917E+04 177 tephroite 18.09 15.20 -2.88 -0.412 0.49230E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.16 -1.75 -0.582 0.29832E+04 190 wairakite 3.95 0.81 -3.14 -0.184 0.53548E+04 191 walstromite 11.51 8.39 -3.12 -0.624 0.53284E+04 192 wollastonite 10.46 8.39 -2.07 -0.415 0.35389E+04 193 pseudo-wollastonite 11.00 8.39 -2.61 -0.522 0.44587E+04 195 akaganeite 7.75 4.99 -2.77 -0.598 0.47217E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 204 montmorillonite-Ca -2.29 -6.17 -3.88 -0.240 0.66178E+04 205 montmorillonite-K -2.24 -6.14 -3.91 -0.239 0.66704E+04 206 montmorillonite-Mg -2.48 -6.67 -4.19 -0.259 0.71527E+04 207 montmorillonite-Na -2.04 -5.44 -3.40 -0.208 0.58109E+04 208 nontronite-Ca 3.21 1.11 -2.10 -0.136 0.35854E+04 209 nontronite-H 2.53 -0.76 -3.30 -0.221 0.56267E+04 210 nontronite-K 3.34 1.14 -2.20 -0.141 0.37613E+04 211 nontronite-Mg 3.07 0.61 -2.46 -0.160 0.42044E+04 212 nontronite-Na 3.52 1.84 -1.68 -0.108 0.28677E+04 228 tobermorite 9.82 6.49 -3.33 -0.910 0.56937E+04 234 alabandite -0.98 -3.37 -2.39 -0.796 0.40762E+04 237 boehmite 4.41 0.70 -3.71 -0.618 0.63335E+04 239 ferrous-oxide 9.81 6.30 -3.51 -0.877 0.59906E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.074 0.16498E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21092E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25782E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.0839900 MOLES New total amount of reactant added: 0.0879900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0879900 Water: Moles liquid = 0.4993E+02 kg liquid = 0.8996E+00 Moles total = 0.4992E+02 kg total = 0.8993E+00 Activity = 1.0000 Stoichiometric ionic strength = .1702614E-01 Osmotic coef. = 0.9248 True ionic strength = .2440980E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6570E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.28637E-09 -9.5431 0.23763E-09 -9.6241 0.82978E+00 -0.0810 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.72694E-03 -3.1385 0.59897E-03 -3.2226 0.82397E+00 -0.0841 4 SO4-- 0.44993E-03 -3.3469 0.22154E-03 -3.6546 0.49239E+00 -0.3077 5 HCO3- 0.43794E-02 -2.3586 0.36146E-02 -2.4419 0.82537E+00 -0.0833 6 HS- 0.19535E-02 -2.7092 0.16099E-02 -2.7932 0.82411E+00 -0.0840 7 Al+++ 0.34464E-27 -27.4626 0.70462E-28 -28.1520 0.20445E+00 -0.6894 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24468E-07 -7.6114 0.11944E-07 -7.9228 0.48816E+00 -0.3114 10 Mg++ 0.22538E-10 -10.6471 0.10944E-10 -10.9608 0.48555E+00 -0.3138 11 Fe++ 0.18795E-12 -12.7260 0.91374E-13 -13.0392 0.48617E+00 -0.3132 12 K+ 0.15623E-03 -3.8062 0.12898E-03 -3.8895 0.82560E+00 -0.0832 13 Na+ 0.21098E-01 -1.6757 0.17381E-01 -1.7599 0.82378E+00 -0.0842 14 Mn++ 0.14064E-09 -9.8519 0.68442E-10 -10.1647 0.48664E+00 -0.3128 15 F- 0.39106E-04 -4.4078 0.32145E-04 -4.4929 0.82199E+00 -0.0851 16 HPO4-- 0.45865E-07 -7.3385 0.22587E-07 -7.6461 0.49247E+00 -0.3076 18 HSiO3- 0.48864E-02 -2.3110 0.40262E-02 -2.3951 0.82397E+00 -0.0841 19 Ca(HSiO3)+ 0.13262E-08 -8.8774 0.10952E-08 -8.9605 0.82580E+00 -0.0831 20 Mg(HSiO3)+ 0.15122E-11 -11.8204 0.12488E-11 -11.9035 0.82580E+00 -0.0831 21 NaHSiO3,aq 0.11318E-02 -2.9462 0.11318E-02 -2.9462 0.10000E+01 0.0000 22 AlO+ 0.20557E-15 -15.6870 0.16976E-15 -15.7702 0.82580E+00 -0.0831 24 HAlO2,aq 0.14227E-09 -9.8469 0.14227E-09 -9.8469 0.10000E+01 0.0000 25 AlO2- 0.16119E-05 -5.7927 0.13253E-05 -5.8777 0.82224E+00 -0.0850 26 CH4,aq 0.25648E-07 -7.5909 0.25516E-07 -7.5932 0.99485E+00 -0.0022 27 C2H6,aq 0.70209E-18 -18.1536 0.69848E-18 -18.1558 0.99485E+00 -0.0022 31 CO,aq 0.73468E-14 -14.1339 0.73468E-14 -14.1339 0.10000E+01 0.0000 32 CO2,aq 0.18448E-05 -5.7340 0.18353E-05 -5.7363 0.99485E+00 -0.0022 33 CO3-2 0.27051E-02 -2.5678 0.13287E-02 -2.8766 0.49117E+00 -0.3088 34 CaCO3,aq 0.19899E-06 -6.7012 0.19899E-06 -6.7012 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.13345E-08 -8.8747 0.11021E-08 -8.9578 0.82580E+00 -0.0831 36 CaCl+ 0.14020E-10 -10.8532 0.11578E-10 -10.9364 0.82580E+00 -0.0831 37 CaCl2,aq 0.16476E-14 -14.7832 0.16476E-14 -14.7832 0.10000E+01 0.0000 38 CaF+ 0.67882E-11 -11.1682 0.56057E-11 -11.2514 0.82580E+00 -0.0831 39 CaOH+ 0.43380E-08 -8.3627 0.35824E-08 -8.4458 0.82580E+00 -0.0831 40 CaSO4,aq 0.84026E-09 -9.0756 0.84026E-09 -9.0756 0.10000E+01 0.0000 41 HCl,aq 0.26082E-13 -13.5837 0.26082E-13 -13.5837 0.10000E+01 0.0000 45 HF,aq 0.52291E-10 -10.2816 0.52291E-10 -10.2816 0.10000E+01 0.0000 46 HF2- 0.68876E-15 -15.1619 0.56752E-15 -15.2460 0.82397E+00 -0.0841 48 FeCl+ 0.10490E-15 -15.9792 0.86629E-16 -16.0623 0.82580E+00 -0.0831 51 FeF+ 0.18176E-15 -15.7405 0.15010E-15 -15.8236 0.82580E+00 -0.0831 53 FeO,aq 0.62892E-10 -10.2014 0.62892E-10 -10.2014 0.10000E+01 0.0000 54 FeOH+ 0.15157E-10 -10.8194 0.12517E-10 -10.9025 0.82580E+00 -0.0831 55 HFeO2- 0.33609E-08 -8.4735 0.27693E-08 -8.5576 0.82397E+00 -0.0841 56 FeO+ 0.90567E-16 -16.0430 0.74790E-16 -16.1262 0.82580E+00 -0.0831 58 FeO2- 0.32892E-09 -9.4829 0.27102E-09 -9.5670 0.82397E+00 -0.0841 59 HFeO2,aq 0.81909E-11 -11.0867 0.81909E-11 -11.0867 0.10000E+01 0.0000 60 H2,aq 0.16017E-06 -6.7954 0.15935E-06 -6.7977 0.99485E+00 -0.0022 61 KCl,aq 0.14002E-08 -8.8538 0.14002E-08 -8.8538 0.10000E+01 0.0000 62 KHSO4,aq 0.19198E-16 -16.7167 0.19198E-16 -16.7167 0.10000E+01 0.0000 63 KOH,aq 0.23180E-06 -6.6349 0.23180E-06 -6.6349 0.10000E+01 0.0000 64 KSO4- 0.53813E-06 -6.2691 0.44340E-06 -6.3532 0.82397E+00 -0.0841 65 MgCO3,aq 0.45699E-10 -10.3401 0.45699E-10 -10.3401 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12494E-11 -11.9033 0.10318E-11 -11.9864 0.82580E+00 -0.0831 67 MgCl+ 0.11642E-13 -13.9340 0.96144E-14 -14.0171 0.82580E+00 -0.0831 68 MgF+ 0.23039E-13 -13.6375 0.19026E-13 -13.7207 0.82580E+00 -0.0831 69 MgOH+ 0.21993E-10 -10.6577 0.18162E-10 -10.7408 0.82580E+00 -0.0831 71 MnF+ 0.44874E-13 -13.3480 0.37057E-13 -13.4311 0.82580E+00 -0.0831 72 MnO,aq 0.12552E-08 -8.9013 0.12552E-08 -8.9013 0.10000E+01 0.0000 73 MnOH+ 0.10547E-08 -8.9769 0.87095E-09 -9.0600 0.82580E+00 -0.0831 74 MnO2-2 0.15020E-11 -11.8233 0.73775E-12 -12.1321 0.49117E+00 -0.3088 75 HMnO2- 0.46613E-10 -10.3315 0.38407E-10 -10.4156 0.82397E+00 -0.0841 78 MnCl+ 0.30569E-12 -12.5147 0.25244E-12 -12.5978 0.82580E+00 -0.0831 79 MnSO4,aq 0.43773E-11 -11.3588 0.43773E-11 -11.3588 0.10000E+01 0.0000 80 NaCl,aq 0.34500E-05 -5.4622 0.34500E-05 -5.4622 0.10000E+01 0.0000 81 NaF,aq 0.13080E-06 -6.8834 0.13080E-06 -6.8834 0.10000E+01 0.0000 82 NaOH,aq 0.31425E-04 -4.5027 0.31425E-04 -4.5027 0.10000E+01 0.0000 84 OH- 0.29571E-02 -2.5291 0.24314E-02 -2.6141 0.82224E+00 -0.0850 89 HPO3-2 0.22836E-16 -16.6414 0.11216E-16 -16.9501 0.49117E+00 -0.3088 92 H3PO4,aq 0.89201E-17 -17.0496 0.89201E-17 -17.0496 0.10000E+01 0.0000 93 H2PO4- 0.12003E-09 -9.9207 0.99011E-10 -10.0043 0.82488E+00 -0.0836 94 PO4-3 0.35821E-09 -9.4459 0.77552E-10 -10.1104 0.21650E+00 -0.6645 98 HP2O7-3 0.31553E-17 -17.5010 0.64591E-18 -18.1898 0.20471E+00 -0.6889 99 P2O7-4 0.10415E-16 -16.9823 0.64937E-18 -18.1875 0.62348E-01 -1.2052 100 H2S,aq 0.11885E-05 -5.9250 0.11823E-05 -5.9273 0.99485E+00 -0.0022 101 S2-2 0.73377E-09 -9.1344 0.36041E-09 -9.4432 0.49117E+00 -0.3088 102 S3-2 0.73352E-14 -14.1346 0.36028E-14 -14.4434 0.49117E+00 -0.3088 103 S3- 0.17448E-17 -17.7583 0.14376E-17 -17.8424 0.82397E+00 -0.0841 104 S4-2 0.48437E-19 -19.3148 0.23791E-19 -19.6236 0.49117E+00 -0.3088 107 SO3-2 0.91849E-11 -11.0369 0.45874E-11 -11.3384 0.49946E+00 -0.3015 108 HSO3- 0.82836E-13 -13.0818 0.68254E-13 -13.1659 0.82397E+00 -0.0841 109 HSO4- 0.61365E-10 -10.2121 0.50733E-10 -10.2947 0.82675E+00 -0.0826 111 S2O3-2 0.62644E-11 -11.2031 0.30769E-11 -11.5119 0.49117E+00 -0.3088 112 HS2O3- 0.15866E-18 -18.7995 0.13073E-18 -18.8836 0.82397E+00 -0.0841 Charge balance for all species = -.6123E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2863726E-09 -.1171569E-01 -.1178875E+02 0.0000 2 H2O 0.1000000E+01 0.5550522E+02 0.9982528E+06 0.0000 3 Cl- 0.7269366E-03 0.7303880E-03 0.2585067E+02 6.4015 4 SO4-- 0.4499261E-03 0.4503997E-03 0.4319297E+02 15.5937 5 HCO3- 0.4379387E-02 0.7086546E-02 0.4316702E+03 7.1822 6 HS- 0.1953534E-02 0.1954789E-02 0.6453951E+02 6.8309 7 Al+++ 0.3446404E-27 0.1611995E-05 0.4342052E-01 0.7203 8 H4SiO4 0.1024625E-02 0.7042797E-02 0.6757769E+03 -2.9894 9 Ca++ 0.2446804E-07 0.2313179E-06 0.9255087E-02 11.3254 10 Mg++ 0.2253834E-10 0.9302728E-10 0.2257856E-05 8.2874 11 Fe++ 0.1879455E-12 0.3776252E-08 0.2105358E-03 6.2090 12 K+ 0.1562276E-03 0.1569989E-03 0.6128595E+01 5.7346 13 Na+ 0.2109843E-01 0.2226523E-01 0.5110078E+03 7.8642 14 Mn++ 0.1406407E-09 0.2503389E-08 0.1372987E-03 9.0835 15 F- 0.3910626E-04 0.3923712E-04 0.7441667E+00 5.1312 16 HPO4-- 0.4586481E-07 0.4634306E-07 0.4440441E-02 11.6021 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1055222E-01 -.1053892E-01 -.1329379E-04 0.0000000E+00 2 H2O 0.4991845E+02 0.4993007E+02 -.1162863E-01 0.0000000E+00 3 Cl- 0.6570252E-03 0.6570252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4051672E-03 0.4051599E-03 0.7298830E-08 0.0000000E+00 5 HCO3- 0.6374747E-02 0.6374747E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.1758494E-02 0.1758443E-02 0.5109181E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1450080E-05 0.3325272E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.6335393E-02 0.5817627E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.3396952E-08 0.2919532E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002882E-01 0.3325272E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3529600E-04 0.3529600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.901080E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0879900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3325E-05 -5.478 0.8720E-03 -3.060 0.2493 0.3347E-03 pyrite 0.2920E-07 -7.535 0.3503E-05 -5.456 0.1001E-02 0.6989E-06 quartz 0.5808E-02 -2.236 0.3489 -0.457 99.75 0.1318 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.349799 g Volume = 0.132104 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0879900 moles log = -1.0556 Original solution: 1000.0103000 g Original solution / Rock added: 11365.04 (Water/Rock Ratio), log = 4.0556 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0208 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9995E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1910E-03 1.0071 0.1964E-03 0.1950E-03 CH4,gas 0.3634E-04 1.0125 0.3756E-04 0.3709E-04 H2,gas 0.2048E-03 1.0005 0.2092E-03 0.2091E-03 H2S,gas 0.3197E-04 0.9960 0.3250E-04 0.3263E-04 S2,gas 0.8875E-21 1.0000 0.9060E-21 0.9060E-21 CO,gas 0.1073E-10 1.0000 0.1095E-10 0.1095E-10 SO3,gas 0.4634E-38 1.0000 0.4730E-38 0.4730E-38 SO2,gas 0.3771E-19 1.0000 0.3850E-19 0.3850E-19 HF,gas 0.1258E-12 1.0000 0.1284E-12 0.1284E-12 HCl,gas 0.4509E-16 1.0000 0.4602E-16 0.4602E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.07 -5.41 -1.802 0.92305E+04 -3.707 3 CH4,gas 4.54 -1.58 -6.12 -1.531 0.10457E+05 -4.425 4 H2,gas 8.00 2.62 -5.38 -3.073 0.91835E+04 -3.679 5 H2S,gas -6.23 -12.42 -6.19 -3.094 0.10564E+05 -4.488 6 S2,gas -7.34 -30.08 -22.74 -3.499 0.38831E+05 -21.043 7 CO,gas 3.21 -9.44 -12.66 -3.895 0.21616E+05 -10.961 8 SO3,gas 17.12 -22.90 -40.02 -10.006 0.68340E+05 -38.325 9 SO2,gas 0.83 -20.28 -21.11 -5.630 0.36051E+05 -19.415 10 HF,gas 0.47 -14.12 -14.59 -7.295 0.24913E+05 -12.891 11 HCl,gas 5.19 -12.85 -18.04 -9.018 0.30796E+05 -16.337 12 acmite 7.71 6.78 -0.93 -0.096 0.15812E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.72 -4.73 -0.237 0.80840E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 23 andradite 39.01 34.80 -4.20 -0.218 0.71786E+04 26 ankerite -2.14 -6.60 -4.46 -0.744 0.76198E+04 27 annite 20.12 16.11 -4.01 -0.223 0.68464E+04 28 phlogopite 27.06 22.35 -4.72 -0.262 0.80522E+04 34 apatite-F -34.30 -38.17 -3.87 -0.323 0.66117E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29150E+04 39 brucite 12.57 8.29 -4.28 -0.856 0.73100E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26508E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.75 -4.83 -0.322 0.82523E+04 45 celadonite 5.34 2.78 -2.56 -0.150 0.43661E+04 46 celadonite-Fe 3.88 0.71 -3.17 -0.186 0.54132E+04 54 chloritoid-Fe 9.17 4.66 -4.51 -0.301 0.77066E+04 55 chloritoid-Mn 11.40 7.53 -3.87 -0.258 0.66018E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.51 -4.20 -0.350 0.71693E+04 68 diaspore 2.87 0.72 -2.15 -0.359 0.36769E+04 69 diamond -3.10 -6.82 -3.72 -1.063 0.63534E+04 70 diopside 16.18 13.63 -2.55 -0.255 0.43498E+04 71 hedenbergite 14.21 11.56 -2.65 -0.265 0.45295E+04 78 epidote 24.67 20.02 -4.65 -0.225 0.79373E+04 81 fayalite 14.05 9.43 -4.62 -0.660 0.78836E+04 82 ferrosilite 11.15 6.44 -4.71 -0.471 0.80426E+04 86 gibbsite 4.08 0.72 -3.36 -0.480 0.57355E+04 87 glaucophane 22.97 18.12 -4.86 -0.131 0.82971E+04 89 graphite -3.55 -6.82 -3.28 -0.936 0.55956E+04 90 greenalite 16.14 12.65 -3.49 -0.291 0.59613E+04 93 hematite 12.57 9.80 -2.77 -0.336 0.47288E+04 94 heulandite -5.83 -8.16 -2.33 -0.106 0.39833E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.47 -4.12 -0.588 0.70321E+04 101 kaolinite -1.33 -4.54 -3.21 -0.291 0.54734E+04 104 laumontite 2.88 0.81 -2.08 -0.138 0.35434E+04 105 lawsonite 9.62 6.79 -2.83 -0.189 0.48305E+04 106 leucite 4.12 0.48 -3.64 -0.364 0.62200E+04 108 lizardite 23.24 18.88 -4.36 -0.363 0.74456E+04 109 magnesite 0.69 -3.78 -4.47 -1.490 0.76312E+04 110 magnetite 20.09 16.01 -4.08 -0.333 0.69693E+04 111 minnesotaite 10.39 6.67 -3.72 -0.219 0.63496E+04 115 manganosite 14.06 9.08 -4.97 -1.244 0.84940E+04 119 microcline -2.49 -2.51 -0.03 -0.002 0.45948E+02 123 muscovite 2.58 -1.07 -3.66 -0.215 0.62413E+04 124 paragonite 4.24 1.06 -3.18 -0.187 0.54345E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 15.12 -4.25 -0.250 0.72549E+04 140 prehnite-Fe 22.50 19.30 -3.20 -0.192 0.54585E+04 146 pyrrhotite -4.26 -6.21 -1.95 -0.649 0.33261E+04 147 pyrrhotiteFe0.875 -6.02 -7.31 -1.29 -0.475 0.22069E+04 148 pyroxmangite 7.40 6.09 -1.30 -0.261 0.22275E+04 149 pyrophyllite -6.18 -10.52 -4.34 -0.271 0.74128E+04 154 rhodochrosite -0.98 -2.98 -2.01 -0.669 0.34255E+04 155 rhodonite 7.45 6.09 -1.35 -0.270 0.23078E+04 156 sanidine -1.28 -2.51 -1.24 -0.095 0.21137E+04 158 siderite -2.61 -5.86 -3.25 -1.083 0.55473E+04 166 stilbite -7.52 -8.16 -0.64 -0.030 0.10895E+04 167 stilpnomelane-Fe 13.02 11.44 -1.58 -0.047 0.26968E+04 174 talc 16.49 12.90 -3.59 -0.211 0.61242E+04 177 tephroite 18.09 15.18 -2.91 -0.415 0.49656E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.21 -1.80 -0.599 0.30689E+04 190 wairakite 3.95 0.81 -3.14 -0.185 0.53654E+04 191 walstromite 11.51 8.34 -3.17 -0.635 0.54183E+04 192 wollastonite 10.46 8.34 -2.13 -0.425 0.36287E+04 193 pseudo-wollastonite 11.00 8.34 -2.66 -0.533 0.45486E+04 195 akaganeite 7.75 4.90 -2.86 -0.618 0.48769E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 204 montmorillonite-Ca -2.29 -6.15 -3.86 -0.239 0.65920E+04 205 montmorillonite-K -2.24 -6.13 -3.89 -0.238 0.66436E+04 206 montmorillonite-Mg -2.48 -6.65 -4.17 -0.258 0.71249E+04 207 montmorillonite-Na -2.04 -5.42 -3.39 -0.207 0.57834E+04 208 nontronite-Ca 3.21 0.93 -2.28 -0.148 0.38976E+04 209 nontronite-H 2.53 -0.94 -3.47 -0.233 0.59241E+04 210 nontronite-K 3.34 0.96 -2.39 -0.153 0.40725E+04 211 nontronite-Mg 3.07 0.43 -2.64 -0.172 0.45146E+04 212 nontronite-Na 3.52 1.66 -1.86 -0.119 0.31782E+04 228 tobermorite 9.82 6.44 -3.38 -0.922 0.57686E+04 234 alabandite -0.98 -3.33 -2.36 -0.785 0.40226E+04 237 boehmite 4.41 0.72 -3.69 -0.614 0.62938E+04 239 ferrous-oxide 9.81 6.21 -3.60 -0.901 0.61513E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.074 0.16519E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21119E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25814E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.0879900 MOLES New total amount of reactant added: 0.0919900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0919900 Water: Moles liquid = 0.4994E+02 kg liquid = 0.8996E+00 Moles total = 0.4992E+02 kg total = 0.8994E+00 Activity = 1.0000 Stoichiometric ionic strength = .1728542E-01 Osmotic coef. = 0.9243 True ionic strength = .2451520E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6806E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.30356E-09 -9.5178 0.25182E-09 -9.5989 0.82955E+00 -0.0812 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.75298E-03 -3.1232 0.62024E-03 -3.2074 0.82372E+00 -0.0842 4 SO4-- 0.47110E-03 -3.3269 0.23169E-03 -3.6351 0.49180E+00 -0.3082 5 HCO3- 0.46768E-02 -2.3301 0.38589E-02 -2.4135 0.82513E+00 -0.0835 6 HS- 0.20401E-02 -2.6904 0.16807E-02 -2.7745 0.82386E+00 -0.0841 7 Al+++ 0.43473E-27 -27.3618 0.88638E-28 -28.0524 0.20389E+00 -0.6906 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24358E-07 -7.6134 0.11876E-07 -7.9253 0.48756E+00 -0.3120 10 Mg++ 0.22777E-10 -10.6425 0.11046E-10 -10.9568 0.48495E+00 -0.3143 11 Fe++ 0.17010E-12 -12.7693 0.82594E-13 -13.0831 0.48557E+00 -0.3137 12 K+ 0.15620E-03 -3.8063 0.12892E-03 -3.8897 0.82535E+00 -0.0834 13 Na+ 0.21159E-01 -1.6745 0.17425E-01 -1.7588 0.82353E+00 -0.0843 14 Mn++ 0.15330E-09 -9.8145 0.74509E-10 -10.1278 0.48604E+00 -0.3133 15 F- 0.40876E-04 -4.3885 0.33589E-04 -4.4738 0.82174E+00 -0.0853 16 HPO4-- 0.45874E-07 -7.3384 0.22565E-07 -7.6466 0.49188E+00 -0.3081 18 HSiO3- 0.46124E-02 -2.3361 0.37993E-02 -2.4203 0.82372E+00 -0.0842 19 Ca(HSiO3)+ 0.12447E-08 -8.9049 0.10275E-08 -8.9882 0.82556E+00 -0.0833 20 Mg(HSiO3)+ 0.14407E-11 -11.8414 0.11894E-11 -11.9247 0.82556E+00 -0.0833 21 NaHSiO3,aq 0.10708E-02 -2.9703 0.10708E-02 -2.9703 0.10000E+01 0.0000 22 AlO+ 0.23034E-15 -15.6376 0.19016E-15 -15.7209 0.82556E+00 -0.0833 24 HAlO2,aq 0.15038E-09 -9.8228 0.15038E-09 -9.8228 0.10000E+01 0.0000 25 AlO2- 0.16082E-05 -5.7937 0.13219E-05 -5.8788 0.82198E+00 -0.0851 26 CH4,aq 0.27335E-07 -7.5633 0.27193E-07 -7.5655 0.99478E+00 -0.0023 27 C2H6,aq 0.80947E-18 -18.0918 0.80524E-18 -18.0941 0.99478E+00 -0.0023 31 CO,aq 0.81886E-14 -14.0868 0.81886E-14 -14.0868 0.10000E+01 0.0000 32 CO2,aq 0.20873E-05 -5.6804 0.20764E-05 -5.6827 0.99478E+00 -0.0023 33 CO3-2 0.27284E-02 -2.5641 0.13385E-02 -2.8734 0.49058E+00 -0.3093 34 CaCO3,aq 0.19932E-06 -6.7005 0.19932E-06 -6.7005 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.14170E-08 -8.8486 0.11698E-08 -8.9319 0.82556E+00 -0.0833 36 CaCl+ 0.14439E-10 -10.8405 0.11920E-10 -10.9237 0.82556E+00 -0.0833 37 CaCl2,aq 0.17565E-14 -14.7553 0.17565E-14 -14.7553 0.10000E+01 0.0000 38 CaF+ 0.70545E-11 -11.1515 0.58239E-11 -11.2348 0.82556E+00 -0.0833 39 CaOH+ 0.40712E-08 -8.3903 0.33611E-08 -8.4735 0.82556E+00 -0.0833 40 CaSO4,aq 0.87372E-09 -9.0586 0.87372E-09 -9.0586 0.10000E+01 0.0000 41 HCl,aq 0.28621E-13 -13.5433 0.28621E-13 -13.5433 0.10000E+01 0.0000 45 HF,aq 0.57904E-10 -10.2373 0.57904E-10 -10.2373 0.10000E+01 0.0000 46 HF2- 0.79719E-15 -15.0984 0.65666E-15 -15.1827 0.82372E+00 -0.0842 48 FeCl+ 0.98220E-16 -16.0078 0.81086E-16 -16.0911 0.82556E+00 -0.0833 51 FeF+ 0.17172E-15 -15.7652 0.14177E-15 -15.8484 0.82556E+00 -0.0833 53 FeO,aq 0.50621E-10 -10.2957 0.50621E-10 -10.2957 0.10000E+01 0.0000 54 FeOH+ 0.12932E-10 -10.8883 0.10676E-10 -10.9716 0.82556E+00 -0.0833 55 HFeO2- 0.25534E-08 -8.5929 0.21033E-08 -8.6771 0.82372E+00 -0.0842 56 FeO+ 0.77852E-16 -16.1087 0.64271E-16 -16.1920 0.82556E+00 -0.0833 58 FeO2- 0.25177E-09 -9.5990 0.20739E-09 -9.6832 0.82372E+00 -0.0842 59 HFeO2,aq 0.66422E-11 -11.1777 0.66422E-11 -11.1777 0.10000E+01 0.0000 60 H2,aq 0.15781E-06 -6.8019 0.15699E-06 -6.8041 0.99478E+00 -0.0023 61 KCl,aq 0.14493E-08 -8.8388 0.14493E-08 -8.8388 0.10000E+01 0.0000 62 KHSO4,aq 0.21267E-16 -16.6723 0.21267E-16 -16.6723 0.10000E+01 0.0000 63 KOH,aq 0.21864E-06 -6.6603 0.21864E-06 -6.6603 0.10000E+01 0.0000 64 KSO4- 0.56270E-06 -6.2497 0.46351E-06 -6.3339 0.82372E+00 -0.0842 65 MgCO3,aq 0.46467E-10 -10.3329 0.46467E-10 -10.3329 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13467E-11 -11.8707 0.11118E-11 -11.9540 0.82556E+00 -0.0833 67 MgCl+ 0.12172E-13 -13.9146 0.10049E-13 -13.9979 0.82556E+00 -0.0833 68 MgF+ 0.24305E-13 -13.6143 0.20065E-13 -13.6976 0.82556E+00 -0.0833 69 MgOH+ 0.20953E-10 -10.6787 0.17298E-10 -10.7620 0.82556E+00 -0.0833 71 MnF+ 0.51062E-13 -13.2919 0.42154E-13 -13.3752 0.82556E+00 -0.0833 72 MnO,aq 0.12168E-08 -8.9148 0.12168E-08 -8.9148 0.10000E+01 0.0000 73 MnOH+ 0.10838E-08 -8.9651 0.89472E-09 -9.0483 0.82556E+00 -0.0833 74 MnO2-2 0.12981E-11 -11.8867 0.63681E-12 -12.1960 0.49058E+00 -0.3093 75 HMnO2- 0.42652E-10 -10.3701 0.35133E-10 -10.4543 0.82372E+00 -0.0842 78 MnCl+ 0.34472E-12 -12.4625 0.28458E-12 -12.5458 0.82556E+00 -0.0833 79 MnSO4,aq 0.49836E-11 -11.3025 0.49836E-11 -11.3025 0.10000E+01 0.0000 80 NaCl,aq 0.35818E-05 -5.4459 0.35818E-05 -5.4459 0.10000E+01 0.0000 81 NaF,aq 0.13703E-06 -6.8632 0.13703E-06 -6.8632 0.10000E+01 0.0000 82 NaOH,aq 0.29731E-04 -4.5268 0.29731E-04 -4.5268 0.10000E+01 0.0000 84 OH- 0.27913E-02 -2.5542 0.22944E-02 -2.6393 0.82198E+00 -0.0851 89 HPO3-2 0.22502E-16 -16.6478 0.11039E-16 -16.9571 0.49058E+00 -0.3093 92 H3PO4,aq 0.10008E-16 -16.9997 0.10008E-16 -16.9997 0.10000E+01 0.0000 93 H2PO4- 0.12711E-09 -9.8958 0.10482E-09 -9.9796 0.82463E+00 -0.0837 94 PO4-3 0.33855E-09 -9.4704 0.73108E-10 -10.1360 0.21595E+00 -0.6657 98 HP2O7-3 0.33463E-17 -17.4754 0.68314E-18 -18.1655 0.20415E+00 -0.6901 99 P2O7-4 0.10444E-16 -16.9811 0.64808E-18 -18.1884 0.62052E-01 -1.2072 100 H2S,aq 0.13149E-05 -5.8811 0.13081E-05 -5.8834 0.99478E+00 -0.0023 101 S2-2 0.81275E-09 -9.0900 0.39872E-09 -9.3993 0.49058E+00 -0.3093 102 S3-2 0.91240E-14 -14.0398 0.44760E-14 -14.3491 0.49058E+00 -0.3093 103 S3- 0.23150E-17 -17.6354 0.19069E-17 -17.7197 0.82372E+00 -0.0842 104 S4-2 0.67660E-19 -19.1697 0.33193E-19 -19.4790 0.49058E+00 -0.3093 106 SO2,aq 0.10301E-19 -19.9871 0.10301E-19 -19.9871 0.10000E+01 0.0000 107 SO3-2 0.94740E-11 -11.0235 0.47264E-11 -11.3255 0.49888E+00 -0.3020 108 HSO3- 0.90471E-13 -13.0435 0.74522E-13 -13.1277 0.82372E+00 -0.0842 109 HSO4- 0.68029E-10 -10.1673 0.56227E-10 -10.2501 0.82651E+00 -0.0828 111 S2O3-2 0.72568E-11 -11.1393 0.35600E-11 -11.4485 0.49058E+00 -0.3093 112 HS2O3- 0.19460E-18 -18.7109 0.16029E-18 -18.7951 0.82372E+00 -0.0842 Charge balance for all species = -.6122E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3035636E-09 -.1123605E-01 -.1130615E+02 0.0000 2 H2O 0.1000000E+01 0.5550539E+02 0.9982591E+06 0.0000 3 Cl- 0.7529835E-03 0.7565667E-03 0.2677731E+02 6.3915 4 SO4-- 0.4710998E-03 0.4715970E-03 0.4522592E+02 15.5627 5 HCO3- 0.4676761E-02 0.7407485E-02 0.4512214E+03 7.1854 6 HS- 0.2040073E-02 0.2041456E-02 0.6740112E+02 6.8244 7 Al+++ 0.4347326E-27 0.1608352E-05 0.4332253E-01 0.7443 8 H4SiO4 0.1024625E-02 0.6707739E-02 0.6436292E+03 -2.9894 9 Ca++ 0.2435752E-07 0.2313007E-06 0.9254427E-02 11.2725 10 Mg++ 0.2277653E-10 0.9302034E-10 0.2257695E-05 8.2410 11 Fe++ 0.1700959E-12 0.2875568E-08 0.1603209E-03 6.1148 12 K+ 0.1562044E-03 0.1569872E-03 0.6128158E+01 5.7092 13 Na+ 0.2115935E-01 0.2226356E-01 0.5109712E+03 7.8401 14 Mn++ 0.1532974E-09 0.2503202E-08 0.1372889E-03 9.0700 15 F- 0.4087562E-04 0.4101271E-04 0.7778449E+00 5.1251 16 HPO4-- 0.4587393E-07 0.4633960E-07 0.4440124E-02 11.5512 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1012152E-01 -.1010821E-01 -.1330626E-04 0.0000000E+00 2 H2O 0.4992172E+02 0.4993395E+02 -.1223053E-01 0.0000000E+00 3 Cl- 0.6806252E-03 0.6806252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4242672E-03 0.4242597E-03 0.7501335E-08 0.0000000E+00 5 HCO3- 0.6663947E-02 0.6663947E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.1836594E-02 0.1836542E-02 0.5250935E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1446911E-05 0.3328441E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.6034439E-02 0.6118581E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.2586928E-08 0.3000534E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002882E-01 0.3328441E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3689600E-04 0.3689600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1694E-20 Mass of aqueous solution: 0.901144E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0919900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3328E-05 -5.478 0.8728E-03 -3.059 0.2372 0.3350E-03 pyrite 0.3001E-07 -7.523 0.3600E-05 -5.444 0.9786E-03 0.7183E-06 quartz 0.6109E-02 -2.214 0.3670 -0.435 99.76 0.1386 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.367881 g Volume = 0.138933 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0919900 moles log = -1.0363 Original solution: 1000.0103000 g Original solution / Rock added: 10870.86 (Water/Rock Ratio), log = 4.0363 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0208 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9995E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.2161E-03 1.0071 0.2222E-03 0.2206E-03 CH4,gas 0.3872E-04 1.0125 0.4003E-04 0.3953E-04 H2,gas 0.2018E-03 1.0005 0.2061E-03 0.2060E-03 H2S,gas 0.3537E-04 0.9960 0.3596E-04 0.3610E-04 S2,gas 0.1119E-20 1.0000 0.1143E-20 0.1143E-20 CO,gas 0.1195E-10 1.0000 0.1220E-10 0.1220E-10 SO3,gas 0.5442E-38 1.0000 0.5555E-38 0.5555E-38 SO2,gas 0.4364E-19 1.0000 0.4454E-19 0.4454E-19 HF,gas 0.1393E-12 1.0000 0.1422E-12 0.1422E-12 HCl,gas 0.4947E-16 1.0000 0.5050E-16 0.5050E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.01 -5.35 -1.784 0.91389E+04 -3.653 3 CH4,gas 4.54 -1.55 -6.10 -1.524 0.10410E+05 -4.398 4 H2,gas 8.00 2.61 -5.38 -3.077 0.91945E+04 -3.686 5 H2S,gas -6.23 -12.37 -6.14 -3.072 0.10489E+05 -4.444 6 S2,gas -7.34 -29.98 -22.64 -3.483 0.38659E+05 -20.942 7 CO,gas 3.21 -9.40 -12.61 -3.881 0.21536E+05 -10.914 8 SO3,gas 17.12 -22.83 -39.95 -9.989 0.68221E+05 -38.255 9 SO2,gas 0.83 -20.22 -21.05 -5.613 0.35943E+05 -19.351 10 HF,gas 0.47 -14.07 -14.55 -7.273 0.24837E+05 -12.847 11 HCl,gas 5.19 -12.81 -18.00 -8.998 0.30727E+05 -16.297 12 acmite 7.71 6.67 -1.04 -0.108 0.17778E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.73 -4.73 -0.236 0.80710E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 23 andradite 39.01 34.46 -4.54 -0.236 0.77604E+04 26 ankerite -2.14 -6.64 -4.50 -0.750 0.76880E+04 27 annite 20.12 15.83 -4.29 -0.239 0.73316E+04 28 phlogopite 27.06 22.21 -4.86 -0.270 0.82920E+04 34 apatite-F -34.30 -38.24 -3.94 -0.329 0.67317E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29138E+04 39 brucite 12.57 8.24 -4.33 -0.866 0.73892E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26495E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.75 -4.83 -0.322 0.82493E+04 45 celadonite 5.34 2.74 -2.60 -0.153 0.44475E+04 46 celadonite-Fe 3.88 0.61 -3.27 -0.192 0.55765E+04 54 chloritoid-Fe 9.17 4.61 -4.56 -0.304 0.77854E+04 55 chloritoid-Mn 11.40 7.57 -3.83 -0.255 0.65427E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.51 -4.20 -0.350 0.71716E+04 68 diaspore 2.87 0.74 -2.13 -0.355 0.36358E+04 69 diamond -3.10 -6.78 -3.68 -1.052 0.62840E+04 70 diopside 16.18 13.53 -2.65 -0.265 0.45192E+04 71 hedenbergite 14.21 11.41 -2.80 -0.280 0.47808E+04 78 epidote 24.67 19.87 -4.80 -0.233 0.81912E+04 81 fayalite 14.05 9.24 -4.81 -0.687 0.82055E+04 82 ferrosilite 11.15 6.25 -4.90 -0.490 0.83646E+04 86 gibbsite 4.08 0.74 -3.33 -0.476 0.56944E+04 87 glaucophane 22.97 17.98 -5.00 -0.135 0.85346E+04 89 graphite -3.55 -6.78 -3.24 -0.925 0.55263E+04 90 greenalite 16.14 12.37 -3.77 -0.315 0.64441E+04 93 hematite 12.57 9.61 -2.95 -0.358 0.50396E+04 94 heulandite -5.83 -8.16 -2.34 -0.106 0.39914E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.12 -0.589 0.70344E+04 101 kaolinite -1.33 -4.49 -3.16 -0.287 0.53912E+04 104 laumontite 2.88 0.80 -2.08 -0.139 0.35515E+04 105 lawsonite 9.62 6.78 -2.83 -0.189 0.48386E+04 106 leucite 4.12 0.47 -3.64 -0.364 0.62223E+04 108 lizardite 23.24 18.74 -4.50 -0.375 0.76831E+04 109 magnesite 0.69 -3.77 -4.46 -1.487 0.76188E+04 110 magnetite 20.09 15.73 -4.36 -0.356 0.74411E+04 111 minnesotaite 10.39 6.39 -4.00 -0.235 0.68325E+04 115 manganosite 14.06 9.07 -4.99 -1.247 0.85170E+04 119 microcline -2.49 -2.51 -0.03 -0.002 0.48191E+02 123 muscovite 2.58 -1.03 -3.61 -0.212 0.61613E+04 124 paragonite 4.24 1.10 -3.13 -0.184 0.53523E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 15.07 -4.31 -0.253 0.73533E+04 140 prehnite-Fe 22.50 19.13 -3.37 -0.203 0.57534E+04 146 pyrrhotite -4.26 -6.26 -2.00 -0.666 0.34121E+04 147 pyrrhotiteFe0.875 -6.02 -7.35 -1.33 -0.489 0.22714E+04 148 pyroxmangite 7.40 6.08 -1.32 -0.264 0.22506E+04 149 pyrophyllite -6.18 -10.47 -4.29 -0.268 0.73306E+04 154 rhodochrosite -0.98 -2.94 -1.97 -0.655 0.33570E+04 155 rhodonite 7.45 6.08 -1.37 -0.273 0.23308E+04 156 sanidine -1.28 -2.51 -1.24 -0.095 0.21159E+04 158 siderite -2.61 -5.90 -3.29 -1.097 0.56168E+04 166 stilbite -7.52 -8.16 -0.64 -0.031 0.10976E+04 167 stilpnomelane-Fe 13.02 11.00 -2.02 -0.060 0.34411E+04 174 talc 16.49 12.77 -3.73 -0.219 0.63617E+04 177 tephroite 18.09 15.15 -2.94 -0.419 0.50117E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.26 -1.85 -0.616 0.31549E+04 190 wairakite 3.95 0.80 -3.15 -0.185 0.53735E+04 191 walstromite 11.51 8.28 -3.23 -0.645 0.55086E+04 192 wollastonite 10.46 8.28 -2.18 -0.436 0.37190E+04 193 pseudo-wollastonite 11.00 8.28 -2.72 -0.543 0.46389E+04 195 akaganeite 7.75 4.81 -2.95 -0.637 0.50324E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 204 montmorillonite-Ca -2.29 -6.14 -3.84 -0.238 0.65643E+04 205 montmorillonite-K -2.24 -6.11 -3.87 -0.237 0.66154E+04 206 montmorillonite-Mg -2.48 -6.64 -4.16 -0.257 0.70954E+04 207 montmorillonite-Na -2.04 -5.41 -3.37 -0.206 0.57544E+04 208 nontronite-Ca 3.21 0.75 -2.47 -0.160 0.42098E+04 209 nontronite-H 2.53 -1.11 -3.64 -0.244 0.62214E+04 210 nontronite-K 3.34 0.77 -2.57 -0.165 0.43841E+04 211 nontronite-Mg 3.07 0.25 -2.83 -0.183 0.48250E+04 212 nontronite-Na 3.52 1.48 -2.04 -0.131 0.34891E+04 228 tobermorite 9.82 6.40 -3.42 -0.934 0.58438E+04 234 alabandite -0.98 -3.30 -2.33 -0.775 0.39707E+04 237 boehmite 4.41 0.74 -3.66 -0.610 0.62527E+04 239 ferrous-oxide 9.81 6.11 -3.70 -0.924 0.63122E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.074 0.16535E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21139E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25839E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.0919900 MOLES New total amount of reactant added: 0.0959900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0959900 Water: Moles liquid = 0.4994E+02 kg liquid = 0.8997E+00 Moles total = 0.4992E+02 kg total = 0.8994E+00 Activity = 1.0000 Stoichiometric ionic strength = .1754467E-01 Osmotic coef. = 0.9238 True ionic strength = .2460847E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7042E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.32245E-09 -9.4915 0.26742E-09 -9.5728 0.82934E+00 -0.0813 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.77903E-03 -3.1084 0.64152E-03 -3.1928 0.82349E+00 -0.0843 4 SO4-- 0.49227E-03 -3.3078 0.24184E-03 -3.6165 0.49128E+00 -0.3087 5 HCO3- 0.49850E-02 -2.3023 0.41122E-02 -2.3859 0.82491E+00 -0.0836 6 HS- 0.21266E-02 -2.6723 0.17515E-02 -2.7566 0.82364E+00 -0.0843 7 Al+++ 0.55280E-27 -27.2574 0.11244E-27 -27.9491 0.20340E+00 -0.6917 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24325E-07 -7.6139 0.11847E-07 -7.9264 0.48704E+00 -0.3124 10 Mg++ 0.23054E-10 -10.6373 0.11168E-10 -10.9520 0.48442E+00 -0.3148 11 Fe++ 0.15439E-12 -12.8114 0.74887E-13 -13.1256 0.48504E+00 -0.3142 12 K+ 0.15618E-03 -3.8064 0.12887E-03 -3.8898 0.82513E+00 -0.0835 13 Na+ 0.21219E-01 -1.6733 0.17470E-01 -1.7577 0.82331E+00 -0.0844 14 Mn++ 0.16733E-09 -9.7764 0.81244E-10 -10.0902 0.48552E+00 -0.3138 15 F- 0.42645E-04 -4.3701 0.35033E-04 -4.4555 0.82151E+00 -0.0854 16 HPO4-- 0.45882E-07 -7.3384 0.22545E-07 -7.6470 0.49136E+00 -0.3086 18 HSiO3- 0.43445E-02 -2.3621 0.35777E-02 -2.4464 0.82349E+00 -0.0843 19 Ca(HSiO3)+ 0.11695E-08 -8.9320 0.96527E-09 -9.0154 0.82534E+00 -0.0834 20 Mg(HSiO3)+ 0.13720E-11 -11.8626 0.11324E-11 -11.9460 0.82534E+00 -0.0834 21 NaHSiO3,aq 0.10109E-02 -2.9953 0.10109E-02 -2.9953 0.10000E+01 0.0000 22 AlO+ 0.25916E-15 -15.5864 0.21390E-15 -15.6698 0.82534E+00 -0.0834 24 HAlO2,aq 0.15929E-09 -9.7978 0.15929E-09 -9.7978 0.10000E+01 0.0000 25 AlO2- 0.16045E-05 -5.7946 0.13185E-05 -5.8799 0.82176E+00 -0.0853 26 CH4,aq 0.29084E-07 -7.5363 0.28930E-07 -7.5387 0.99470E+00 -0.0023 27 C2H6,aq 0.93052E-18 -18.0313 0.92559E-18 -18.0336 0.99470E+00 -0.0023 31 CO,aq 0.91245E-14 -14.0398 0.91245E-14 -14.0398 0.10000E+01 0.0000 32 CO2,aq 0.23623E-05 -5.6267 0.23497E-05 -5.6290 0.99470E+00 -0.0023 33 CO3-2 0.27408E-02 -2.5621 0.13431E-02 -2.8719 0.49006E+00 -0.3098 34 CaCO3,aq 0.19952E-06 -6.7000 0.19952E-06 -6.7000 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.15067E-08 -8.8220 0.12436E-08 -8.9053 0.82534E+00 -0.0834 36 CaCl+ 0.14902E-10 -10.8267 0.12300E-10 -10.9101 0.82534E+00 -0.0834 37 CaCl2,aq 0.18746E-14 -14.7271 0.18746E-14 -14.7271 0.10000E+01 0.0000 38 CaF+ 0.73420E-11 -11.1342 0.60597E-11 -11.2176 0.82534E+00 -0.0834 39 CaOH+ 0.38255E-08 -8.4173 0.31574E-08 -8.5007 0.82534E+00 -0.0834 40 CaSO4,aq 0.90982E-09 -9.0410 0.90982E-09 -9.0410 0.10000E+01 0.0000 41 HCl,aq 0.31437E-13 -13.5026 0.31437E-13 -13.5026 0.10000E+01 0.0000 45 HF,aq 0.64134E-10 -10.1929 0.64134E-10 -10.1929 0.10000E+01 0.0000 46 HF2- 0.92117E-15 -15.0357 0.75858E-15 -15.1200 0.82349E+00 -0.0843 48 FeCl+ 0.92133E-16 -16.0356 0.76042E-16 -16.1189 0.82534E+00 -0.0834 51 FeF+ 0.16244E-15 -15.7893 0.13407E-15 -15.8727 0.82534E+00 -0.0834 53 FeO,aq 0.40699E-10 -10.3904 0.40699E-10 -10.3904 0.10000E+01 0.0000 54 FeOH+ 0.11044E-10 -10.9569 0.91154E-11 -11.0402 0.82534E+00 -0.0834 55 HFeO2- 0.19337E-08 -8.7136 0.15924E-08 -8.7979 0.82349E+00 -0.0843 56 FeO+ 0.67002E-16 -16.1739 0.55300E-16 -16.2573 0.82534E+00 -0.0834 58 FeO2- 0.19214E-09 -9.7164 0.15823E-09 -9.8007 0.82349E+00 -0.0843 59 HFeO2,aq 0.53817E-11 -11.2691 0.53817E-11 -11.2691 0.10000E+01 0.0000 60 H2,aq 0.15540E-06 -6.8085 0.15458E-06 -6.8108 0.99470E+00 -0.0023 61 KCl,aq 0.14984E-08 -8.8244 0.14984E-08 -8.8244 0.10000E+01 0.0000 62 KHSO4,aq 0.23565E-16 -16.6277 0.23565E-16 -16.6277 0.10000E+01 0.0000 63 KOH,aq 0.20580E-06 -6.6866 0.20580E-06 -6.6866 0.10000E+01 0.0000 64 KSO4- 0.58729E-06 -6.2311 0.48363E-06 -6.3155 0.82349E+00 -0.0843 65 MgCO3,aq 0.47144E-10 -10.3266 0.47144E-10 -10.3266 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14513E-11 -11.8382 0.11978E-11 -11.9216 0.82534E+00 -0.0834 67 MgCl+ 0.12732E-13 -13.8951 0.10508E-13 -13.9785 0.82534E+00 -0.0834 68 MgF+ 0.25637E-13 -13.5911 0.21159E-13 -13.6745 0.82534E+00 -0.0834 69 MgOH+ 0.19954E-10 -10.7000 0.16469E-10 -10.7833 0.82534E+00 -0.0834 71 MnF+ 0.58086E-13 -13.2359 0.47941E-13 -13.3193 0.82534E+00 -0.0834 72 MnO,aq 0.11765E-08 -8.9294 0.11765E-08 -8.9294 0.10000E+01 0.0000 73 MnOH+ 0.11131E-08 -8.9535 0.91868E-09 -9.0368 0.82534E+00 -0.0834 74 MnO2-2 0.11141E-11 -11.9531 0.54599E-12 -12.2628 0.49006E+00 -0.3098 75 HMnO2- 0.38844E-10 -10.4107 0.31988E-10 -10.4950 0.82349E+00 -0.0843 78 MnCl+ 0.38887E-12 -12.4102 0.32095E-12 -12.4936 0.82534E+00 -0.0834 79 MnSO4,aq 0.56723E-11 -11.2462 0.56723E-11 -11.2462 0.10000E+01 0.0000 80 NaCl,aq 0.37141E-05 -5.4301 0.37141E-05 -5.4301 0.10000E+01 0.0000 81 NaF,aq 0.14329E-06 -6.8438 0.14329E-06 -6.8438 0.10000E+01 0.0000 82 NaOH,aq 0.28068E-04 -4.5518 0.28068E-04 -4.5518 0.10000E+01 0.0000 84 OH- 0.26292E-02 -2.5802 0.21606E-02 -2.6654 0.82176E+00 -0.0853 89 HPO3-2 0.22161E-16 -16.6544 0.10860E-16 -16.9642 0.49006E+00 -0.3098 92 H3PO4,aq 0.11276E-16 -16.9478 0.11276E-16 -16.9478 0.10000E+01 0.0000 93 H2PO4- 0.13490E-09 -9.8700 0.11122E-09 -9.9538 0.82441E+00 -0.0839 94 PO4-3 0.31924E-09 -9.4959 0.68784E-10 -10.1625 0.21546E+00 -0.6666 98 HP2O7-3 0.35559E-17 -17.4490 0.72418E-18 -18.1402 0.20366E+00 -0.6911 99 P2O7-4 0.10470E-16 -16.9801 0.64694E-18 -18.1891 0.61791E-01 -1.2091 100 H2S,aq 0.14553E-05 -5.8370 0.14476E-05 -5.8393 0.99470E+00 -0.0023 101 S2-2 0.89735E-09 -9.0470 0.43976E-09 -9.3568 0.49006E+00 -0.3098 102 S3-2 0.11322E-13 -13.9461 0.55483E-14 -14.2558 0.49006E+00 -0.3098 103 S3- 0.30718E-17 -17.5126 0.25296E-17 -17.5969 0.82349E+00 -0.0843 104 S4-2 0.94360E-19 -19.0252 0.46242E-19 -19.3350 0.49006E+00 -0.3098 106 SO2,aq 0.11940E-19 -19.9230 0.11940E-19 -19.9230 0.10000E+01 0.0000 107 SO3-2 0.97478E-11 -11.0111 0.48581E-11 -11.3135 0.49838E+00 -0.3024 108 HSO3- 0.98777E-13 -13.0053 0.81342E-13 -13.0897 0.82349E+00 -0.0843 109 HSO4- 0.75430E-10 -10.1225 0.62327E-10 -10.2053 0.82629E+00 -0.0829 111 S2O3-2 0.83920E-11 -11.0761 0.41125E-11 -11.3859 0.49006E+00 -0.3098 112 HS2O3- 0.23879E-18 -18.6220 0.19664E-18 -18.7063 0.82349E+00 -0.0843 Charge balance for all species = -.6122E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3224469E-09 -.1075648E-01 -.1082362E+02 0.0000 2 H2O 0.1000000E+01 0.5550555E+02 0.9982647E+06 0.0000 3 Cl- 0.7790260E-03 0.7827417E-03 0.2770379E+02 6.3800 4 SO4-- 0.4922706E-03 0.4927912E-03 0.4725857E+02 15.5292 5 HCO3- 0.4985000E-02 0.7728377E-02 0.4707696E+03 7.1869 6 HS- 0.2126586E-02 0.2128111E-02 0.7026231E+02 6.8162 7 Al+++ 0.5528004E-27 0.1604705E-05 0.4322442E-01 0.7693 8 H4SiO4 0.1024625E-02 0.6379991E-02 0.6121824E+03 -2.9894 9 Ca++ 0.2432503E-07 0.2312834E-06 0.9253763E-02 11.2192 10 Mg++ 0.2305362E-10 0.9301342E-10 0.2257533E-05 8.1936 11 Fe++ 0.1543913E-12 0.2183145E-08 0.1217167E-03 6.0200 12 K+ 0.1561810E-03 0.1569756E-03 0.6127718E+01 5.6830 13 Na+ 0.2121910E-01 0.2226190E-01 0.5109345E+03 7.8151 14 Mn++ 0.1673347E-09 0.2503015E-08 0.1372790E-03 9.0554 15 F- 0.4264469E-04 0.4278805E-04 0.8115180E+00 5.1173 16 HPO4-- 0.4588200E-07 0.4633615E-07 0.4439806E-02 11.4987 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.9690817E-02 -.9677498E-02 -.1331880E-04 0.0000000E+00 2 H2O 0.4992500E+02 0.4993782E+02 -.1281937E-01 0.0000000E+00 3 Cl- 0.7042252E-03 0.7042252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4433672E-03 0.4433595E-03 0.7657029E-08 0.0000000E+00 5 HCO3- 0.6953147E-02 0.6953147E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.1914694E-02 0.1914641E-02 0.5359920E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1443738E-05 0.3331614E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.5740017E-02 0.6413003E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1964154E-08 0.3062812E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002882E-01 0.3331614E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3849600E-04 0.3849600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.901209E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0959900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3332E-05 -5.477 0.8736E-03 -3.059 0.2266 0.3354E-03 pyrite 0.3063E-07 -7.514 0.3675E-05 -5.435 0.9531E-03 0.7332E-06 quartz 0.6403E-02 -2.194 0.3847 -0.415 99.77 0.1453 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.385570 g Volume = 0.145613 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0959900 moles log = -1.0178 Original solution: 1000.0103000 g Original solution / Rock added: 10417.86 (Water/Rock Ratio), log = 4.0178 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0208 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9995E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.2445E-03 1.0071 0.2514E-03 0.2496E-03 CH4,gas 0.4120E-04 1.0125 0.4258E-04 0.4206E-04 H2,gas 0.1987E-03 1.0005 0.2029E-03 0.2028E-03 H2S,gas 0.3914E-04 0.9960 0.3979E-04 0.3995E-04 S2,gas 0.1414E-20 1.0000 0.1443E-20 0.1443E-20 CO,gas 0.1332E-10 1.0000 0.1360E-10 0.1360E-10 SO3,gas 0.6406E-38 1.0000 0.6539E-38 0.6539E-38 SO2,gas 0.5058E-19 1.0000 0.5163E-19 0.5163E-19 HF,gas 0.1543E-12 1.0000 0.1575E-12 0.1575E-12 HCl,gas 0.5434E-16 1.0000 0.5547E-16 0.5547E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 -0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.96 -5.30 -1.766 0.90472E+04 -3.600 3 CH4,gas 4.54 -1.53 -6.07 -1.517 0.10364E+05 -4.371 4 H2,gas 8.00 2.61 -5.39 -3.081 0.92060E+04 -3.693 5 H2S,gas -6.23 -12.33 -6.10 -3.050 0.10414E+05 -4.400 6 S2,gas -7.34 -29.88 -22.54 -3.468 0.38486E+05 -20.841 7 CO,gas 3.21 -9.35 -12.57 -3.866 0.21455E+05 -10.867 8 SO3,gas 17.12 -22.76 -39.88 -9.971 0.68100E+05 -38.184 9 SO2,gas 0.83 -20.15 -20.99 -5.596 0.35833E+05 -19.287 10 HF,gas 0.47 -14.03 -14.50 -7.251 0.24761E+05 -12.803 11 HCl,gas 5.19 -12.77 -17.95 -8.977 0.30658E+05 -16.256 12 acmite 7.71 6.55 -1.16 -0.120 0.19765E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.74 -4.72 -0.236 0.80605E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 23 andradite 39.01 34.12 -4.89 -0.254 0.83453E+04 26 ankerite -2.14 -6.68 -4.54 -0.757 0.77573E+04 27 annite 20.12 15.54 -4.58 -0.254 0.78191E+04 28 phlogopite 27.06 22.06 -5.00 -0.278 0.85371E+04 34 apatite-F -34.30 -38.31 -4.01 -0.334 0.68451E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29130E+04 39 brucite 12.57 8.19 -4.37 -0.875 0.74702E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26488E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.75 -4.83 -0.322 0.82449E+04 45 celadonite 5.34 2.69 -2.65 -0.156 0.45307E+04 46 celadonite-Fe 3.88 0.51 -3.36 -0.198 0.57404E+04 54 chloritoid-Fe 9.17 4.57 -4.60 -0.307 0.78618E+04 55 chloritoid-Mn 11.40 7.60 -3.80 -0.253 0.64823E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.20 -0.350 0.71738E+04 68 diaspore 2.87 0.77 -2.10 -0.351 0.35931E+04 69 diamond -3.10 -6.74 -3.64 -1.040 0.62152E+04 70 diopside 16.18 13.43 -2.75 -0.275 0.46911E+04 71 hedenbergite 14.21 11.26 -2.95 -0.295 0.50335E+04 78 epidote 24.67 19.72 -4.95 -0.240 0.84437E+04 81 fayalite 14.05 9.05 -5.00 -0.714 0.85290E+04 86 gibbsite 4.08 0.77 -3.31 -0.473 0.56517E+04 89 graphite -3.55 -6.74 -3.20 -0.913 0.54574E+04 90 greenalite 16.14 12.08 -4.06 -0.338 0.69295E+04 93 hematite 12.57 9.43 -3.13 -0.380 0.53518E+04 94 heulandite -5.83 -8.17 -2.34 -0.106 0.39970E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.12 -0.589 0.70366E+04 101 kaolinite -1.33 -4.44 -3.11 -0.282 0.53058E+04 104 laumontite 2.88 0.80 -2.08 -0.139 0.35571E+04 105 lawsonite 9.62 6.78 -2.84 -0.189 0.48442E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62245E+04 108 lizardite 23.24 18.60 -4.64 -0.387 0.79261E+04 109 magnesite 0.69 -3.77 -4.46 -1.485 0.76081E+04 110 magnetite 20.09 15.45 -4.64 -0.378 0.79150E+04 111 minnesotaite 10.39 6.10 -4.29 -0.252 0.73179E+04 119 microcline -2.49 -2.52 -0.03 -0.002 0.50388E+02 123 muscovite 2.58 -0.98 -3.56 -0.209 0.60782E+04 124 paragonite 4.24 1.15 -3.08 -0.181 0.52669E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 15.01 -4.36 -0.257 0.74498E+04 140 prehnite-Fe 22.50 18.96 -3.54 -0.213 0.60486E+04 146 pyrrhotite -4.26 -6.31 -2.05 -0.683 0.34987E+04 147 pyrrhotiteFe0.875 -6.02 -7.39 -1.37 -0.503 0.23364E+04 148 pyroxmangite 7.40 6.07 -1.33 -0.267 0.22756E+04 149 pyrophyllite -6.18 -10.42 -4.24 -0.265 0.72453E+04 154 rhodochrosite -0.98 -2.90 -1.93 -0.642 0.32903E+04 155 rhodonite 7.45 6.07 -1.38 -0.276 0.23558E+04 156 sanidine -1.28 -2.52 -1.24 -0.095 0.21181E+04 158 siderite -2.61 -5.94 -3.33 -1.110 0.56869E+04 166 stilbite -7.52 -8.17 -0.65 -0.031 0.11032E+04 167 stilpnomelane-Fe 13.02 10.56 -2.45 -0.073 0.41870E+04 174 talc 16.49 12.62 -3.87 -0.228 0.66046E+04 177 tephroite 18.09 15.12 -2.96 -0.423 0.50617E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.31 -1.90 -0.633 0.32415E+04 190 wairakite 3.95 0.80 -3.15 -0.185 0.53790E+04 191 walstromite 11.51 8.23 -3.28 -0.656 0.55995E+04 192 wollastonite 10.46 8.23 -2.23 -0.446 0.38100E+04 193 pseudo-wollastonite 11.00 8.23 -2.77 -0.554 0.47298E+04 195 akaganeite 7.75 4.72 -3.04 -0.657 0.51884E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 204 montmorillonite-Ca -2.29 -6.12 -3.83 -0.237 0.65348E+04 205 montmorillonite-K -2.24 -6.09 -3.86 -0.236 0.65857E+04 206 montmorillonite-Mg -2.48 -6.62 -4.14 -0.256 0.70642E+04 207 montmorillonite-Na -2.04 -5.39 -3.35 -0.205 0.57239E+04 208 nontronite-Ca 3.21 0.57 -2.65 -0.172 0.45228E+04 209 nontronite-H 2.53 -1.29 -3.82 -0.256 0.65194E+04 210 nontronite-K 3.34 0.59 -2.75 -0.177 0.46969E+04 211 nontronite-Mg 3.07 0.07 -3.01 -0.195 0.51363E+04 212 nontronite-Na 3.52 1.29 -2.23 -0.143 0.38012E+04 228 tobermorite 9.82 6.36 -3.47 -0.946 0.59196E+04 234 alabandite -0.98 -3.27 -2.30 -0.765 0.39206E+04 237 boehmite 4.41 0.77 -3.64 -0.606 0.62101E+04 239 ferrous-oxide 9.81 6.02 -3.79 -0.948 0.64740E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.075 0.16547E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21153E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25855E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.0959900 MOLES New total amount of reactant added: 0.0999900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0999900 Water: Moles liquid = 0.4994E+02 kg liquid = 0.8998E+00 Moles total = 0.4993E+02 kg total = 0.8995E+00 Activity = 1.0000 Stoichiometric ionic strength = .1780388E-01 Osmotic coef. = 0.9232 True ionic strength = .2468935E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7278E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.34326E-09 -9.4644 0.28462E-09 -9.5457 0.82916E+00 -0.0814 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.80506E-03 -3.0942 0.66281E-03 -3.1786 0.82330E+00 -0.0844 4 SO4-- 0.51344E-03 -3.2895 0.25201E-03 -3.5986 0.49083E+00 -0.3091 5 HCO3- 0.53043E-02 -2.2754 0.43746E-02 -2.3591 0.82472E+00 -0.0837 6 HS- 0.22131E-02 -2.6550 0.18223E-02 -2.7394 0.82345E+00 -0.0844 7 Al+++ 0.70904E-27 -27.1493 0.14391E-27 -27.8419 0.20297E+00 -0.6926 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24371E-07 -7.6131 0.11858E-07 -7.9260 0.48658E+00 -0.3128 10 Mg++ 0.23373E-10 -10.6313 0.11312E-10 -10.9465 0.48396E+00 -0.3152 11 Fe++ 0.14050E-12 -12.8523 0.68084E-13 -13.1670 0.48459E+00 -0.3146 12 K+ 0.15616E-03 -3.8064 0.12882E-03 -3.8900 0.82495E+00 -0.0836 13 Na+ 0.21278E-01 -1.6721 0.17514E-01 -1.7566 0.82312E+00 -0.0845 14 Mn++ 0.18293E-09 -9.7377 0.88731E-10 -10.0519 0.48506E+00 -0.3142 15 F- 0.44413E-04 -4.3525 0.36477E-04 -4.4380 0.82132E+00 -0.0855 16 HPO4-- 0.45889E-07 -7.3383 0.22528E-07 -7.6473 0.49092E+00 -0.3090 18 HSiO3- 0.40829E-02 -2.3890 0.33615E-02 -2.4735 0.82330E+00 -0.0844 19 Ca(HSiO3)+ 0.11002E-08 -8.9585 0.90780E-09 -9.0420 0.82516E+00 -0.0835 20 Mg(HSiO3)+ 0.13060E-11 -11.8840 0.10777E-11 -11.9675 0.82516E+00 -0.0835 21 NaHSiO3,aq 0.95218E-03 -3.0213 0.95218E-03 -3.0213 0.10000E+01 0.0000 22 AlO+ 0.29290E-15 -15.5333 0.24169E-15 -15.6167 0.82516E+00 -0.0835 24 HAlO2,aq 0.16911E-09 -9.7718 0.16911E-09 -9.7718 0.10000E+01 0.0000 25 AlO2- 0.16009E-05 -5.7956 0.13152E-05 -5.8810 0.82156E+00 -0.0854 26 CH4,aq 0.30894E-07 -7.5101 0.30728E-07 -7.5125 0.99463E+00 -0.0023 27 C2H6,aq 0.10668E-17 -17.9719 0.10610E-17 -17.9743 0.99463E+00 -0.0023 31 CO,aq 0.10167E-13 -13.9928 0.10167E-13 -13.9928 0.10000E+01 0.0000 32 CO2,aq 0.26748E-05 -5.5727 0.26605E-05 -5.5750 0.99463E+00 -0.0023 33 CO3-2 0.27420E-02 -2.5619 0.13425E-02 -2.8721 0.48961E+00 -0.3102 34 CaCO3,aq 0.19962E-06 -6.6998 0.19962E-06 -6.6998 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.16048E-08 -8.7946 0.13242E-08 -8.8781 0.82516E+00 -0.0835 36 CaCl+ 0.15415E-10 -10.8121 0.12720E-10 -10.8955 0.82516E+00 -0.0835 37 CaCl2,aq 0.20030E-14 -14.6983 0.20030E-14 -14.6983 0.10000E+01 0.0000 38 CaF+ 0.76537E-11 -11.1161 0.63155E-11 -11.1996 0.82516E+00 -0.0835 39 CaOH+ 0.35986E-08 -8.4439 0.29694E-08 -8.5273 0.82516E+00 -0.0835 40 CaSO4,aq 0.94898E-09 -9.0227 0.94898E-09 -9.0227 0.10000E+01 0.0000 41 HCl,aq 0.34569E-13 -13.4613 0.34569E-13 -13.4613 0.10000E+01 0.0000 45 HF,aq 0.71073E-10 -10.1483 0.71073E-10 -10.1483 0.10000E+01 0.0000 46 HF2- 0.10632E-14 -14.9734 0.87532E-15 -15.0578 0.82330E+00 -0.0844 48 FeCl+ 0.86563E-16 -16.0627 0.71428E-16 -16.1461 0.82516E+00 -0.0835 51 FeF+ 0.15380E-15 -15.8130 0.12691E-15 -15.8965 0.82516E+00 -0.0835 53 FeO,aq 0.32665E-10 -10.4859 0.32665E-10 -10.4859 0.10000E+01 0.0000 54 FeOH+ 0.94365E-11 -11.0252 0.77866E-11 -11.1087 0.82516E+00 -0.0835 55 HFeO2- 0.14585E-08 -8.8361 0.12008E-08 -8.9205 0.82330E+00 -0.0844 56 FeO+ 0.57707E-16 -16.2388 0.47617E-16 -16.3222 0.82516E+00 -0.0835 58 FeO2- 0.14609E-09 -9.8354 0.12028E-09 -9.9198 0.82330E+00 -0.0844 59 HFeO2,aq 0.43539E-11 -11.3611 0.43539E-11 -11.3611 0.10000E+01 0.0000 60 H2,aq 0.15295E-06 -6.8154 0.15213E-06 -6.8178 0.99463E+00 -0.0023 61 KCl,aq 0.15475E-08 -8.8104 0.15475E-08 -8.8104 0.10000E+01 0.0000 62 KHSO4,aq 0.26125E-16 -16.5829 0.26125E-16 -16.5829 0.10000E+01 0.0000 63 KOH,aq 0.19329E-06 -6.7138 0.19329E-06 -6.7138 0.10000E+01 0.0000 64 KSO4- 0.61189E-06 -6.2133 0.50377E-06 -6.2978 0.82330E+00 -0.0844 65 MgCO3,aq 0.47729E-10 -10.3212 0.47729E-10 -10.3212 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.15642E-11 -11.8057 0.12907E-11 -11.8892 0.82516E+00 -0.0835 67 MgCl+ 0.13327E-13 -13.8753 0.10997E-13 -13.9587 0.82516E+00 -0.0835 68 MgF+ 0.27044E-13 -13.5679 0.22316E-13 -13.6514 0.82516E+00 -0.0835 69 MgOH+ 0.18995E-10 -10.7214 0.15673E-10 -10.8048 0.82516E+00 -0.0835 71 MnF+ 0.66069E-13 -13.1800 0.54517E-13 -13.2635 0.82516E+00 -0.0835 72 MnO,aq 0.11343E-08 -8.9453 0.11343E-08 -8.9453 0.10000E+01 0.0000 73 MnOH+ 0.11425E-08 -8.9422 0.94271E-09 -9.0256 0.82516E+00 -0.0835 74 MnO2-2 0.94915E-12 -12.0227 0.46471E-12 -12.3328 0.48961E+00 -0.3102 75 HMnO2- 0.35197E-10 -10.4535 0.28977E-10 -10.5379 0.82330E+00 -0.0844 78 MnCl+ 0.43890E-12 -12.3576 0.36216E-12 -12.4411 0.82516E+00 -0.0835 79 MnSO4,aq 0.64555E-11 -11.1901 0.64555E-11 -11.1901 0.10000E+01 0.0000 80 NaCl,aq 0.38471E-05 -5.4149 0.38471E-05 -5.4149 0.10000E+01 0.0000 81 NaF,aq 0.14957E-06 -6.8252 0.14957E-06 -6.8252 0.10000E+01 0.0000 82 NaOH,aq 0.26438E-04 -4.5778 0.26438E-04 -4.5778 0.10000E+01 0.0000 84 OH- 0.24709E-02 -2.6071 0.20300E-02 -2.6925 0.82156E+00 -0.0854 89 HPO3-2 0.21814E-16 -16.6613 0.10680E-16 -16.9714 0.48961E+00 -0.3102 92 H3PO4,aq 0.12763E-16 -16.8940 0.12763E-16 -16.8940 0.10000E+01 0.0000 93 H2PO4- 0.14350E-09 -9.8431 0.11828E-09 -9.9271 0.82422E+00 -0.0840 94 PO4-3 0.30031E-09 -9.5224 0.64578E-10 -10.1899 0.21504E+00 -0.6675 98 HP2O7-3 0.37868E-17 -17.4217 0.76959E-18 -18.1137 0.20323E+00 -0.6920 99 P2O7-4 0.10492E-16 -16.9791 0.64596E-18 -18.1898 0.61567E-01 -1.2107 100 H2S,aq 0.16117E-05 -5.7927 0.16030E-05 -5.7951 0.99463E+00 -0.0023 101 S2-2 0.98792E-09 -9.0053 0.48370E-09 -9.3154 0.48961E+00 -0.3102 102 S3-2 0.14025E-13 -13.8531 0.68666E-14 -14.1633 0.48961E+00 -0.3102 103 S3- 0.40796E-17 -17.3894 0.33588E-17 -17.4738 0.82330E+00 -0.0844 104 S4-2 0.13152E-18 -18.8810 0.64393E-19 -19.1912 0.48961E+00 -0.3102 106 SO2,aq 0.13870E-19 -19.8579 0.13870E-19 -19.8579 0.10000E+01 0.0000 107 SO3-2 0.10005E-10 -10.9998 0.49821E-11 -11.3026 0.49794E+00 -0.3028 108 HSO3- 0.10784E-12 -12.9672 0.88785E-13 -13.0517 0.82330E+00 -0.0844 109 HSO4- 0.83676E-10 -10.0774 0.69125E-10 -10.1604 0.82611E+00 -0.0830 111 S2O3-2 0.96924E-11 -11.0136 0.47455E-11 -11.3237 0.48961E+00 -0.3102 112 HS2O3- 0.29333E-18 -18.5326 0.24150E-18 -18.6171 0.82330E+00 -0.0844 Charge balance for all species = -.6121E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3432598E-09 -.1027698E-01 -.1034115E+02 0.0000 2 H2O 0.1000000E+01 0.5550571E+02 0.9982696E+06 0.0000 3 Cl- 0.8050642E-03 0.8089129E-03 0.2863014E+02 6.3671 4 SO4-- 0.5134384E-03 0.5139825E-03 0.4929090E+02 15.4929 5 HCO3- 0.5304317E-02 0.8049224E-02 0.4903147E+03 7.1867 6 HS- 0.2213070E-02 0.2214753E-02 0.7312307E+02 6.8064 7 Al+++ 0.7090366E-27 0.1601056E-05 0.4312620E-01 0.7953 8 H4SiO4 0.1024625E-02 0.6059706E-02 0.5814511E+03 -2.9894 9 Ca++ 0.2437095E-07 0.2312663E-06 0.9253095E-02 11.1655 10 Mg++ 0.2337287E-10 0.9300651E-10 0.2257370E-05 8.1450 11 Fe++ 0.1404989E-12 0.1651233E-08 0.9206123E-04 5.9245 12 K+ 0.1561572E-03 0.1569639E-03 0.6127276E+01 5.6557 13 Na+ 0.2127762E-01 0.2226024E-01 0.5108975E+03 7.7891 14 Mn++ 0.1829283E-09 0.2502830E-08 0.1372691E-03 9.0395 15 F- 0.4441348E-04 0.4456313E-04 0.8451859E+00 5.1078 16 HPO4-- 0.4588890E-07 0.4633271E-07 0.4439485E-02 11.4442 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.9260117E-02 -.9246785E-02 -.1333139E-04 0.0000000E+00 2 H2O 0.4992827E+02 0.4994167E+02 -.1339487E-01 0.0000000E+00 3 Cl- 0.7278252E-03 0.7278252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4624672E-03 0.4624594E-03 0.7776640E-08 0.0000000E+00 5 HCO3- 0.7242347E-02 0.7242347E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.1992794E-02 0.1992740E-02 0.5443648E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1440561E-05 0.3334791E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.5452264E-02 0.6700756E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1485709E-08 0.3110656E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002882E-01 0.3334791E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4009600E-04 0.4009600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.901274E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3335E-05 -5.477 0.8744E-03 -3.058 0.2171 0.3357E-03 pyrite 0.3111E-07 -7.507 0.3732E-05 -5.428 0.9264E-03 0.7446E-06 quartz 0.6691E-02 -2.175 0.4020 -0.396 99.78 0.1518 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.402859 g Volume = 0.152142 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0999900 moles log = -1.0000 Original solution: 1000.0103000 g Original solution / Rock added: 10001.10 (Water/Rock Ratio), log = 4.0000 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0209 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9994E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.2769E-03 1.0071 0.2846E-03 0.2826E-03 CH4,gas 0.4376E-04 1.0125 0.4523E-04 0.4467E-04 H2,gas 0.1955E-03 1.0005 0.1997E-03 0.1996E-03 H2S,gas 0.4334E-04 0.9960 0.4407E-04 0.4424E-04 S2,gas 0.1790E-20 1.0000 0.1827E-20 0.1827E-20 CO,gas 0.1484E-10 1.0000 0.1515E-10 0.1515E-10 SO3,gas 0.7561E-38 1.0000 0.7719E-38 0.7719E-38 SO2,gas 0.5875E-19 1.0000 0.5998E-19 0.5998E-19 HF,gas 0.1709E-12 1.0000 0.1745E-12 0.1745E-12 HCl,gas 0.5975E-16 1.0000 0.6100E-16 0.6100E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.90 -5.24 -1.748 0.89551E+04 -3.546 3 CH4,gas 4.54 -1.50 -6.04 -1.511 0.10319E+05 -4.345 4 H2,gas 8.00 2.60 -5.40 -3.085 0.92178E+04 -3.700 5 H2S,gas -6.23 -12.29 -6.05 -3.027 0.10339E+05 -4.356 6 S2,gas -7.34 -29.77 -22.44 -3.452 0.38311E+05 -20.738 7 CO,gas 3.21 -9.30 -12.52 -3.852 0.21375E+05 -10.820 8 SO3,gas 17.12 -22.69 -39.81 -9.953 0.67977E+05 -38.112 9 SO2,gas 0.83 -20.09 -20.92 -5.579 0.35722E+05 -19.222 10 HF,gas 0.47 -13.98 -14.46 -7.229 0.24685E+05 -12.758 11 HCl,gas 5.19 -12.72 -17.91 -8.957 0.30587E+05 -16.215 12 acmite 7.71 6.43 -1.28 -0.133 0.21780E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.74 -4.72 -0.236 0.80531E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.72 -4.58 -0.764 0.78279E+04 27 annite 20.12 15.26 -4.87 -0.270 0.83105E+04 34 apatite-F -34.30 -38.37 -4.07 -0.339 0.69520E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29126E+04 39 brucite 12.57 8.14 -4.42 -0.885 0.75531E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26484E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.76 -4.83 -0.322 0.82391E+04 45 celadonite 5.34 2.64 -2.70 -0.159 0.46158E+04 46 celadonite-Fe 3.88 0.42 -3.46 -0.203 0.59056E+04 54 chloritoid-Fe 9.17 4.53 -4.65 -0.310 0.79362E+04 55 chloritoid-Mn 11.40 7.64 -3.76 -0.251 0.64207E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.20 -0.350 0.71759E+04 68 diaspore 2.87 0.80 -2.08 -0.346 0.35488E+04 69 diamond -3.10 -6.70 -3.60 -1.029 0.61468E+04 70 diopside 16.18 13.33 -2.85 -0.285 0.48658E+04 71 hedenbergite 14.21 11.11 -3.10 -0.310 0.52883E+04 86 gibbsite 4.08 0.80 -3.28 -0.469 0.56073E+04 89 graphite -3.55 -6.70 -3.16 -0.902 0.53890E+04 90 greenalite 16.14 11.79 -4.34 -0.362 0.74187E+04 93 hematite 12.57 9.25 -3.32 -0.402 0.56660E+04 94 heulandite -5.83 -8.17 -2.34 -0.106 0.40000E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.12 -0.589 0.70387E+04 101 kaolinite -1.33 -4.39 -3.06 -0.278 0.52171E+04 104 laumontite 2.88 0.80 -2.09 -0.139 0.35601E+04 105 lawsonite 9.62 6.78 -2.84 -0.189 0.48472E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62266E+04 108 lizardite 23.24 18.46 -4.79 -0.399 0.81749E+04 109 magnesite 0.69 -3.76 -4.45 -1.483 0.75989E+04 110 magnetite 20.09 15.17 -4.92 -0.401 0.83924E+04 111 minnesotaite 10.39 5.82 -4.57 -0.269 0.78071E+04 119 microcline -2.49 -2.52 -0.03 -0.002 0.52540E+02 123 muscovite 2.58 -0.93 -3.51 -0.206 0.59916E+04 124 paragonite 4.24 1.21 -3.03 -0.178 0.51782E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.95 -4.42 -0.260 0.75446E+04 140 prehnite-Fe 22.50 18.78 -3.72 -0.224 0.63449E+04 146 pyrrhotite -4.26 -6.36 -2.10 -0.700 0.35862E+04 147 pyrrhotiteFe0.875 -6.02 -7.42 -1.41 -0.517 0.24020E+04 148 pyroxmangite 7.40 6.05 -1.35 -0.270 0.23026E+04 149 pyrophyllite -6.18 -10.37 -4.19 -0.262 0.71565E+04 154 rhodochrosite -0.98 -2.87 -1.89 -0.630 0.32253E+04 155 rhodonite 7.45 6.05 -1.40 -0.279 0.23829E+04 156 sanidine -1.28 -2.52 -1.24 -0.096 0.21203E+04 158 siderite -2.61 -5.98 -3.37 -1.124 0.57578E+04 166 stilbite -7.52 -8.17 -0.65 -0.031 0.11062E+04 167 stilpnomelane-Fe 13.02 10.13 -2.89 -0.086 0.49369E+04 174 talc 16.49 12.48 -4.01 -0.236 0.68535E+04 177 tephroite 18.09 15.09 -3.00 -0.428 0.51158E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.36 -1.95 -0.650 0.33290E+04 190 wairakite 3.95 0.80 -3.15 -0.185 0.53821E+04 191 walstromite 11.51 8.18 -3.33 -0.667 0.56913E+04 192 wollastonite 10.46 8.18 -2.29 -0.457 0.39017E+04 193 pseudo-wollastonite 11.00 8.18 -2.82 -0.565 0.48215E+04 195 akaganeite 7.75 4.62 -3.13 -0.677 0.53456E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 204 montmorillonite-Ca -2.29 -6.10 -3.81 -0.236 0.65032E+04 205 montmorillonite-K -2.24 -6.08 -3.84 -0.235 0.65543E+04 206 montmorillonite-Mg -2.48 -6.60 -4.12 -0.255 0.70312E+04 207 montmorillonite-Na -2.04 -5.37 -3.33 -0.204 0.56919E+04 208 nontronite-Ca 3.21 0.38 -2.83 -0.184 0.48376E+04 209 nontronite-H 2.53 -1.46 -3.99 -0.268 0.68191E+04 210 nontronite-K 3.34 0.41 -2.94 -0.188 0.50119E+04 211 nontronite-Mg 3.07 -0.12 -3.19 -0.207 0.54497E+04 212 nontronite-Na 3.52 1.11 -2.41 -0.155 0.41155E+04 228 tobermorite 9.82 6.31 -3.51 -0.958 0.59960E+04 234 alabandite -0.98 -3.25 -2.27 -0.756 0.38720E+04 237 boehmite 4.41 0.80 -3.61 -0.602 0.61657E+04 239 ferrous-oxide 9.81 5.92 -3.89 -0.972 0.66371E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.075 0.16553E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21160E+04 249 an30ab70 3.28 1.76 -1.51 -0.117 0.25864E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.0999900 MOLES New total amount of reactant added: 0.1039900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1039900 Water: Moles liquid = 0.4995E+02 kg liquid = 0.8998E+00 Moles total = 0.4993E+02 kg total = 0.8995E+00 Activity = 1.0000 Stoichiometric ionic strength = .1806305E-01 Osmotic coef. = 0.9227 True ionic strength = .2475763E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7514E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.36629E-09 -9.4362 0.30366E-09 -9.5176 0.82901E+00 -0.0814 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.83110E-03 -3.0803 0.68411E-03 -3.1649 0.82314E+00 -0.0845 4 SO4-- 0.53460E-03 -3.2720 0.26220E-03 -3.5814 0.49046E+00 -0.3094 5 HCO3- 0.56349E-02 -2.2491 0.46463E-02 -2.3329 0.82456E+00 -0.0838 6 HS- 0.22995E-02 -2.6384 0.18932E-02 -2.7228 0.82328E+00 -0.0845 7 Al+++ 0.91796E-27 -27.0372 0.18599E-27 -27.7305 0.20261E+00 -0.6933 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24497E-07 -7.6109 0.11910E-07 -7.9241 0.48620E+00 -0.3132 10 Mg++ 0.23738E-10 -10.6246 0.11479E-10 -10.9401 0.48358E+00 -0.3155 11 Fe++ 0.12815E-12 -12.8923 0.62049E-13 -13.2073 0.48420E+00 -0.3150 12 K+ 0.15613E-03 -3.8065 0.12878E-03 -3.8902 0.82479E+00 -0.0837 13 Na+ 0.21335E-01 -1.6709 0.17558E-01 -1.7555 0.82296E+00 -0.0846 14 Mn++ 0.20028E-09 -9.6984 0.97070E-10 -10.0129 0.48467E+00 -0.3146 15 F- 0.46182E-04 -4.3355 0.37922E-04 -4.4211 0.82115E+00 -0.0856 16 HPO4-- 0.45894E-07 -7.3382 0.22513E-07 -7.6476 0.49054E+00 -0.3093 18 HSiO3- 0.38277E-02 -2.4171 0.31507E-02 -2.5016 0.82314E+00 -0.0845 19 Ca(HSiO3)+ 0.10359E-08 -8.9847 0.85462E-09 -9.0682 0.82500E+00 -0.0835 20 Mg(HSiO3)+ 0.12425E-11 -11.9057 0.10251E-11 -11.9892 0.82500E+00 -0.0835 21 NaHSiO3,aq 0.89472E-03 -3.0483 0.89472E-03 -3.0483 0.10000E+01 0.0000 22 AlO+ 0.33263E-15 -15.4780 0.27442E-15 -15.5616 0.82500E+00 -0.0835 24 HAlO2,aq 0.17997E-09 -9.7448 0.17997E-09 -9.7448 0.10000E+01 0.0000 25 AlO2- 0.15972E-05 -5.7966 0.13120E-05 -5.8821 0.82140E+00 -0.0854 26 CH4,aq 0.32766E-07 -7.4846 0.32588E-07 -7.4869 0.99455E+00 -0.0024 27 C2H6,aq 0.12199E-17 -17.9137 0.12133E-17 -17.9160 0.99455E+00 -0.0024 31 CO,aq 0.11332E-13 -13.9457 0.11332E-13 -13.9457 0.10000E+01 0.0000 32 CO2,aq 0.30312E-05 -5.5184 0.30147E-05 -5.5208 0.99455E+00 -0.0024 33 CO3-2 0.27319E-02 -2.5635 0.13365E-02 -2.8740 0.48923E+00 -0.3105 34 CaCO3,aq 0.19960E-06 -6.6998 0.19960E-06 -6.6998 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.17123E-08 -8.7664 0.14126E-08 -8.8500 0.82500E+00 -0.0835 36 CaCl+ 0.15983E-10 -10.7963 0.13186E-10 -10.8799 0.82500E+00 -0.0835 37 CaCl2,aq 0.21432E-14 -14.6689 0.21432E-14 -14.6689 0.10000E+01 0.0000 38 CaF+ 0.79933E-11 -11.0973 0.65945E-11 -11.1808 0.82500E+00 -0.0835 39 CaOH+ 0.33884E-08 -8.4700 0.27954E-08 -8.5535 0.82500E+00 -0.0835 40 CaSO4,aq 0.99167E-09 -9.0036 0.99167E-09 -9.0036 0.10000E+01 0.0000 41 HCl,aq 0.38066E-13 -13.4195 0.38066E-13 -13.4195 0.10000E+01 0.0000 45 HF,aq 0.78831E-10 -10.1033 0.78831E-10 -10.1033 0.10000E+01 0.0000 46 HF2- 0.12262E-14 -14.9114 0.10093E-14 -14.9960 0.82314E+00 -0.0845 48 FeCl+ 0.81441E-16 -16.0892 0.67189E-16 -16.1727 0.82500E+00 -0.0835 51 FeF+ 0.14575E-15 -15.8364 0.12024E-15 -15.9199 0.82500E+00 -0.0835 53 FeO,aq 0.26154E-10 -10.5825 0.26154E-10 -10.5825 0.10000E+01 0.0000 54 FeOH+ 0.80624E-11 -11.0935 0.66515E-11 -11.1771 0.82500E+00 -0.0835 55 HFeO2- 0.10948E-08 -8.9607 0.90119E-09 -9.0452 0.82314E+00 -0.0845 56 FeO+ 0.49714E-16 -16.3035 0.41014E-16 -16.3871 0.82500E+00 -0.0835 58 FeO2- 0.11057E-09 -9.9564 0.91016E-10 -10.0409 0.82314E+00 -0.0845 59 HFeO2,aq 0.35151E-11 -11.4541 0.35151E-11 -11.4541 0.10000E+01 0.0000 60 H2,aq 0.15045E-06 -6.8226 0.14963E-06 -6.8250 0.99455E+00 -0.0024 61 KCl,aq 0.15967E-08 -8.7968 0.15967E-08 -8.7968 0.10000E+01 0.0000 62 KHSO4,aq 0.28989E-16 -16.5378 0.28989E-16 -16.5378 0.10000E+01 0.0000 63 KOH,aq 0.18111E-06 -6.7421 0.18111E-06 -6.7421 0.10000E+01 0.0000 64 KSO4- 0.63653E-06 -6.1962 0.52395E-06 -6.2807 0.82314E+00 -0.0845 65 MgCO3,aq 0.48219E-10 -10.3168 0.48219E-10 -10.3168 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.16863E-11 -11.7731 0.13912E-11 -11.8566 0.82500E+00 -0.0835 67 MgCl+ 0.13962E-13 -13.8551 0.11518E-13 -13.9386 0.82500E+00 -0.0835 68 MgF+ 0.28538E-13 -13.5446 0.23543E-13 -13.6281 0.82500E+00 -0.0835 69 MgOH+ 0.18071E-10 -10.7430 0.14908E-10 -10.8266 0.82500E+00 -0.0835 71 MnF+ 0.75156E-13 -13.1240 0.62004E-13 -13.2076 0.82500E+00 -0.0835 72 MnO,aq 0.10902E-08 -8.9625 0.10902E-08 -8.9625 0.10000E+01 0.0000 73 MnOH+ 0.11717E-08 -8.9312 0.96665E-09 -9.0147 0.82500E+00 -0.0835 74 MnO2-2 0.80207E-12 -12.0958 0.39240E-12 -12.4063 0.48923E+00 -0.3105 75 HMnO2- 0.31713E-10 -10.4988 0.26105E-10 -10.5833 0.82314E+00 -0.0845 78 MnCl+ 0.49567E-12 -12.3048 0.40893E-12 -12.3884 0.82500E+00 -0.0835 79 MnSO4,aq 0.73477E-11 -11.1338 0.73477E-11 -11.1338 0.10000E+01 0.0000 80 NaCl,aq 0.39806E-05 -5.4000 0.39806E-05 -5.4000 0.10000E+01 0.0000 81 NaF,aq 0.15588E-06 -6.8072 0.15588E-06 -6.8072 0.10000E+01 0.0000 82 NaOH,aq 0.24843E-04 -4.6048 0.24843E-04 -4.6048 0.10000E+01 0.0000 84 OH- 0.23165E-02 -2.6352 0.19027E-02 -2.7206 0.82140E+00 -0.0854 89 HPO3-2 0.21458E-16 -16.6684 0.10498E-16 -16.9789 0.48923E+00 -0.3105 92 H3PO4,aq 0.14518E-16 -16.8381 0.14518E-16 -16.8381 0.10000E+01 0.0000 93 H2PO4- 0.15303E-09 -9.8152 0.12611E-09 -9.8993 0.82406E+00 -0.0840 94 PO4-3 0.28176E-09 -9.5501 0.60490E-10 -10.2183 0.21469E+00 -0.6682 98 HP2O7-3 0.40419E-17 -17.3934 0.82000E-18 -18.0862 0.20287E+00 -0.6928 99 P2O7-4 0.10510E-16 -16.9784 0.64512E-18 -18.1904 0.61379E-01 -1.2120 100 H2S,aq 0.17864E-05 -5.7480 0.17767E-05 -5.7504 0.99455E+00 -0.0024 101 S2-2 0.10848E-08 -8.9646 0.53074E-09 -9.2751 0.48923E+00 -0.3105 102 S3-2 0.17354E-13 -13.7606 0.84902E-14 -14.0711 0.48923E+00 -0.3105 103 S3- 0.54274E-17 -17.2654 0.44676E-17 -17.3499 0.82314E+00 -0.0845 104 S4-2 0.18339E-18 -18.7366 0.89718E-19 -19.0471 0.48923E+00 -0.3105 106 SO2,aq 0.16156E-19 -19.7917 0.16156E-19 -19.7917 0.10000E+01 0.0000 107 SO3-2 0.10246E-10 -10.9894 0.50984E-11 -11.2926 0.49758E+00 -0.3031 108 HSO3- 0.11776E-12 -12.9290 0.96934E-13 -13.0135 0.82314E+00 -0.0845 109 HSO4- 0.92898E-10 -10.0320 0.76730E-10 -10.1150 0.82595E+00 -0.0830 111 S2O3-2 0.11185E-10 -10.9513 0.54723E-11 -11.2618 0.48923E+00 -0.3105 112 HS2O3- 0.36095E-18 -18.4426 0.29711E-18 -18.5271 0.82314E+00 -0.0845 Charge balance for all species = -.6121E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3662853E-09 -.9797555E-02 -.9858745E+01 0.0000 2 H2O 0.1000000E+01 0.5550587E+02 0.9982738E+06 0.0000 3 Cl- 0.8310982E-03 0.8350804E-03 0.2955633E+02 6.3527 4 SO4-- 0.5346031E-03 0.5351707E-03 0.5132292E+02 15.4539 5 HCO3- 0.5634899E-02 0.8370024E-02 0.5098568E+03 7.1847 6 HS- 0.2299524E-02 0.2301383E-02 0.7598338E+02 6.7948 7 Al+++ 0.9179617E-27 0.1597403E-05 0.4302787E-01 0.8223 8 H4SiO4 0.1024625E-02 0.5747021E-02 0.5514485E+03 -2.9894 9 Ca++ 0.2449715E-07 0.2312492E-06 0.9252423E-02 11.1112 10 Mg++ 0.2373811E-10 0.9299963E-10 0.2257206E-05 8.0951 11 Fe++ 0.1281476E-12 0.1243253E-08 0.6931521E-04 5.8280 12 K+ 0.1561330E-03 0.1569523E-03 0.6126830E+01 5.6275 13 Na+ 0.2133490E-01 0.2225859E-01 0.5108603E+03 7.7621 14 Mn++ 0.2002798E-09 0.2502644E-08 0.1372591E-03 9.0223 15 F- 0.4618199E-04 0.4633796E-04 0.8788486E+00 5.0965 16 HPO4-- 0.4589449E-07 0.4632928E-07 0.4439162E-02 11.3877 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.8829417E-02 -.8816073E-02 -.1334401E-04 0.0000000E+00 2 H2O 0.4993155E+02 0.4994550E+02 -.1395678E-01 0.0000000E+00 3 Cl- 0.7514252E-03 0.7514252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4815672E-03 0.4815593E-03 0.7868390E-08 0.0000000E+00 5 HCO3- 0.7531547E-02 0.7531547E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2070894E-02 0.2070839E-02 0.5507873E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1437381E-05 0.3337971E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.5171306E-02 0.6981714E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1118709E-08 0.3147356E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002881E-01 0.3337971E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4169600E-04 0.4169600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8470E-21 Mass of aqueous solution: 0.901339E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1039900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3338E-05 -5.477 0.8753E-03 -3.058 0.2085 0.3360E-03 pyrite 0.3147E-07 -7.502 0.3776E-05 -5.423 0.8997E-03 0.7534E-06 quartz 0.6972E-02 -2.157 0.4189 -0.378 99.79 0.1582 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.419739 g Volume = 0.158516 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1039900 moles log = -0.9830 Original solution: 1000.0103000 g Original solution / Rock added: 9616.41 (Water/Rock Ratio), log = 3.9830 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0209 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9994E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.3137E-03 1.0071 0.3225E-03 0.3203E-03 CH4,gas 0.4640E-04 1.0125 0.4797E-04 0.4737E-04 H2,gas 0.1923E-03 1.0005 0.1965E-03 0.1963E-03 H2S,gas 0.4803E-04 0.9960 0.4884E-04 0.4903E-04 S2,gas 0.2273E-20 1.0000 0.2320E-20 0.2320E-20 CO,gas 0.1654E-10 1.0000 0.1689E-10 0.1689E-10 SO3,gas 0.8954E-38 1.0000 0.9141E-38 0.9141E-38 SO2,gas 0.6843E-19 1.0000 0.6987E-19 0.6987E-19 HF,gas 0.1896E-12 1.0000 0.1936E-12 0.1936E-12 HCl,gas 0.6579E-16 1.0000 0.6717E-16 0.6717E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.85 -5.19 -1.730 0.88624E+04 -3.491 3 CH4,gas 4.54 -1.47 -6.02 -1.505 0.10276E+05 -4.319 4 H2,gas 8.00 2.59 -5.41 -3.089 0.92301E+04 -3.707 5 H2S,gas -6.23 -12.24 -6.01 -3.005 0.10262E+05 -4.311 6 S2,gas -7.34 -29.67 -22.33 -3.436 0.38134E+05 -20.634 7 CO,gas 3.21 -9.26 -12.47 -3.837 0.21295E+05 -10.772 8 SO3,gas 17.12 -22.62 -39.74 -9.934 0.67851E+05 -38.039 9 SO2,gas 0.83 -20.02 -20.85 -5.561 0.35609E+05 -19.156 10 HF,gas 0.47 -13.94 -14.41 -7.206 0.24608E+05 -12.713 11 HCl,gas 5.19 -12.68 -17.87 -8.936 0.30516E+05 -16.173 12 acmite 7.71 6.31 -1.40 -0.145 0.23829E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.74 -4.71 -0.236 0.80490E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.76 -4.63 -0.771 0.79001E+04 34 apatite-F -34.30 -38.43 -4.13 -0.344 0.70524E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29127E+04 39 brucite 12.57 8.10 -4.47 -0.895 0.76382E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26485E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.76 -4.82 -0.321 0.82319E+04 45 celadonite 5.34 2.59 -2.75 -0.162 0.47030E+04 46 celadonite-Fe 3.88 0.32 -3.56 -0.209 0.60726E+04 54 chloritoid-Fe 9.17 4.48 -4.69 -0.313 0.80087E+04 55 chloritoid-Mn 11.40 7.68 -3.72 -0.248 0.63577E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.20 -0.350 0.71780E+04 68 diaspore 2.87 0.82 -2.05 -0.342 0.35026E+04 69 diamond -3.10 -6.66 -3.56 -1.017 0.60787E+04 70 diopside 16.18 13.23 -2.95 -0.295 0.50437E+04 71 hedenbergite 14.21 10.96 -3.25 -0.325 0.55459E+04 86 gibbsite 4.08 0.82 -3.26 -0.465 0.55612E+04 89 graphite -3.55 -6.66 -3.12 -0.890 0.53209E+04 90 greenalite 16.14 11.51 -4.63 -0.386 0.79132E+04 93 hematite 12.57 9.06 -3.50 -0.425 0.59835E+04 94 heulandite -5.83 -8.17 -2.34 -0.106 0.40005E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.12 -0.589 0.70408E+04 101 kaolinite -1.33 -4.33 -3.00 -0.273 0.51248E+04 104 laumontite 2.88 0.80 -2.09 -0.139 0.35606E+04 105 lawsonite 9.62 6.78 -2.84 -0.189 0.48476E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62287E+04 108 lizardite 23.24 18.31 -4.94 -0.411 0.84303E+04 109 magnesite 0.69 -3.76 -4.45 -1.482 0.75914E+04 111 minnesotaite 10.39 5.53 -4.86 -0.286 0.83016E+04 119 microcline -2.49 -2.52 -0.03 -0.002 0.54644E+02 123 muscovite 2.58 -0.87 -3.46 -0.203 0.59014E+04 124 paragonite 4.24 1.26 -2.98 -0.175 0.50859E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.90 -4.47 -0.263 0.76378E+04 140 prehnite-Fe 22.50 18.61 -3.89 -0.234 0.66430E+04 146 pyrrhotite -4.26 -6.41 -2.15 -0.717 0.36747E+04 147 pyrrhotiteFe0.875 -6.02 -7.46 -1.45 -0.532 0.24684E+04 148 pyroxmangite 7.40 6.03 -1.37 -0.273 0.23320E+04 149 pyrophyllite -6.18 -10.31 -4.14 -0.259 0.70642E+04 154 rhodochrosite -0.98 -2.83 -1.85 -0.617 0.31620E+04 155 rhodonite 7.45 6.03 -1.41 -0.283 0.24123E+04 156 sanidine -1.28 -2.52 -1.24 -0.096 0.21224E+04 158 siderite -2.61 -6.02 -3.41 -1.138 0.58300E+04 166 stilbite -7.52 -8.17 -0.65 -0.031 0.11067E+04 167 stilpnomelane-Fe 13.02 9.68 -3.33 -0.100 0.56930E+04 174 talc 16.49 12.33 -4.16 -0.245 0.71088E+04 177 tephroite 18.09 15.06 -3.03 -0.433 0.51746E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.41 -2.00 -0.667 0.34175E+04 190 wairakite 3.95 0.80 -3.15 -0.185 0.53825E+04 191 walstromite 11.51 8.12 -3.39 -0.677 0.57841E+04 192 wollastonite 10.46 8.12 -2.34 -0.468 0.39945E+04 193 pseudo-wollastonite 11.00 8.12 -2.88 -0.576 0.49143E+04 195 akaganeite 7.75 4.53 -3.22 -0.697 0.55043E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.27 -4.95 -0.618 0.84484E+04 204 montmorillonite-Ca -2.29 -6.08 -3.79 -0.234 0.64695E+04 205 montmorillonite-K -2.24 -6.06 -3.82 -0.234 0.65212E+04 206 montmorillonite-Mg -2.48 -6.58 -4.10 -0.253 0.69963E+04 207 montmorillonite-Na -2.04 -5.35 -3.31 -0.203 0.56581E+04 208 nontronite-Ca 3.21 0.20 -3.02 -0.196 0.51551E+04 209 nontronite-H 2.53 -1.64 -4.17 -0.280 0.71213E+04 210 nontronite-K 3.34 0.22 -3.12 -0.200 0.53300E+04 211 nontronite-Mg 3.07 -0.30 -3.38 -0.219 0.57659E+04 212 nontronite-Na 3.52 0.92 -2.60 -0.167 0.44329E+04 228 tobermorite 9.82 6.27 -3.56 -0.971 0.60733E+04 234 alabandite -0.98 -3.22 -2.24 -0.747 0.38251E+04 237 boehmite 4.41 0.82 -3.58 -0.597 0.61195E+04 239 ferrous-oxide 9.81 5.83 -3.98 -0.996 0.68019E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.075 0.16553E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21162E+04 249 an30ab70 3.28 1.76 -1.51 -0.117 0.25866E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1039900 MOLES New total amount of reactant added: 0.1079900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1079900 Water: Moles liquid = 0.4995E+02 kg liquid = 0.8999E+00 Moles total = 0.4993E+02 kg total = 0.8996E+00 Activity = 1.0000 Stoichiometric ionic strength = .1832219E-01 Osmotic coef. = 0.9222 True ionic strength = .2481310E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7750E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.39186E-09 -9.4069 0.32481E-09 -9.4884 0.82889E+00 -0.0815 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.85713E-03 -3.0670 0.70543E-03 -3.1515 0.82301E+00 -0.0846 4 SO4-- 0.55576E-03 -3.2551 0.27241E-03 -3.5648 0.49015E+00 -0.3097 5 HCO3- 0.59769E-02 -2.2235 0.49276E-02 -2.3074 0.82443E+00 -0.0838 6 HS- 0.23859E-02 -2.6223 0.19640E-02 -2.7069 0.82315E+00 -0.0845 7 Al+++ 0.12006E-26 -26.9206 0.24290E-27 -27.6146 0.20232E+00 -0.6940 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.24707E-07 -7.6072 0.12005E-07 -7.9206 0.48589E+00 -0.3135 10 Mg++ 0.24154E-10 -10.6170 0.11673E-10 -10.9328 0.48326E+00 -0.3158 11 Fe++ 0.11712E-12 -12.9314 0.56671E-13 -13.2466 0.48389E+00 -0.3153 12 K+ 0.15611E-03 -3.8066 0.12874E-03 -3.8903 0.82466E+00 -0.0837 13 Na+ 0.21391E-01 -1.6698 0.17601E-01 -1.7545 0.82283E+00 -0.0847 14 Mn++ 0.21962E-09 -9.6583 0.10638E-09 -9.9732 0.48436E+00 -0.3148 15 F- 0.47950E-04 -4.3192 0.39368E-04 -4.4049 0.82102E+00 -0.0856 16 HPO4-- 0.45899E-07 -7.3382 0.22501E-07 -7.6478 0.49023E+00 -0.3096 18 HSiO3- 0.35789E-02 -2.4462 0.29455E-02 -2.5308 0.82301E+00 -0.0846 19 Ca(HSiO3)+ 0.97626E-09 -9.0104 0.80529E-09 -9.0940 0.82487E+00 -0.0836 20 Mg(HSiO3)+ 0.11813E-11 -11.9276 0.97446E-12 -12.0112 0.82487E+00 -0.0836 21 NaHSiO3,aq 0.83850E-03 -3.0765 0.83850E-03 -3.0765 0.10000E+01 0.0000 22 AlO+ 0.37972E-15 -15.4205 0.31322E-15 -15.5042 0.82487E+00 -0.0836 24 HAlO2,aq 0.19204E-09 -9.7166 0.19204E-09 -9.7166 0.10000E+01 0.0000 25 AlO2- 0.15936E-05 -5.7976 0.13087E-05 -5.8832 0.82126E+00 -0.0855 26 CH4,aq 0.34701E-07 -7.4597 0.34510E-07 -7.4621 0.99447E+00 -0.0024 27 C2H6,aq 0.13919E-17 -17.8564 0.13842E-17 -17.8588 0.99447E+00 -0.0024 31 CO,aq 0.12636E-13 -13.8984 0.12636E-13 -13.8984 0.10000E+01 0.0000 32 CO2,aq 0.34390E-05 -5.4636 0.34200E-05 -5.4660 0.99447E+00 -0.0024 33 CO3-2 0.27102E-02 -2.5670 0.13251E-02 -2.8778 0.48892E+00 -0.3108 34 CaCO3,aq 0.19946E-06 -6.7001 0.19946E-06 -6.7001 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.18306E-08 -8.7374 0.15100E-08 -8.8210 0.82487E+00 -0.0836 36 CaCl+ 0.16614E-10 -10.7795 0.13705E-10 -10.8631 0.82487E+00 -0.0836 37 CaCl2,aq 0.22968E-14 -14.6389 0.22968E-14 -14.6389 0.10000E+01 0.0000 38 CaF+ 0.83651E-11 -11.0775 0.69001E-11 -11.1611 0.82487E+00 -0.0836 39 CaOH+ 0.31933E-08 -8.4958 0.26341E-08 -8.5794 0.82487E+00 -0.0836 40 CaSO4,aq 0.10385E-08 -8.9836 0.10385E-08 -8.9836 0.10000E+01 0.0000 41 HCl,aq 0.41987E-13 -13.3769 0.41987E-13 -13.3769 0.10000E+01 0.0000 45 HF,aq 0.87537E-10 -10.0578 0.87537E-10 -10.0578 0.10000E+01 0.0000 46 HF2- 0.14137E-14 -14.8496 0.11635E-14 -14.9342 0.82301E+00 -0.0846 48 FeCl+ 0.76711E-16 -16.1151 0.63277E-16 -16.1988 0.82487E+00 -0.0836 51 FeF+ 0.13821E-15 -15.8595 0.11401E-15 -15.9431 0.82487E+00 -0.0836 53 FeO,aq 0.20876E-10 -10.6803 0.20876E-10 -10.6803 0.10000E+01 0.0000 54 FeOH+ 0.68850E-11 -11.1621 0.56792E-11 -11.2457 0.82487E+00 -0.0836 55 HFeO2- 0.81711E-09 -9.0877 0.67249E-09 -9.1723 0.82301E+00 -0.0846 56 FeO+ 0.42821E-16 -16.3683 0.35321E-16 -16.4520 0.82487E+00 -0.0836 58 FeO2- 0.83237E-10 -10.0797 0.68505E-10 -10.1643 0.82301E+00 -0.0846 59 HFeO2,aq 0.28300E-11 -11.5482 0.28300E-11 -11.5482 0.10000E+01 0.0000 60 H2,aq 0.14790E-06 -6.8300 0.14708E-06 -6.8324 0.99447E+00 -0.0024 61 KCl,aq 0.16459E-08 -8.7836 0.16459E-08 -8.7836 0.10000E+01 0.0000 62 KHSO4,aq 0.32206E-16 -16.4921 0.32206E-16 -16.4921 0.10000E+01 0.0000 63 KOH,aq 0.16926E-06 -6.7714 0.16926E-06 -6.7714 0.10000E+01 0.0000 64 KSO4- 0.66121E-06 -6.1797 0.54418E-06 -6.2643 0.82301E+00 -0.0846 65 MgCO3,aq 0.48613E-10 -10.3132 0.48613E-10 -10.3132 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.18187E-11 -11.7402 0.15002E-11 -11.8238 0.82487E+00 -0.0836 67 MgCl+ 0.14642E-13 -13.8344 0.12077E-13 -13.9180 0.82487E+00 -0.0836 68 MgF+ 0.30129E-13 -13.5210 0.24853E-13 -13.6046 0.82487E+00 -0.0836 69 MgOH+ 0.17181E-10 -10.7649 0.14172E-10 -10.8486 0.82487E+00 -0.0836 71 MnF+ 0.85514E-13 -13.0680 0.70538E-13 -13.1516 0.82487E+00 -0.0836 72 MnO,aq 0.10442E-08 -8.9812 0.10442E-08 -8.9812 0.10000E+01 0.0000 73 MnOH+ 0.12006E-08 -8.9206 0.99032E-09 -9.0042 0.82487E+00 -0.0836 74 MnO2-2 0.67179E-12 -12.1728 0.32846E-12 -12.4835 0.48892E+00 -0.3108 75 HMnO2- 0.28400E-10 -10.5467 0.23373E-10 -10.6313 0.82301E+00 -0.0846 78 MnCl+ 0.56020E-12 -12.2517 0.46209E-12 -12.3353 0.82487E+00 -0.0836 79 MnSO4,aq 0.83657E-11 -11.0775 0.83657E-11 -11.0775 0.10000E+01 0.0000 80 NaCl,aq 0.41147E-05 -5.3857 0.41147E-05 -5.3857 0.10000E+01 0.0000 81 NaF,aq 0.16222E-06 -6.7899 0.16222E-06 -6.7899 0.10000E+01 0.0000 82 NaOH,aq 0.23282E-04 -4.6330 0.23282E-04 -4.6330 0.10000E+01 0.0000 84 OH- 0.21659E-02 -2.6644 0.17788E-02 -2.7499 0.82126E+00 -0.0855 89 HPO3-2 0.21094E-16 -16.6758 0.10313E-16 -16.9866 0.48892E+00 -0.3108 92 H3PO4,aq 0.16603E-16 -16.7798 0.16603E-16 -16.7798 0.10000E+01 0.0000 93 H2PO4- 0.16364E-09 -9.7861 0.13482E-09 -9.8702 0.82393E+00 -0.0841 94 PO4-3 0.26362E-09 -9.5790 0.56520E-10 -10.2478 0.21440E+00 -0.6688 98 HP2O7-3 0.43251E-17 -17.3640 0.87620E-18 -18.0574 0.20258E+00 -0.6934 99 P2O7-4 0.10525E-16 -16.9778 0.64443E-18 -18.1908 0.61227E-01 -1.2131 100 H2S,aq 0.19826E-05 -5.7028 0.19716E-05 -5.7052 0.99447E+00 -0.0024 101 S2-2 0.11886E-08 -8.9250 0.58111E-09 -9.2357 0.48892E+00 -0.3108 102 S3-2 0.21465E-13 -13.6683 0.10495E-13 -13.9790 0.48892E+00 -0.3108 103 S3- 0.72395E-17 -17.1403 0.59582E-17 -17.2249 0.82301E+00 -0.0846 104 S4-2 0.25608E-18 -18.5916 0.12520E-18 -18.9024 0.48892E+00 -0.3108 106 SO2,aq 0.18878E-19 -19.7240 0.18878E-19 -19.7240 0.10000E+01 0.0000 107 SO3-2 0.10470E-10 -10.9800 0.52066E-11 -11.2834 0.49728E+00 -0.3034 108 HSO3- 0.12866E-12 -12.8906 0.10589E-12 -12.9752 0.82301E+00 -0.0846 109 HSO4- 0.10326E-09 -9.9861 0.85271E-10 -10.0692 0.82582E+00 -0.0831 111 S2O3-2 0.12904E-10 -10.8893 0.63090E-11 -11.2000 0.48892E+00 -0.3108 112 HS2O3- 0.44521E-18 -18.3514 0.36641E-18 -18.4360 0.82301E+00 -0.0846 Charge balance for all species = -.6120E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3918638E-09 -.9318204E-02 -.9376406E+01 0.0000 2 H2O 0.1000000E+01 0.5550602E+02 0.9982772E+06 0.0000 3 Cl- 0.8571278E-03 0.8612442E-03 0.3048238E+02 6.3368 4 SO4-- 0.5557649E-03 0.5563559E-03 0.5335463E+02 15.4120 5 HCO3- 0.5976903E-02 0.8690779E-02 0.5293959E+03 7.1810 6 HS- 0.2385945E-02 0.2388001E-02 0.7884325E+02 6.7815 7 Al+++ 0.1200559E-26 0.1593749E-05 0.4292947E-01 0.8505 8 H4SiO4 0.1024625E-02 0.5442054E-02 0.5221861E+03 -2.9894 9 Ca++ 0.2470708E-07 0.2312321E-06 0.9251746E-02 11.0561 10 Mg++ 0.2415386E-10 0.9299277E-10 0.2257041E-05 8.0439 11 Fe++ 0.1171150E-12 0.9310533E-09 0.5190915E-04 5.7301 12 K+ 0.1561086E-03 0.1569407E-03 0.6126383E+01 5.5981 13 Na+ 0.2139089E-01 0.2225695E-01 0.5108229E+03 7.7339 14 Mn++ 0.2196217E-09 0.2502460E-08 0.1372491E-03 9.0036 15 F- 0.4795022E-04 0.4811254E-04 0.9125059E+00 5.0835 16 HPO4-- 0.4589861E-07 0.4632586E-07 0.4438838E-02 11.3289 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.8398717E-02 -.8385360E-02 -.1335667E-04 0.0000000E+00 2 H2O 0.4993482E+02 0.4994932E+02 -.1450489E-01 0.0000000E+00 3 Cl- 0.7750252E-03 0.7750252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5006672E-03 0.5006593E-03 0.7938606E-08 0.0000000E+00 5 HCO3- 0.7820747E-02 0.7820747E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2148994E-02 0.2148939E-02 0.5557024E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1434199E-05 0.3341153E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.4897251E-02 0.7255769E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.8378458E-09 0.3175442E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002881E-01 0.3341153E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4329600E-04 0.4329600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.901405E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1079900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3341E-05 -5.476 0.8761E-03 -3.057 0.2009 0.3363E-03 pyrite 0.3175E-07 -7.498 0.3810E-05 -5.419 0.8734E-03 0.7602E-06 quartz 0.7246E-02 -2.140 0.4353 -0.361 99.80 0.1644 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.436204 g Volume = 0.164735 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1079900 moles log = -0.9666 Original solution: 1000.0103000 g Original solution / Rock added: 9260.21 (Water/Rock Ratio), log = 3.9666 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0210 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9994E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.3559E-03 1.0071 0.3659E-03 0.3633E-03 CH4,gas 0.4914E-04 1.0125 0.5080E-04 0.5017E-04 H2,gas 0.1890E-03 1.0005 0.1931E-03 0.1930E-03 H2S,gas 0.5330E-04 0.9960 0.5420E-04 0.5441E-04 S2,gas 0.2896E-20 1.0000 0.2957E-20 0.2957E-20 CO,gas 0.1844E-10 1.0000 0.1883E-10 0.1883E-10 SO3,gas 0.1064E-37 1.0000 0.1087E-37 0.1087E-37 SO2,gas 0.7996E-19 1.0000 0.8164E-19 0.8164E-19 HF,gas 0.2105E-12 1.0000 0.2149E-12 0.2149E-12 HCl,gas 0.7257E-16 1.0000 0.7409E-16 0.7409E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.80 -5.14 -1.712 0.87689E+04 -3.437 3 CH4,gas 4.54 -1.45 -5.99 -1.498 0.10233E+05 -4.294 4 H2,gas 8.00 2.59 -5.41 -3.093 0.92429E+04 -3.714 5 H2S,gas -6.23 -12.20 -5.96 -2.982 0.10185E+05 -4.266 6 S2,gas -7.34 -29.56 -22.23 -3.420 0.37954E+05 -20.529 7 CO,gas 3.21 -9.21 -12.42 -3.823 0.21214E+05 -10.725 8 SO3,gas 17.12 -22.54 -39.66 -9.916 0.67723E+05 -37.964 9 SO2,gas 0.83 -19.95 -20.79 -5.543 0.35493E+05 -19.088 10 HF,gas 0.47 -13.89 -14.37 -7.183 0.24531E+05 -12.668 11 HCl,gas 5.19 -12.64 -17.83 -8.915 0.30443E+05 -16.130 12 acmite 7.71 6.19 -1.52 -0.158 0.25917E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.74 -4.71 -0.236 0.80487E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.81 -4.67 -0.778 0.79743E+04 34 apatite-F -34.30 -38.49 -4.19 -0.349 0.71464E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29132E+04 39 brucite 12.57 8.04 -4.52 -0.905 0.77257E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26490E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.77 -4.82 -0.321 0.82232E+04 45 celadonite 5.34 2.53 -2.81 -0.165 0.47926E+04 46 celadonite-Fe 3.88 0.22 -3.66 -0.215 0.62418E+04 54 chloritoid-Fe 9.17 4.44 -4.73 -0.315 0.80796E+04 55 chloritoid-Mn 11.40 7.72 -3.69 -0.246 0.62935E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.21 -0.350 0.71801E+04 68 diaspore 2.87 0.85 -2.02 -0.337 0.34545E+04 69 diamond -3.10 -6.62 -3.52 -1.006 0.60107E+04 70 diopside 16.18 13.12 -3.06 -0.306 0.52253E+04 71 hedenbergite 14.21 10.81 -3.40 -0.340 0.58071E+04 86 gibbsite 4.08 0.85 -3.23 -0.461 0.55130E+04 89 graphite -3.55 -6.62 -3.08 -0.879 0.52529E+04 90 greenalite 16.14 11.21 -4.93 -0.411 0.84146E+04 93 hematite 12.57 8.87 -3.69 -0.448 0.63050E+04 94 heulandite -5.83 -8.17 -2.34 -0.106 0.39983E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.12 -0.589 0.70429E+04 101 kaolinite -1.33 -4.28 -2.95 -0.268 0.50286E+04 104 laumontite 2.88 0.80 -2.08 -0.139 0.35584E+04 105 lawsonite 9.62 6.78 -2.84 -0.189 0.48454E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62308E+04 109 magnesite 0.69 -3.75 -4.44 -1.481 0.75853E+04 119 microcline -2.49 -2.52 -0.03 -0.003 0.56701E+02 123 muscovite 2.58 -0.82 -3.40 -0.200 0.58072E+04 124 paragonite 4.24 1.32 -2.92 -0.172 0.49896E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.84 -4.53 -0.266 0.77296E+04 140 prehnite-Fe 22.50 18.43 -4.07 -0.245 0.69437E+04 146 pyrrhotite -4.26 -6.47 -2.20 -0.735 0.37647E+04 147 pyrrhotiteFe0.875 -6.02 -7.50 -1.49 -0.546 0.25359E+04 148 pyroxmangite 7.40 6.01 -1.38 -0.277 0.23641E+04 149 pyrophyllite -6.18 -10.26 -4.08 -0.255 0.69680E+04 154 rhodochrosite -0.98 -2.79 -1.82 -0.605 0.31005E+04 155 rhodonite 7.45 6.01 -1.43 -0.286 0.24443E+04 156 sanidine -1.28 -2.52 -1.24 -0.096 0.21245E+04 158 siderite -2.61 -6.07 -3.46 -1.152 0.59036E+04 166 stilbite -7.52 -8.17 -0.65 -0.031 0.11044E+04 167 stilpnomelane-Fe 13.02 9.24 -3.78 -0.113 0.64575E+04 174 talc 16.49 12.17 -4.32 -0.254 0.73713E+04 177 tephroite 18.09 15.02 -3.07 -0.438 0.52386E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.47 -2.05 -0.685 0.35075E+04 190 wairakite 3.95 0.80 -3.15 -0.185 0.53803E+04 191 walstromite 11.51 8.07 -3.44 -0.689 0.58781E+04 192 wollastonite 10.46 8.07 -2.39 -0.479 0.40885E+04 193 pseudo-wollastonite 11.00 8.07 -2.93 -0.587 0.50084E+04 195 akaganeite 7.75 4.44 -3.32 -0.717 0.56650E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.21 -4.89 -0.612 0.83548E+04 204 montmorillonite-Ca -2.29 -6.06 -3.77 -0.233 0.64336E+04 205 montmorillonite-K -2.24 -6.04 -3.80 -0.233 0.64863E+04 206 montmorillonite-Mg -2.48 -6.56 -4.08 -0.252 0.69592E+04 207 montmorillonite-Na -2.04 -5.33 -3.29 -0.202 0.56225E+04 208 nontronite-Ca 3.21 0.01 -3.21 -0.208 0.54762E+04 209 nontronite-H 2.53 -1.82 -4.35 -0.292 0.74269E+04 210 nontronite-K 3.34 0.03 -3.31 -0.212 0.56522E+04 211 nontronite-Mg 3.07 -0.49 -3.56 -0.231 0.60860E+04 212 nontronite-Na 3.52 0.74 -2.78 -0.179 0.47544E+04 228 tobermorite 9.82 6.22 -3.60 -0.983 0.61516E+04 234 alabandite -0.98 -3.19 -2.21 -0.738 0.37800E+04 237 boehmite 4.41 0.85 -3.56 -0.593 0.60714E+04 239 ferrous-oxide 9.81 5.73 -4.08 -1.020 0.69690E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.075 0.16549E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21156E+04 249 an30ab70 3.28 1.76 -1.51 -0.116 0.25859E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1079900 MOLES New total amount of reactant added: 0.1119900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1119900 Water: Moles liquid = 0.4996E+02 kg liquid = 0.9000E+00 Moles total = 0.4994E+02 kg total = 0.8997E+00 Activity = 1.0000 Stoichiometric ionic strength = .1858130E-01 Osmotic coef. = 0.9218 True ionic strength = .2485560E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7986E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.42041E-09 -9.3763 0.34843E-09 -9.4579 0.82880E+00 -0.0816 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.88315E-03 -3.0540 0.72676E-03 -3.1386 0.82291E+00 -0.0846 4 SO4-- 0.57692E-03 -3.2389 0.28264E-03 -3.5488 0.48992E+00 -0.3099 5 HCO3- 0.63305E-02 -2.1986 0.52184E-02 -2.2825 0.82433E+00 -0.0839 6 HS- 0.24723E-02 -2.6069 0.20349E-02 -2.6915 0.82305E+00 -0.0846 7 Al+++ 0.15876E-26 -26.7993 0.32086E-27 -27.4937 0.20210E+00 -0.6944 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.25006E-07 -7.6020 0.12144E-07 -7.9156 0.48565E+00 -0.3137 10 Mg++ 0.24625E-10 -10.6086 0.11895E-10 -10.9246 0.48302E+00 -0.3160 11 Fe++ 0.10722E-12 -12.9697 0.51855E-13 -13.2852 0.48365E+00 -0.3155 12 K+ 0.15608E-03 -3.8066 0.12870E-03 -3.8904 0.82456E+00 -0.0838 13 Na+ 0.21446E-01 -1.6687 0.17644E-01 -1.7534 0.82272E+00 -0.0847 14 Mn++ 0.24122E-09 -9.6176 0.11678E-09 -9.9326 0.48412E+00 -0.3150 15 F- 0.49718E-04 -4.3035 0.40814E-04 -4.3892 0.82091E+00 -0.0857 16 HPO4-- 0.45901E-07 -7.3382 0.22492E-07 -7.6480 0.49000E+00 -0.3098 18 HSiO3- 0.33367E-02 -2.4767 0.27458E-02 -2.5613 0.82291E+00 -0.0846 19 Ca(HSiO3)+ 0.92075E-09 -9.0359 0.75941E-09 -9.1195 0.82477E+00 -0.0837 20 Mg(HSiO3)+ 0.11223E-11 -11.9499 0.92567E-12 -12.0335 0.82477E+00 -0.0837 21 NaHSiO3,aq 0.78356E-03 -3.1059 0.78356E-03 -3.1059 0.10000E+01 0.0000 22 AlO+ 0.43594E-15 -15.3606 0.35955E-15 -15.4442 0.82477E+00 -0.0837 24 HAlO2,aq 0.20550E-09 -9.6872 0.20550E-09 -9.6872 0.10000E+01 0.0000 25 AlO2- 0.15899E-05 -5.7986 0.13056E-05 -5.8842 0.82116E+00 -0.0856 26 CH4,aq 0.36699E-07 -7.4353 0.36494E-07 -7.4378 0.99440E+00 -0.0024 27 C2H6,aq 0.15848E-17 -17.8000 0.15760E-17 -17.8025 0.99440E+00 -0.0024 31 CO,aq 0.14100E-13 -13.8508 0.14100E-13 -13.8508 0.10000E+01 0.0000 32 CO2,aq 0.39071E-05 -5.4081 0.38852E-05 -5.4106 0.99440E+00 -0.0024 33 CO3-2 0.26769E-02 -2.5724 0.13082E-02 -2.8833 0.48869E+00 -0.3110 34 CaCO3,aq 0.19920E-06 -6.7007 0.19920E-06 -6.7007 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.19613E-08 -8.7074 0.16177E-08 -8.7911 0.82477E+00 -0.0837 36 CaCl+ 0.17317E-10 -10.7615 0.14283E-10 -10.8452 0.82477E+00 -0.0837 37 CaCl2,aq 0.24661E-14 -14.6080 0.24661E-14 -14.6080 0.10000E+01 0.0000 38 CaF+ 0.87741E-11 -11.0568 0.72366E-11 -11.1405 0.82477E+00 -0.0837 39 CaOH+ 0.30117E-08 -8.5212 0.24840E-08 -8.6048 0.82477E+00 -0.0837 40 CaSO4,aq 0.10900E-08 -8.9626 0.10900E-08 -8.9626 0.10000E+01 0.0000 41 HCl,aq 0.46403E-13 -13.3335 0.46403E-13 -13.3335 0.10000E+01 0.0000 45 HF,aq 0.97353E-10 -10.0117 0.97353E-10 -10.0117 0.10000E+01 0.0000 46 HF2- 0.16302E-14 -14.7878 0.13415E-14 -14.8724 0.82291E+00 -0.0846 48 FeCl+ 0.72324E-16 -16.1407 0.59651E-16 -16.2244 0.82477E+00 -0.0837 51 FeF+ 0.13113E-15 -15.8823 0.10815E-15 -15.9660 0.82477E+00 -0.0837 53 FeO,aq 0.16600E-10 -10.7799 0.16600E-10 -10.7799 0.10000E+01 0.0000 54 FeOH+ 0.58736E-11 -11.2311 0.48444E-11 -11.3148 0.82477E+00 -0.0837 55 HFeO2- 0.60577E-09 -9.2177 0.49850E-09 -9.3023 0.82291E+00 -0.0846 56 FeO+ 0.36859E-16 -16.4335 0.30400E-16 -16.5171 0.82477E+00 -0.0837 58 FeO2- 0.62264E-10 -10.2058 0.51237E-10 -10.2904 0.82291E+00 -0.0846 59 HFeO2,aq 0.22706E-11 -11.6439 0.22706E-11 -11.6439 0.10000E+01 0.0000 60 H2,aq 0.14528E-06 -6.8378 0.14447E-06 -6.8402 0.99440E+00 -0.0024 61 KCl,aq 0.16952E-08 -8.7708 0.16952E-08 -8.7708 0.10000E+01 0.0000 62 KHSO4,aq 0.35836E-16 -16.4457 0.35836E-16 -16.4457 0.10000E+01 0.0000 63 KOH,aq 0.15774E-06 -6.8021 0.15774E-06 -6.8021 0.10000E+01 0.0000 64 KSO4- 0.68595E-06 -6.1637 0.56448E-06 -6.2484 0.82291E+00 -0.0846 65 MgCO3,aq 0.48905E-10 -10.3106 0.48905E-10 -10.3106 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.19630E-11 -11.7071 0.16190E-11 -11.7908 0.82477E+00 -0.0837 67 MgCl+ 0.15373E-13 -13.8132 0.12679E-13 -13.8969 0.82477E+00 -0.0837 68 MgF+ 0.31834E-13 -13.4971 0.26256E-13 -13.5808 0.82477E+00 -0.0837 69 MgOH+ 0.16323E-10 -10.7872 0.13463E-10 -10.8709 0.82477E+00 -0.0837 71 MnF+ 0.97339E-13 -13.0117 0.80283E-13 -13.0954 0.82477E+00 -0.0837 72 MnO,aq 0.99616E-09 -9.0017 0.99616E-09 -9.0017 0.10000E+01 0.0000 73 MnOH+ 0.12288E-08 -8.9105 0.10135E-08 -8.9942 0.82477E+00 -0.0837 74 MnO2-2 0.55722E-12 -12.2540 0.27231E-12 -12.5649 0.48869E+00 -0.3110 75 HMnO2- 0.25260E-10 -10.5976 0.20787E-10 -10.6822 0.82291E+00 -0.0846 78 MnCl+ 0.63367E-12 -12.1981 0.52263E-12 -12.2818 0.82477E+00 -0.0837 79 MnSO4,aq 0.95291E-11 -11.0209 0.95291E-11 -11.0209 0.10000E+01 0.0000 80 NaCl,aq 0.42495E-05 -5.3717 0.42495E-05 -5.3717 0.10000E+01 0.0000 81 NaF,aq 0.16859E-06 -6.7732 0.16859E-06 -6.7732 0.10000E+01 0.0000 82 NaOH,aq 0.21756E-04 -4.6624 0.21756E-04 -4.6624 0.10000E+01 0.0000 84 OH- 0.20193E-02 -2.6948 0.16582E-02 -2.7804 0.82116E+00 -0.0856 89 HPO3-2 0.20721E-16 -16.6836 0.10126E-16 -16.9946 0.48869E+00 -0.3110 92 H3PO4,aq 0.19098E-16 -16.7190 0.19098E-16 -16.7190 0.10000E+01 0.0000 93 H2PO4- 0.17548E-09 -9.7558 0.14457E-09 -9.8399 0.82383E+00 -0.0842 94 PO4-3 0.24589E-09 -9.6093 0.52666E-10 -10.2785 0.21418E+00 -0.6692 98 HP2O7-3 0.46408E-17 -17.3334 0.93912E-18 -18.0273 0.20236E+00 -0.6939 99 P2O7-4 0.10536E-16 -16.9773 0.64389E-18 -18.1912 0.61110E-01 -1.2139 100 H2S,aq 0.22036E-05 -5.6569 0.21913E-05 -5.6593 0.99440E+00 -0.0024 101 S2-2 0.12995E-08 -8.8862 0.63507E-09 -9.1972 0.48869E+00 -0.3110 102 S3-2 0.26556E-13 -13.5758 0.12978E-13 -13.8868 0.48869E+00 -0.3110 103 S3- 0.96907E-17 -17.0136 0.79746E-17 -17.0983 0.82291E+00 -0.0846 104 S4-2 0.35847E-18 -18.4455 0.17518E-18 -18.7565 0.48869E+00 -0.3110 106 SO2,aq 0.22140E-19 -19.6548 0.22140E-19 -19.6548 0.10000E+01 0.0000 107 SO3-2 0.10676E-10 -10.9716 0.53063E-11 -11.2752 0.49705E+00 -0.3036 108 HSO3- 0.14068E-12 -12.8518 0.11576E-12 -12.9364 0.82291E+00 -0.0846 109 HSO4- 0.11494E-09 -9.9395 0.94910E-10 -10.0227 0.82573E+00 -0.0832 111 S2O3-2 0.14888E-10 -10.8272 0.72755E-11 -11.1381 0.48869E+00 -0.3110 112 HS2O3- 0.55081E-18 -18.2590 0.45326E-18 -18.3436 0.82291E+00 -0.0846 Charge balance for all species = -.6120E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4204076E-09 -.8838925E-02 -.8894135E+01 0.0000 2 H2O 0.1000000E+01 0.5550617E+02 0.9982799E+06 0.0000 3 Cl- 0.8831531E-03 0.8874043E-03 0.3140827E+02 6.3193 4 SO4-- 0.5769237E-03 0.5775382E-03 0.5538601E+02 15.3670 5 HCO3- 0.6330454E-02 0.9011489E-02 0.5489318E+03 7.1754 6 HS- 0.2472328E-02 0.2474607E-02 0.8170267E+02 6.7664 7 Al+++ 0.1587630E-26 0.1590093E-05 0.4283100E-01 0.8800 8 H4SiO4 0.1024625E-02 0.5144905E-02 0.4936736E+03 -2.9894 9 Ca++ 0.2500590E-07 0.2312151E-06 0.9251066E-02 11.0001 10 Mg++ 0.2462543E-10 0.9298593E-10 0.2256875E-05 7.9911 11 Fe++ 0.1072170E-12 0.6928886E-09 0.3863072E-04 5.6306 12 K+ 0.1560838E-03 0.1569292E-03 0.6125932E+01 5.5675 13 Na+ 0.2144557E-01 0.2225531E-01 0.5107852E+03 7.7045 14 Mn++ 0.2412230E-09 0.2502276E-08 0.1372390E-03 8.9831 15 F- 0.4971816E-04 0.4988686E-04 0.9461579E+00 5.0687 16 HPO4-- 0.4590108E-07 0.4632245E-07 0.4438511E-02 11.2678 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7968017E-02 -.7954647E-02 -.1336936E-04 0.0000000E+00 2 H2O 0.4993809E+02 0.4995313E+02 -.1503900E-01 0.0000000E+00 3 Cl- 0.7986252E-03 0.7986252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5197672E-03 0.5197592E-03 0.7992175E-08 0.0000000E+00 5 HCO3- 0.8109947E-02 0.8109947E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2227094E-02 0.2227038E-02 0.5594523E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1431014E-05 0.3344338E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.4630191E-02 0.7522829E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.6235695E-09 0.3196870E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002881E-01 0.3344338E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4489600E-04 0.4489600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.901471E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1119900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3344E-05 -5.476 0.8770E-03 -3.057 0.1939 0.3366E-03 pyrite 0.3197E-07 -7.495 0.3836E-05 -5.416 0.8481E-03 0.7653E-06 quartz 0.7513E-02 -2.124 0.4514 -0.345 99.81 0.1705 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.452250 g Volume = 0.170794 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1119900 moles log = -0.9508 Original solution: 1000.0103000 g Original solution / Rock added: 8929.46 (Water/Rock Ratio), log = 3.9508 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0210 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9993E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.4043E-03 1.0071 0.4157E-03 0.4127E-03 CH4,gas 0.5196E-04 1.0125 0.5372E-04 0.5305E-04 H2,gas 0.1857E-03 1.0005 0.1897E-03 0.1896E-03 H2S,gas 0.5923E-04 0.9960 0.6024E-04 0.6048E-04 S2,gas 0.3708E-20 1.0000 0.3786E-20 0.3786E-20 CO,gas 0.2058E-10 1.0000 0.2101E-10 0.2101E-10 SO3,gas 0.1271E-37 1.0000 0.1297E-37 0.1297E-37 SO2,gas 0.9377E-19 1.0000 0.9574E-19 0.9574E-19 HF,gas 0.2341E-12 1.0000 0.2390E-12 0.2390E-12 HCl,gas 0.8019E-16 1.0000 0.8188E-16 0.8188E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.74 -5.08 -1.693 0.86743E+04 -3.381 3 CH4,gas 4.54 -1.43 -5.97 -1.492 0.10192E+05 -4.270 4 H2,gas 8.00 2.58 -5.42 -3.098 0.92562E+04 -3.722 5 H2S,gas -6.23 -12.15 -5.92 -2.960 0.10107E+05 -4.220 6 S2,gas -7.34 -29.46 -22.12 -3.403 0.37771E+05 -20.422 7 CO,gas 3.21 -9.16 -12.38 -3.808 0.21133E+05 -10.678 8 SO3,gas 17.12 -22.46 -39.59 -9.896 0.67592E+05 -37.887 9 SO2,gas 0.83 -19.89 -20.72 -5.525 0.35375E+05 -19.019 10 HF,gas 0.47 -13.85 -14.32 -7.160 0.24452E+05 -12.622 11 HCl,gas 5.19 -12.60 -17.79 -8.893 0.30369E+05 -16.087 12 acmite 7.71 6.07 -1.64 -0.171 0.28053E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.74 -4.72 -0.236 0.80530E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.85 -4.71 -0.786 0.80506E+04 34 apatite-F -34.30 -38.54 -4.24 -0.353 0.72340E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29142E+04 39 brucite 12.57 7.99 -4.58 -0.915 0.78159E+04 40 calcite 0.81 -0.74 -1.55 -0.517 0.26500E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.77 -4.81 -0.321 0.82128E+04 45 celadonite 5.34 2.48 -2.86 -0.168 0.48847E+04 46 celadonite-Fe 3.88 0.12 -3.76 -0.221 0.64137E+04 54 chloritoid-Fe 9.17 4.40 -4.77 -0.318 0.81490E+04 55 chloritoid-Mn 11.40 7.75 -3.65 -0.243 0.62279E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.21 -0.351 0.71821E+04 68 diaspore 2.87 0.88 -1.99 -0.332 0.34042E+04 69 diamond -3.10 -6.58 -3.48 -0.994 0.59426E+04 70 diopside 16.18 13.01 -3.17 -0.317 0.54110E+04 71 hedenbergite 14.21 10.65 -3.56 -0.356 0.60726E+04 86 gibbsite 4.08 0.88 -3.20 -0.457 0.54628E+04 89 graphite -3.55 -6.58 -3.04 -0.868 0.51849E+04 93 hematite 12.57 8.68 -3.88 -0.471 0.66316E+04 94 heulandite -5.83 -8.17 -2.34 -0.106 0.39933E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.13 -0.589 0.70449E+04 101 kaolinite -1.33 -4.22 -2.89 -0.262 0.49281E+04 104 laumontite 2.88 0.80 -2.08 -0.139 0.35534E+04 105 lawsonite 9.62 6.78 -2.83 -0.189 0.48405E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62328E+04 109 magnesite 0.69 -3.75 -4.44 -1.480 0.75809E+04 119 microcline -2.49 -2.52 -0.03 -0.003 0.58710E+02 123 muscovite 2.58 -0.76 -3.34 -0.197 0.57087E+04 124 paragonite 4.24 1.38 -2.86 -0.168 0.48891E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.79 -4.58 -0.269 0.78202E+04 140 prehnite-Fe 22.50 18.25 -4.24 -0.255 0.72479E+04 146 pyrrhotite -4.26 -6.52 -2.26 -0.753 0.38563E+04 147 pyrrhotiteFe0.875 -6.02 -7.54 -1.53 -0.561 0.26046E+04 148 pyroxmangite 7.40 5.99 -1.40 -0.281 0.23990E+04 149 pyrophyllite -6.18 -10.20 -4.02 -0.251 0.68675E+04 154 rhodochrosite -0.98 -2.76 -1.78 -0.594 0.30408E+04 155 rhodonite 7.45 5.99 -1.45 -0.290 0.24792E+04 156 sanidine -1.28 -2.52 -1.25 -0.096 0.21265E+04 158 siderite -2.61 -6.11 -3.50 -1.167 0.59790E+04 166 stilbite -7.52 -8.17 -0.64 -0.031 0.10995E+04 167 stilpnomelane-Fe 13.02 8.78 -4.24 -0.126 0.72329E+04 174 talc 16.49 12.02 -4.48 -0.263 0.76417E+04 177 tephroite 18.09 14.98 -3.11 -0.444 0.53085E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.52 -2.11 -0.703 0.35991E+04 190 wairakite 3.95 0.80 -3.15 -0.185 0.53754E+04 191 walstromite 11.51 8.01 -3.50 -0.700 0.59737E+04 192 wollastonite 10.46 8.01 -2.45 -0.490 0.41841E+04 193 pseudo-wollastonite 11.00 8.01 -2.99 -0.598 0.51039E+04 195 akaganeite 7.75 4.34 -3.41 -0.738 0.58283E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.16 -4.84 -0.605 0.82603E+04 204 montmorillonite-Ca -2.29 -6.04 -3.75 -0.232 0.63952E+04 205 montmorillonite-K -2.24 -6.01 -3.78 -0.231 0.64494E+04 206 montmorillonite-Mg -2.48 -6.53 -4.05 -0.251 0.69199E+04 207 montmorillonite-Na -2.04 -5.31 -3.27 -0.200 0.55849E+04 208 nontronite-Ca 3.21 -0.18 -3.40 -0.220 0.58021E+04 209 nontronite-H 2.53 -2.00 -4.53 -0.304 0.77369E+04 210 nontronite-K 3.34 -0.16 -3.50 -0.225 0.59795E+04 211 nontronite-Mg 3.07 -0.68 -3.75 -0.244 0.64109E+04 212 nontronite-Na 3.52 0.54 -2.98 -0.191 0.50810E+04 228 tobermorite 9.82 6.17 -3.65 -0.996 0.62312E+04 234 alabandite -0.98 -3.17 -2.19 -0.729 0.37365E+04 237 boehmite 4.41 0.88 -3.53 -0.588 0.60212E+04 239 ferrous-oxide 9.81 5.63 -4.18 -1.045 0.71390E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.075 0.16539E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21144E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25844E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1119900 MOLES New total amount of reactant added: 0.1159900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1159900 Water: Moles liquid = 0.4996E+02 kg liquid = 0.9000E+00 Moles total = 0.4994E+02 kg total = 0.8997E+00 Activity = 1.0000 Stoichiometric ionic strength = .1884037E-01 Osmotic coef. = 0.9213 True ionic strength = .2488502E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8222E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.45242E-09 -9.3445 0.37494E-09 -9.4260 0.82873E+00 -0.0816 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.90917E-03 -3.0414 0.74810E-03 -3.1260 0.82284E+00 -0.0847 4 SO4-- 0.59808E-03 -3.2232 0.29291E-03 -3.5333 0.48976E+00 -0.3100 5 HCO3- 0.66956E-02 -2.1742 0.55190E-02 -2.2581 0.82427E+00 -0.0839 6 HS- 0.25587E-02 -2.5920 0.21057E-02 -2.6766 0.82298E+00 -0.0846 7 Al+++ 0.21252E-26 -26.6726 0.42918E-27 -27.3674 0.20195E+00 -0.6948 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.25401E-07 -7.5952 0.12332E-07 -7.9090 0.48549E+00 -0.3138 10 Mg++ 0.25159E-10 -10.5993 0.12148E-10 -10.9155 0.48286E+00 -0.3162 11 Fe++ 0.98300E-13 -13.0074 0.47526E-13 -13.3231 0.48348E+00 -0.3156 12 K+ 0.15606E-03 -3.8067 0.12867E-03 -3.8905 0.82449E+00 -0.0838 13 Na+ 0.21499E-01 -1.6676 0.17686E-01 -1.7524 0.82265E+00 -0.0848 14 Mn++ 0.26540E-09 -9.5761 0.12844E-09 -9.8913 0.48396E+00 -0.3152 15 F- 0.51486E-04 -4.2883 0.42262E-04 -4.3741 0.82084E+00 -0.0857 16 HPO4-- 0.45902E-07 -7.3382 0.22484E-07 -7.6481 0.48984E+00 -0.3099 18 HSiO3- 0.31011E-02 -2.5085 0.25517E-02 -2.5932 0.82284E+00 -0.0847 19 Ca(HSiO3)+ 0.86895E-09 -9.0610 0.71663E-09 -9.1447 0.82470E+00 -0.0837 20 Mg(HSiO3)+ 0.10653E-11 -11.9725 0.87858E-12 -12.0562 0.82470E+00 -0.0837 21 NaHSiO3,aq 0.72992E-03 -3.1367 0.72992E-03 -3.1367 0.10000E+01 0.0000 22 AlO+ 0.50362E-15 -15.2979 0.41533E-15 -15.3816 0.82470E+00 -0.0837 24 HAlO2,aq 0.22060E-09 -9.6564 0.22060E-09 -9.6564 0.10000E+01 0.0000 25 AlO2- 0.15862E-05 -5.7996 0.13024E-05 -5.8852 0.82109E+00 -0.0856 26 CH4,aq 0.38760E-07 -7.4116 0.38540E-07 -7.4141 0.99432E+00 -0.0025 27 C2H6,aq 0.18011E-17 -17.7445 0.17908E-17 -17.7469 0.99432E+00 -0.0025 31 CO,aq 0.15750E-13 -13.8027 0.15750E-13 -13.8027 0.10000E+01 0.0000 32 CO2,aq 0.44468E-05 -5.3520 0.44216E-05 -5.3544 0.99432E+00 -0.0025 33 CO3-2 0.26318E-02 -2.5797 0.12857E-02 -2.8909 0.48853E+00 -0.3111 34 CaCO3,aq 0.19881E-06 -6.7016 0.19881E-06 -6.7016 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.21065E-08 -8.6764 0.17373E-08 -8.7601 0.82470E+00 -0.0837 36 CaCl+ 0.18103E-10 -10.7422 0.14930E-10 -10.8260 0.82470E+00 -0.0837 37 CaCl2,aq 0.26535E-14 -14.5762 0.26535E-14 -14.5762 0.10000E+01 0.0000 38 CaF+ 0.92264E-11 -11.0350 0.76090E-11 -11.1187 0.82470E+00 -0.0837 39 CaOH+ 0.28423E-08 -8.5463 0.23441E-08 -8.6300 0.82470E+00 -0.0837 40 CaSO4,aq 0.11470E-08 -8.9404 0.11470E-08 -8.9404 0.10000E+01 0.0000 41 HCl,aq 0.51399E-13 -13.2890 0.51399E-13 -13.2890 0.10000E+01 0.0000 45 HF,aq 0.10847E-09 -9.9647 0.10847E-09 -9.9647 0.10000E+01 0.0000 46 HF2- 0.18810E-14 -14.7256 0.15478E-14 -14.8103 0.82284E+00 -0.0847 48 FeCl+ 0.68239E-16 -16.1660 0.56277E-16 -16.2497 0.82470E+00 -0.0837 51 FeF+ 0.12446E-15 -15.9050 0.10264E-15 -15.9887 0.82470E+00 -0.0837 53 FeO,aq 0.13140E-10 -10.8814 0.13140E-10 -10.8814 0.10000E+01 0.0000 54 FeOH+ 0.50032E-11 -11.3008 0.41261E-11 -11.3845 0.82470E+00 -0.0837 55 HFeO2- 0.44563E-09 -9.3510 0.36668E-09 -9.4357 0.82284E+00 -0.0847 56 FeO+ 0.31691E-16 -16.4991 0.26136E-16 -16.5828 0.82470E+00 -0.0837 58 FeO2- 0.46233E-10 -10.3350 0.38042E-10 -10.4197 0.82284E+00 -0.0847 59 HFeO2,aq 0.18141E-11 -11.7413 0.18141E-11 -11.7413 0.10000E+01 0.0000 60 H2,aq 0.14260E-06 -6.8459 0.14179E-06 -6.8483 0.99432E+00 -0.0025 61 KCl,aq 0.17446E-08 -8.7583 0.17446E-08 -8.7583 0.10000E+01 0.0000 62 KHSO4,aq 0.39954E-16 -16.3984 0.39954E-16 -16.3984 0.10000E+01 0.0000 63 KOH,aq 0.14656E-06 -6.8340 0.14656E-06 -6.8340 0.10000E+01 0.0000 64 KSO4- 0.71076E-06 -6.1483 0.58484E-06 -6.2330 0.82284E+00 -0.0847 65 MgCO3,aq 0.49090E-10 -10.3090 0.49090E-10 -10.3090 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.21205E-11 -11.6736 0.17488E-11 -11.7573 0.82470E+00 -0.0837 67 MgCl+ 0.16163E-13 -13.7915 0.13330E-13 -13.8752 0.82470E+00 -0.0837 68 MgF+ 0.33669E-13 -13.4728 0.27767E-13 -13.5565 0.82470E+00 -0.0837 69 MgOH+ 0.15494E-10 -10.8098 0.12778E-10 -10.8935 0.82470E+00 -0.0837 71 MnF+ 0.11086E-12 -12.9552 0.91429E-13 -13.0389 0.82470E+00 -0.0837 72 MnO,aq 0.94619E-09 -9.0240 0.94619E-09 -9.0240 0.10000E+01 0.0000 73 MnOH+ 0.12561E-08 -8.9010 0.10359E-08 -8.9847 0.82470E+00 -0.0837 74 MnO2-2 0.45724E-12 -12.3399 0.22337E-12 -12.6510 0.48853E+00 -0.3111 75 HMnO2- 0.22299E-10 -10.6517 0.18348E-10 -10.7364 0.82284E+00 -0.0847 78 MnCl+ 0.71747E-12 -12.1442 0.59170E-12 -12.2279 0.82470E+00 -0.0837 79 MnSO4,aq 0.10861E-10 -10.9641 0.10861E-10 -10.9641 0.10000E+01 0.0000 80 NaCl,aq 0.43848E-05 -5.3580 0.43848E-05 -5.3580 0.10000E+01 0.0000 81 NaF,aq 0.17499E-06 -6.7570 0.17499E-06 -6.7570 0.10000E+01 0.0000 82 NaOH,aq 0.20267E-04 -4.6932 0.20267E-04 -4.6932 0.10000E+01 0.0000 84 OH- 0.18768E-02 -2.7266 0.15410E-02 -2.8122 0.82109E+00 -0.0856 89 HPO3-2 0.20338E-16 -16.6917 0.99354E-17 -17.0028 0.48853E+00 -0.3111 92 H3PO4,aq 0.22107E-16 -16.6555 0.22107E-16 -16.6555 0.10000E+01 0.0000 93 H2PO4- 0.18879E-09 -9.7240 0.15551E-09 -9.8082 0.82376E+00 -0.0842 94 PO4-3 0.22860E-09 -9.6409 0.48928E-10 -10.3104 0.21403E+00 -0.6695 98 HP2O7-3 0.49944E-17 -17.3015 0.10099E-17 -17.9957 0.20221E+00 -0.6942 99 P2O7-4 0.10544E-16 -16.9770 0.64348E-18 -18.1915 0.61030E-01 -1.2145 100 H2S,aq 0.24540E-05 -5.6101 0.24401E-05 -5.6126 0.99432E+00 -0.0025 101 S2-2 0.14184E-08 -8.8482 0.69292E-09 -9.1593 0.48853E+00 -0.3111 102 S3-2 0.32885E-13 -13.4830 0.16065E-13 -13.7941 0.48853E+00 -0.3111 103 S3- 0.13031E-16 -16.8850 0.10722E-16 -16.9697 0.82284E+00 -0.0847 104 S4-2 0.50363E-18 -18.2979 0.24604E-18 -18.6090 0.48853E+00 -0.3111 106 SO2,aq 0.26075E-19 -19.5838 0.26075E-19 -19.5838 0.10000E+01 0.0000 107 SO3-2 0.10862E-10 -10.9641 0.53973E-11 -11.2678 0.49689E+00 -0.3037 108 HSO3- 0.15398E-12 -12.8125 0.12670E-12 -12.8972 0.82284E+00 -0.0847 109 HSO4- 0.12819E-09 -9.8922 0.10584E-09 -9.9754 0.82566E+00 -0.0832 111 S2O3-2 0.17186E-10 -10.7648 0.83959E-11 -11.0759 0.48853E+00 -0.3111 112 HS2O3- 0.68404E-18 -18.1649 0.56286E-18 -18.2496 0.82284E+00 -0.0847 Charge balance for all species = -.6119E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4524224E-09 -.8359719E-02 -.8411930E+01 0.0000 2 H2O 0.1000000E+01 0.5550632E+02 0.9982818E+06 0.0000 3 Cl- 0.9091742E-03 0.9135608E-03 0.3233402E+02 6.3000 4 SO4-- 0.5980795E-03 0.5987175E-03 0.5741707E+02 15.3188 5 HCO3- 0.6695643E-02 0.9332153E-02 0.5684645E+03 7.1679 6 HS- 0.2558670E-02 0.2561201E-02 0.8456163E+02 6.7494 7 Al+++ 0.2125171E-26 0.1586436E-05 0.4273247E-01 0.9108 8 H4SiO4 0.1024625E-02 0.4855657E-02 0.4659188E+03 -2.9894 9 Ca++ 0.2540082E-07 0.2311981E-06 0.9250381E-02 10.9431 10 Mg++ 0.2515913E-10 0.9297911E-10 0.2256708E-05 7.9366 11 Fe++ 0.9830007E-13 0.5119140E-09 0.2854080E-04 5.5290 12 K+ 0.1560586E-03 0.1569176E-03 0.6125478E+01 5.5355 13 Na+ 0.2149893E-01 0.2225367E-01 0.5107473E+03 7.6737 14 Mn++ 0.2653961E-09 0.2502092E-08 0.1372288E-03 8.9608 15 F- 0.5148583E-04 0.5166093E-04 0.9798044E+00 5.0520 16 HPO4-- 0.4590167E-07 0.4631906E-07 0.4438183E-02 11.2040 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7537317E-02 -.7523935E-02 -.1338206E-04 0.0000000E+00 2 H2O 0.4994137E+02 0.4995693E+02 -.1555898E-01 0.0000000E+00 3 Cl- 0.8222252E-03 0.8222252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5388672E-03 0.5388592E-03 0.8032884E-08 0.0000000E+00 5 HCO3- 0.8399147E-02 0.8399147E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2305194E-02 0.2305138E-02 0.5623019E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1427828E-05 0.3347524E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.4370200E-02 0.7782820E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.4607341E-09 0.3213154E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002880E-01 0.3347524E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4649600E-04 0.4649600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2541E-20 Mass of aqueous solution: 0.901538E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1159900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3348E-05 -5.475 0.8778E-03 -3.057 0.1876 0.3370E-03 pyrite 0.3213E-07 -7.493 0.3855E-05 -5.414 0.8240E-03 0.7692E-06 quartz 0.7773E-02 -2.109 0.4670 -0.331 99.81 0.1764 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.467870 g Volume = 0.176693 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1159900 moles log = -0.9356 Original solution: 1000.0103000 g Original solution / Rock added: 8621.52 (Water/Rock Ratio), log = 3.9356 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0211 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9992E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.4600E-03 1.0071 0.4731E-03 0.4697E-03 CH4,gas 0.5487E-04 1.0125 0.5673E-04 0.5603E-04 H2,gas 0.1822E-03 1.0005 0.1862E-03 0.1861E-03 H2S,gas 0.6595E-04 0.9960 0.6708E-04 0.6734E-04 S2,gas 0.4773E-20 1.0000 0.4873E-20 0.4873E-20 CO,gas 0.2299E-10 1.0000 0.2347E-10 0.2347E-10 SO3,gas 0.1525E-37 1.0000 0.1557E-37 0.1557E-37 SO2,gas 0.1104E-18 1.0000 0.1128E-18 0.1128E-18 HF,gas 0.2608E-12 1.0000 0.2663E-12 0.2663E-12 HCl,gas 0.8882E-16 1.0000 0.9069E-16 0.9069E-16 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.68 -5.02 -1.675 0.85784E+04 -3.325 3 CH4,gas 4.54 -1.40 -5.95 -1.486 0.10151E+05 -4.246 4 H2,gas 8.00 2.57 -5.43 -3.102 0.92700E+04 -3.730 5 H2S,gas -6.23 -12.10 -5.87 -2.936 0.10027E+05 -4.173 6 S2,gas -7.34 -29.35 -22.01 -3.386 0.37583E+05 -20.312 7 CO,gas 3.21 -9.11 -12.33 -3.793 0.21051E+05 -10.629 8 SO3,gas 17.12 -22.39 -39.51 -9.877 0.67457E+05 -37.808 9 SO2,gas 0.83 -19.81 -20.65 -5.506 0.35254E+05 -18.948 10 HF,gas 0.47 -13.80 -14.27 -7.137 0.24372E+05 -12.575 11 HCl,gas 5.19 -12.55 -17.74 -8.871 0.30293E+05 -16.042 12 acmite 7.71 5.94 -1.77 -0.184 0.30243E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.74 -4.72 -0.236 0.80623E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.90 -4.76 -0.794 0.81296E+04 34 apatite-F -34.30 -38.59 -4.28 -0.357 0.73151E+04 38 aragonite 0.97 -0.74 -1.71 -0.569 0.29157E+04 39 brucite 12.57 7.94 -4.63 -0.926 0.79090E+04 40 calcite 0.81 -0.74 -1.55 -0.518 0.26514E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.78 -4.80 -0.320 0.82007E+04 45 celadonite 5.34 2.43 -2.92 -0.172 0.49798E+04 46 celadonite-Fe 3.88 0.02 -3.86 -0.227 0.65891E+04 54 chloritoid-Fe 9.17 4.36 -4.81 -0.321 0.82172E+04 55 chloritoid-Mn 11.40 7.79 -3.61 -0.241 0.61609E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.21 -0.351 0.71841E+04 68 diaspore 2.87 0.91 -1.96 -0.327 0.33517E+04 69 diamond -3.10 -6.54 -3.44 -0.983 0.58745E+04 70 diopside 16.18 12.90 -3.28 -0.328 0.56014E+04 71 hedenbergite 14.21 10.49 -3.72 -0.372 0.63433E+04 86 gibbsite 4.08 0.91 -3.17 -0.453 0.54102E+04 89 graphite -3.55 -6.54 -3.00 -0.856 0.51167E+04 93 hematite 12.57 8.49 -4.08 -0.494 0.69645E+04 94 heulandite -5.83 -8.16 -2.33 -0.106 0.39855E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.13 -0.590 0.70468E+04 101 kaolinite -1.33 -4.16 -2.82 -0.257 0.48229E+04 104 laumontite 2.88 0.81 -2.08 -0.138 0.35456E+04 105 lawsonite 9.62 6.79 -2.83 -0.189 0.48327E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62348E+04 109 magnesite 0.69 -3.75 -4.44 -1.479 0.75781E+04 119 microcline -2.49 -2.52 -0.04 -0.003 0.60670E+02 123 muscovite 2.58 -0.70 -3.28 -0.193 0.56055E+04 124 paragonite 4.24 1.44 -2.80 -0.165 0.47840E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.74 -4.63 -0.272 0.79098E+04 140 prehnite-Fe 22.50 18.07 -4.43 -0.266 0.75564E+04 146 pyrrhotite -4.26 -6.57 -2.31 -0.771 0.39499E+04 147 pyrrhotiteFe0.875 -6.02 -7.58 -1.57 -0.576 0.26749E+04 148 pyroxmangite 7.40 5.97 -1.43 -0.285 0.24371E+04 149 pyrophyllite -6.18 -10.14 -3.96 -0.248 0.67623E+04 154 rhodochrosite -0.98 -2.72 -1.75 -0.582 0.29831E+04 155 rhodonite 7.45 5.97 -1.47 -0.295 0.25174E+04 156 sanidine -1.28 -2.52 -1.25 -0.096 0.21284E+04 158 siderite -2.61 -6.16 -3.55 -1.182 0.60564E+04 166 stilbite -7.52 -8.16 -0.64 -0.030 0.10917E+04 167 stilpnomelane-Fe 13.02 8.32 -4.70 -0.140 0.80218E+04 174 talc 16.49 11.85 -4.64 -0.273 0.79210E+04 177 tephroite 18.09 14.93 -3.15 -0.451 0.53848E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.57 -2.16 -0.721 0.36927E+04 190 wairakite 3.95 0.81 -3.14 -0.185 0.53676E+04 191 walstromite 11.51 7.95 -3.56 -0.711 0.60710E+04 192 wollastonite 10.46 7.95 -2.51 -0.501 0.42814E+04 193 pseudo-wollastonite 11.00 7.95 -3.05 -0.609 0.52013E+04 195 akaganeite 7.75 4.24 -3.51 -0.759 0.59948E+04 200 beidellite-Na -1.34 -6.32 -4.97 -0.305 0.84940E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.10 -4.78 -0.598 0.81644E+04 204 montmorillonite-Ca -2.29 -6.01 -3.72 -0.230 0.63541E+04 205 montmorillonite-K -2.24 -5.99 -3.75 -0.230 0.64103E+04 206 montmorillonite-Mg -2.48 -6.51 -4.03 -0.249 0.68782E+04 207 montmorillonite-Na -2.04 -5.29 -3.25 -0.199 0.55452E+04 208 nontronite-Ca 3.21 -0.38 -3.59 -0.233 0.61337E+04 209 nontronite-H 2.53 -2.18 -4.72 -0.316 0.80525E+04 210 nontronite-K 3.34 -0.36 -3.70 -0.237 0.63130E+04 211 nontronite-Mg 3.07 -0.87 -3.95 -0.256 0.67418E+04 212 nontronite-Na 3.52 0.35 -3.17 -0.204 0.54139E+04 228 tobermorite 9.82 6.13 -3.70 -1.009 0.63123E+04 234 alabandite -0.98 -3.14 -2.16 -0.721 0.36949E+04 237 boehmite 4.41 0.91 -3.50 -0.583 0.59686E+04 239 ferrous-oxide 9.81 5.53 -4.28 -1.071 0.73124E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.074 0.16524E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21124E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25821E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1159900 MOLES New total amount of reactant added: 0.1199900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1199900 Water: Moles liquid = 0.4996E+02 kg liquid = 0.9001E+00 Moles total = 0.4994E+02 kg total = 0.8998E+00 Activity = 1.0000 Stoichiometric ionic strength = .1909941E-01 Osmotic coef. = 0.9208 True ionic strength = .2490127E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8458E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.48853E-09 -9.3111 0.40485E-09 -9.3927 0.82870E+00 -0.0816 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.93519E-03 -3.0291 0.76948E-03 -3.1138 0.82280E+00 -0.0847 4 SO4-- 0.61923E-03 -3.2081 0.30322E-03 -3.5182 0.48967E+00 -0.3101 5 HCO3- 0.70725E-02 -2.1504 0.58294E-02 -2.2344 0.82423E+00 -0.0840 6 HS- 0.26450E-02 -2.5776 0.21767E-02 -2.6622 0.82294E+00 -0.0846 7 Al+++ 0.28832E-26 -26.5401 0.58202E-27 -27.2351 0.20187E+00 -0.6949 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.25901E-07 -7.5867 0.12572E-07 -7.9006 0.48539E+00 -0.3139 10 Mg++ 0.25762E-10 -10.5890 0.12437E-10 -10.9053 0.48276E+00 -0.3163 11 Fe++ 0.90235E-13 -13.0446 0.43619E-13 -13.3603 0.48339E+00 -0.3157 12 K+ 0.15603E-03 -3.8068 0.12864E-03 -3.8906 0.82445E+00 -0.0838 13 Na+ 0.21551E-01 -1.6665 0.17728E-01 -1.7513 0.82261E+00 -0.0848 14 Mn++ 0.29251E-09 -9.5339 0.14153E-09 -9.8491 0.48387E+00 -0.3153 15 F- 0.53253E-04 -4.2737 0.43710E-04 -4.3594 0.82080E+00 -0.0858 16 HPO4-- 0.45900E-07 -7.3382 0.22479E-07 -7.6482 0.48975E+00 -0.3100 18 HSiO3- 0.28721E-02 -2.5418 0.23632E-02 -2.6265 0.82280E+00 -0.0847 19 Ca(HSiO3)+ 0.82050E-09 -9.0859 0.67664E-09 -9.1696 0.82466E+00 -0.0837 20 Mg(HSiO3)+ 0.10101E-11 -11.9956 0.83303E-12 -12.0793 0.82466E+00 -0.0837 21 NaHSiO3,aq 0.67760E-03 -3.1690 0.67760E-03 -3.1690 0.10000E+01 0.0000 22 AlO+ 0.58581E-15 -15.2322 0.48309E-15 -15.3160 0.82466E+00 -0.0837 24 HAlO2,aq 0.23764E-09 -9.6241 0.23764E-09 -9.6241 0.10000E+01 0.0000 25 AlO2- 0.15825E-05 -5.8006 0.12993E-05 -5.8863 0.82105E+00 -0.0856 26 CH4,aq 0.40884E-07 -7.3884 0.40649E-07 -7.3910 0.99425E+00 -0.0025 27 C2H6,aq 0.20432E-17 -17.6897 0.20315E-17 -17.6922 0.99425E+00 -0.0025 31 CO,aq 0.17615E-13 -13.7541 0.17615E-13 -13.7541 0.10000E+01 0.0000 32 CO2,aq 0.50719E-05 -5.2948 0.50428E-05 -5.2973 0.99425E+00 -0.0025 33 CO3-2 0.25749E-02 -2.5892 0.12577E-02 -2.9004 0.48844E+00 -0.3112 34 CaCO3,aq 0.19827E-06 -6.7027 0.19827E-06 -6.7027 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.22685E-08 -8.6443 0.18708E-08 -8.7280 0.82466E+00 -0.0837 36 CaCl+ 0.18985E-10 -10.7216 0.15656E-10 -10.8053 0.82466E+00 -0.0837 37 CaCl2,aq 0.28621E-14 -14.5433 0.28621E-14 -14.5433 0.10000E+01 0.0000 38 CaF+ 0.97293E-11 -11.0119 0.80234E-11 -11.0956 0.82466E+00 -0.0837 39 CaOH+ 0.26838E-08 -8.5712 0.22133E-08 -8.6550 0.82466E+00 -0.0837 40 CaSO4,aq 0.12105E-08 -8.9170 0.12105E-08 -8.9170 0.10000E+01 0.0000 41 HCl,aq 0.57085E-13 -13.2435 0.57085E-13 -13.2435 0.10000E+01 0.0000 45 HF,aq 0.12114E-09 -9.9167 0.12114E-09 -9.9167 0.10000E+01 0.0000 46 HF2- 0.21728E-14 -14.6630 0.17878E-14 -14.7477 0.82280E+00 -0.0847 48 FeCl+ 0.64421E-16 -16.1910 0.53126E-16 -16.2747 0.82466E+00 -0.0837 51 FeF+ 0.11815E-15 -15.9276 0.97430E-16 -16.0113 0.82466E+00 -0.0837 53 FeO,aq 0.10343E-10 -10.9853 0.10343E-10 -10.9853 0.10000E+01 0.0000 54 FeOH+ 0.42528E-11 -11.3713 0.35071E-11 -11.4551 0.82466E+00 -0.0837 55 HFeO2- 0.32489E-09 -9.4883 0.26732E-09 -9.5730 0.82280E+00 -0.0847 56 FeO+ 0.27203E-16 -16.5654 0.22433E-16 -16.6491 0.82466E+00 -0.0837 58 FeO2- 0.34038E-10 -10.4680 0.28006E-10 -10.5527 0.82280E+00 -0.0847 59 HFeO2,aq 0.14421E-11 -11.8410 0.14421E-11 -11.8410 0.10000E+01 0.0000 60 H2,aq 0.13985E-06 -6.8543 0.13905E-06 -6.8568 0.99425E+00 -0.0025 61 KCl,aq 0.17941E-08 -8.7462 0.17941E-08 -8.7462 0.10000E+01 0.0000 62 KHSO4,aq 0.44649E-16 -16.3502 0.44649E-16 -16.3502 0.10000E+01 0.0000 63 KOH,aq 0.13570E-06 -6.8674 0.13570E-06 -6.8674 0.10000E+01 0.0000 64 KSO4- 0.73564E-06 -6.1333 0.60528E-06 -6.2180 0.82280E+00 -0.0847 65 MgCO3,aq 0.49163E-10 -10.3084 0.49163E-10 -10.3084 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.22931E-11 -11.6396 0.18910E-11 -11.7233 0.82466E+00 -0.0837 67 MgCl+ 0.17021E-13 -13.7690 0.14037E-13 -13.8527 0.82466E+00 -0.0837 68 MgF+ 0.35653E-13 -13.4479 0.29402E-13 -13.5316 0.82466E+00 -0.0837 69 MgOH+ 0.14691E-10 -10.8329 0.12115E-10 -10.9167 0.82466E+00 -0.0837 71 MnF+ 0.12636E-12 -12.8984 0.10420E-12 -12.9821 0.82466E+00 -0.0837 72 MnO,aq 0.89427E-09 -9.0485 0.89427E-09 -9.0485 0.10000E+01 0.0000 73 MnOH+ 0.12819E-08 -8.8921 0.10571E-08 -8.9759 0.82466E+00 -0.0837 74 MnO2-2 0.37073E-12 -12.4309 0.18108E-12 -12.7421 0.48844E+00 -0.3112 75 HMnO2- 0.19519E-10 -10.7095 0.16061E-10 -10.7942 0.82280E+00 -0.0847 78 MnCl+ 0.81323E-12 -12.0898 0.67064E-12 -12.1735 0.82466E+00 -0.0837 79 MnSO4,aq 0.12389E-10 -10.9070 0.12389E-10 -10.9070 0.10000E+01 0.0000 80 NaCl,aq 0.45208E-05 -5.3448 0.45208E-05 -5.3448 0.10000E+01 0.0000 81 NaF,aq 0.18142E-06 -6.7413 0.18142E-06 -6.7413 0.10000E+01 0.0000 82 NaOH,aq 0.18814E-04 -4.7255 0.18814E-04 -4.7255 0.10000E+01 0.0000 84 OH- 0.17382E-02 -2.7599 0.14271E-02 -2.8455 0.82105E+00 -0.0856 89 HPO3-2 0.19943E-16 -16.7002 0.97409E-17 -17.0114 0.48844E+00 -0.3112 92 H3PO4,aq 0.25769E-16 -16.5889 0.25769E-16 -16.5889 0.10000E+01 0.0000 93 H2PO4- 0.20381E-09 -9.6908 0.16788E-09 -9.7750 0.82372E+00 -0.0842 94 PO4-3 0.21175E-09 -9.6742 0.45303E-10 -10.3439 0.21395E+00 -0.6697 98 HP2O7-3 0.53927E-17 -17.2682 0.10900E-17 -17.9626 0.20212E+00 -0.6944 99 P2O7-4 0.10547E-16 -16.9769 0.64320E-18 -18.1917 0.60986E-01 -1.2148 100 H2S,aq 0.27393E-05 -5.5624 0.27235E-05 -5.5649 0.99425E+00 -0.0025 101 S2-2 0.15457E-08 -8.8109 0.75499E-09 -9.1221 0.48844E+00 -0.3112 102 S3-2 0.40789E-13 -13.3895 0.19923E-13 -13.7007 0.48844E+00 -0.3112 103 S3- 0.17621E-16 -16.7540 0.14499E-16 -16.8387 0.82280E+00 -0.0847 104 S4-2 0.71100E-18 -18.1481 0.34728E-18 -18.4593 0.48844E+00 -0.3112 106 SO2,aq 0.30862E-19 -19.5106 0.30862E-19 -19.5106 0.10000E+01 0.0000 107 SO3-2 0.11028E-10 -10.9575 0.54789E-11 -11.2613 0.49680E+00 -0.3038 108 HSO3- 0.16879E-12 -12.7726 0.13888E-12 -12.8574 0.82280E+00 -0.0847 109 HSO4- 0.14329E-09 -9.8438 0.11830E-09 -9.9270 0.82562E+00 -0.0832 111 S2O3-2 0.19861E-10 -10.7020 0.97006E-11 -11.0132 0.48844E+00 -0.3112 112 HS2O3- 0.85343E-18 -18.0688 0.70220E-18 -18.1535 0.82280E+00 -0.0847 Charge balance for all species = -.6119E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4885344E-09 -.7880585E-02 -.7929792E+01 0.0000 2 H2O 0.1000000E+01 0.5550646E+02 0.9982830E+06 0.0000 3 Cl- 0.9351910E-03 0.9397136E-03 0.3325961E+02 6.2789 4 SO4-- 0.6192322E-03 0.6198938E-03 0.5944780E+02 15.2672 5 HCO3- 0.7072522E-02 0.9652772E-02 0.5879941E+03 7.1583 6 HS- 0.2644965E-02 0.2647782E-02 0.8742012E+02 6.7305 7 Al+++ 0.2883202E-26 0.1582779E-05 0.4263389E-01 0.9431 8 H4SiO4 0.1024625E-02 0.4574367E-02 0.4389273E+03 -2.9894 9 Ca++ 0.2590143E-07 0.2311812E-06 0.9249692E-02 10.8848 10 Mg++ 0.2576246E-10 0.9297230E-10 0.2256540E-05 7.8801 11 Fe++ 0.9023518E-13 0.3750553E-09 0.2091047E-04 5.4251 12 K+ 0.1560330E-03 0.1569062E-03 0.6125022E+01 5.5021 13 Na+ 0.2155093E-01 0.2225204E-01 0.5107092E+03 7.6414 14 Mn++ 0.2925057E-09 0.2501909E-08 0.1372186E-03 8.9363 15 F- 0.5325321E-04 0.5343476E-04 0.1013446E+01 5.0333 16 HPO4-- 0.4590011E-07 0.4631567E-07 0.4437852E-02 11.1372 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7106617E-02 -.7093222E-02 -.1339478E-04 0.0000000E+00 2 H2O 0.4994464E+02 0.4996071E+02 -.1606470E-01 0.0000000E+00 3 Cl- 0.8458252E-03 0.8458252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5579672E-03 0.5579591E-03 0.8063672E-08 0.0000000E+00 5 HCO3- 0.8688347E-02 0.8688347E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2383294E-02 0.2383238E-02 0.5644570E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1424641E-05 0.3350711E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.4117334E-02 0.8035686E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.3375828E-09 0.3225469E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002880E-01 0.3350711E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4809600E-04 0.4809600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.901605E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3351E-05 -5.475 0.8786E-03 -3.056 0.1819 0.3373E-03 pyrite 0.3225E-07 -7.491 0.3870E-05 -5.412 0.8011E-03 0.7721E-06 quartz 0.8026E-02 -2.096 0.4822 -0.317 99.82 0.1821 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.483063 g Volume = 0.182430 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1199900 moles log = -0.9209 Original solution: 1000.0103000 g Original solution / Rock added: 8334.11 (Water/Rock Ratio), log = 3.9209 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0212 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9992E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.5246E-03 1.0071 0.5395E-03 0.5357E-03 CH4,gas 0.5787E-04 1.0125 0.5983E-04 0.5909E-04 H2,gas 0.1787E-03 1.0005 0.1826E-03 0.1825E-03 H2S,gas 0.7361E-04 0.9960 0.7487E-04 0.7517E-04 S2,gas 0.6182E-20 1.0000 0.6313E-20 0.6313E-20 CO,gas 0.2571E-10 1.0000 0.2625E-10 0.2625E-10 SO3,gas 0.1840E-37 1.0000 0.1879E-37 0.1879E-37 SO2,gas 0.1307E-18 1.0000 0.1335E-18 0.1335E-18 HF,gas 0.2913E-12 1.0000 0.2974E-12 0.2974E-12 HCl,gas 0.9864E-16 1.0000 0.1007E-15 0.1007E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 -0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.63 -4.97 -1.656 0.84810E+04 -3.268 3 CH4,gas 4.54 -1.38 -5.92 -1.481 0.10112E+05 -4.223 4 H2,gas 8.00 2.56 -5.44 -3.107 0.92845E+04 -3.739 5 H2S,gas -6.23 -12.05 -5.82 -2.912 0.99455E+04 -4.126 6 S2,gas -7.34 -29.23 -21.90 -3.369 0.37391E+05 -20.200 7 CO,gas 3.21 -9.06 -12.28 -3.778 0.20968E+05 -10.581 8 SO3,gas 17.12 -22.30 -39.43 -9.856 0.67317E+05 -37.726 9 SO2,gas 0.83 -19.74 -20.57 -5.486 0.35129E+05 -18.875 10 HF,gas 0.47 -13.75 -14.23 -7.113 0.24290E+05 -12.527 11 HCl,gas 5.19 -12.51 -17.70 -8.848 0.30215E+05 -15.997 12 acmite 7.71 5.81 -1.90 -0.198 0.32497E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.73 -4.73 -0.237 0.80775E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.94 -4.81 -0.802 0.82115E+04 34 apatite-F -34.30 -38.63 -4.33 -0.361 0.73897E+04 38 aragonite 0.97 -0.74 -1.71 -0.570 0.29177E+04 39 brucite 12.57 7.88 -4.69 -0.938 0.80054E+04 40 calcite 0.81 -0.74 -1.55 -0.518 0.26535E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.79 -4.79 -0.320 0.81868E+04 45 celadonite 5.34 2.37 -2.97 -0.175 0.50781E+04 46 celadonite-Fe 3.88 -0.09 -3.96 -0.233 0.67684E+04 54 chloritoid-Fe 9.17 4.32 -4.85 -0.323 0.82844E+04 55 chloritoid-Mn 11.40 7.83 -3.57 -0.238 0.60924E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.21 -0.351 0.71860E+04 68 diaspore 2.87 0.94 -1.93 -0.322 0.32965E+04 69 diamond -3.10 -6.50 -3.40 -0.972 0.58060E+04 70 diopside 16.18 12.79 -3.40 -0.340 0.57973E+04 71 hedenbergite 14.21 10.33 -3.88 -0.388 0.66202E+04 86 gibbsite 4.08 0.94 -3.14 -0.448 0.53550E+04 89 graphite -3.55 -6.50 -2.96 -0.845 0.50482E+04 93 hematite 12.57 8.29 -4.28 -0.519 0.73049E+04 94 heulandite -5.83 -8.16 -2.33 -0.106 0.39747E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.46 -4.13 -0.590 0.70488E+04 101 kaolinite -1.33 -4.09 -2.76 -0.251 0.47126E+04 104 laumontite 2.88 0.81 -2.07 -0.138 0.35348E+04 105 lawsonite 9.62 6.79 -2.82 -0.188 0.48219E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62367E+04 109 magnesite 0.69 -3.75 -4.44 -1.479 0.75770E+04 119 microcline -2.49 -2.52 -0.04 -0.003 0.62583E+02 123 muscovite 2.58 -0.64 -3.22 -0.189 0.54971E+04 124 paragonite 4.24 1.50 -2.74 -0.161 0.46736E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.69 -4.68 -0.276 0.79984E+04 140 prehnite-Fe 22.50 17.89 -4.61 -0.277 0.78705E+04 146 pyrrhotite -4.26 -6.63 -2.37 -0.790 0.40459E+04 147 pyrrhotiteFe0.875 -6.02 -7.63 -1.61 -0.592 0.27469E+04 148 pyroxmangite 7.40 5.95 -1.45 -0.290 0.24790E+04 149 pyrophyllite -6.18 -10.07 -3.90 -0.243 0.66520E+04 154 rhodochrosite -0.98 -2.69 -1.71 -0.571 0.29274E+04 155 rhodonite 7.45 5.95 -1.50 -0.300 0.25592E+04 156 sanidine -1.28 -2.52 -1.25 -0.096 0.21303E+04 158 siderite -2.61 -6.20 -3.59 -1.198 0.61364E+04 166 stilbite -7.52 -8.16 -0.63 -0.030 0.10809E+04 174 talc 16.49 11.68 -4.81 -0.283 0.82102E+04 177 tephroite 18.09 14.88 -3.20 -0.458 0.54685E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.63 -2.22 -0.740 0.37887E+04 190 wairakite 3.95 0.81 -3.14 -0.185 0.53567E+04 191 walstromite 11.51 7.90 -3.61 -0.723 0.61705E+04 192 wollastonite 10.46 7.90 -2.57 -0.513 0.43809E+04 193 pseudo-wollastonite 11.00 7.90 -3.10 -0.621 0.53008E+04 195 akaganeite 7.75 4.14 -3.61 -0.781 0.61650E+04 200 beidellite-Na -1.34 -6.25 -4.91 -0.301 0.83837E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.04 -4.72 -0.591 0.80669E+04 204 montmorillonite-Ca -2.29 -5.99 -3.70 -0.229 0.63102E+04 205 montmorillonite-K -2.24 -5.97 -3.73 -0.228 0.63688E+04 206 montmorillonite-Mg -2.48 -6.48 -4.00 -0.248 0.68338E+04 207 montmorillonite-Na -2.04 -5.26 -3.22 -0.197 0.55031E+04 208 nontronite-Ca 3.21 -0.58 -3.79 -0.246 0.64723E+04 209 nontronite-H 2.53 -2.37 -4.90 -0.329 0.83747E+04 210 nontronite-K 3.34 -0.56 -3.90 -0.250 0.66541E+04 211 nontronite-Mg 3.07 -1.07 -4.15 -0.269 0.70799E+04 212 nontronite-Na 3.52 0.15 -3.37 -0.216 0.57543E+04 228 tobermorite 9.82 6.08 -3.75 -1.022 0.63952E+04 234 alabandite -0.98 -3.12 -2.14 -0.714 0.36553E+04 237 boehmite 4.41 0.94 -3.46 -0.577 0.59134E+04 239 ferrous-oxide 9.81 5.43 -4.39 -1.097 0.74898E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.97 -0.074 0.16502E+04 248 an25ab75 2.65 1.41 -1.24 -0.095 0.21097E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25788E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1199900 MOLES New total amount of reactant added: 0.1239900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1239900 Water: Moles liquid = 0.4997E+02 kg liquid = 0.9002E+00 Moles total = 0.4995E+02 kg total = 0.8998E+00 Activity = 1.0000 Stoichiometric ionic strength = .1935842E-01 Osmotic coef. = 0.9204 True ionic strength = .2490429E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8694E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.52953E-09 -9.2761 0.43881E-09 -9.3577 0.82869E+00 -0.0816 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.96120E-03 -3.0172 0.79087E-03 -3.1019 0.82279E+00 -0.0847 4 SO4-- 0.64038E-03 -3.1936 0.31356E-03 -3.5037 0.48965E+00 -0.3101 5 HCO3- 0.74611E-02 -2.1272 0.61496E-02 -2.2112 0.82422E+00 -0.0840 6 HS- 0.27312E-02 -2.5636 0.22476E-02 -2.6483 0.82293E+00 -0.0846 7 Al+++ 0.39706E-26 -26.4011 0.80147E-27 -27.0961 0.20185E+00 -0.6950 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.26520E-07 -7.5764 0.12872E-07 -7.8903 0.48538E+00 -0.3139 10 Mg++ 0.26444E-10 -10.5777 0.12766E-10 -10.8939 0.48275E+00 -0.3163 11 Fe++ 0.82913E-13 -13.0814 0.40078E-13 -13.3971 0.48337E+00 -0.3157 12 K+ 0.15601E-03 -3.8069 0.12862E-03 -3.8907 0.82444E+00 -0.0838 13 Na+ 0.21602E-01 -1.6655 0.17770E-01 -1.7503 0.82261E+00 -0.0848 14 Mn++ 0.32298E-09 -9.4908 0.15627E-09 -9.8061 0.48385E+00 -0.3153 15 F- 0.55020E-04 -4.2595 0.45160E-04 -4.3452 0.82079E+00 -0.0858 16 HPO4-- 0.45896E-07 -7.3382 0.22477E-07 -7.6483 0.48973E+00 -0.3100 18 HSiO3- 0.26498E-02 -2.5768 0.21803E-02 -2.6615 0.82279E+00 -0.0847 19 Ca(HSiO3)+ 0.77505E-09 -9.1107 0.63915E-09 -9.1944 0.82465E+00 -0.0837 20 Mg(HSiO3)+ 0.95659E-12 -12.0193 0.78886E-12 -12.1030 0.82465E+00 -0.0837 21 NaHSiO3,aq 0.62661E-03 -3.2030 0.62661E-03 -3.2030 0.10000E+01 0.0000 22 AlO+ 0.68664E-15 -15.1633 0.56624E-15 -15.2470 0.82465E+00 -0.0837 24 HAlO2,aq 0.25698E-09 -9.5901 0.25698E-09 -9.5901 0.10000E+01 0.0000 25 AlO2- 0.15789E-05 -5.8017 0.12963E-05 -5.8873 0.82104E+00 -0.0856 26 CH4,aq 0.43070E-07 -7.3658 0.42818E-07 -7.3684 0.99417E+00 -0.0025 27 C2H6,aq 0.23143E-17 -17.6356 0.23008E-17 -17.6381 0.99417E+00 -0.0025 31 CO,aq 0.19732E-13 -13.7048 0.19732E-13 -13.7048 0.10000E+01 0.0000 32 CO2,aq 0.57999E-05 -5.2366 0.57661E-05 -5.2391 0.99417E+00 -0.0025 33 CO3-2 0.25062E-02 -2.6010 0.12241E-02 -2.9122 0.48842E+00 -0.3112 34 CaCO3,aq 0.19757E-06 -6.7043 0.19757E-06 -6.7043 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.24503E-08 -8.6108 0.20206E-08 -8.6945 0.82465E+00 -0.0837 36 CaCl+ 0.19978E-10 -10.6994 0.16475E-10 -10.7832 0.82465E+00 -0.0837 37 CaCl2,aq 0.30956E-14 -14.5093 0.30956E-14 -14.5093 0.10000E+01 0.0000 38 CaF+ 0.10292E-10 -10.9875 0.84873E-11 -11.0712 0.82465E+00 -0.0837 39 CaOH+ 0.25352E-08 -8.5960 0.20906E-08 -8.6797 0.82465E+00 -0.0837 40 CaSO4,aq 0.12817E-08 -8.8922 0.12817E-08 -8.8922 0.10000E+01 0.0000 41 HCl,aq 0.63595E-13 -13.1966 0.63595E-13 -13.1966 0.10000E+01 0.0000 45 HF,aq 0.13566E-09 -9.8675 0.13566E-09 -9.8675 0.10000E+01 0.0000 46 HF2- 0.25140E-14 -14.5996 0.20685E-14 -14.6844 0.82279E+00 -0.0847 48 FeCl+ 0.60838E-16 -16.2158 0.50170E-16 -16.2996 0.82465E+00 -0.0837 51 FeF+ 0.11216E-15 -15.9502 0.92491E-16 -16.0339 0.82465E+00 -0.0837 53 FeO,aq 0.80893E-11 -11.0921 0.80893E-11 -11.0921 0.10000E+01 0.0000 54 FeOH+ 0.36051E-11 -11.4431 0.29730E-11 -11.5268 0.82465E+00 -0.0837 55 HFeO2- 0.23442E-09 -9.6300 0.19288E-09 -9.7147 0.82279E+00 -0.0847 56 FeO+ 0.23298E-16 -16.6327 0.19213E-16 -16.7164 0.82465E+00 -0.0837 58 FeO2- 0.24813E-10 -10.6053 0.20416E-10 -10.6900 0.82279E+00 -0.0847 59 HFeO2,aq 0.11394E-11 -11.9433 0.11394E-11 -11.9433 0.10000E+01 0.0000 60 H2,aq 0.13703E-06 -6.8632 0.13623E-06 -6.8657 0.99417E+00 -0.0025 61 KCl,aq 0.18436E-08 -8.7343 0.18436E-08 -8.7343 0.10000E+01 0.0000 62 KHSO4,aq 0.50037E-16 -16.3007 0.50037E-16 -16.3007 0.10000E+01 0.0000 63 KOH,aq 0.12517E-06 -6.9025 0.12517E-06 -6.9025 0.10000E+01 0.0000 64 KSO4- 0.76061E-06 -6.1188 0.62583E-06 -6.2035 0.82279E+00 -0.0847 65 MgCO3,aq 0.49113E-10 -10.3088 0.49113E-10 -10.3088 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.24830E-11 -11.6050 0.20476E-11 -11.6887 0.82465E+00 -0.0837 67 MgCl+ 0.17957E-13 -13.7458 0.14809E-13 -13.8295 0.82465E+00 -0.0837 68 MgF+ 0.37809E-13 -13.4224 0.31180E-13 -13.5061 0.82465E+00 -0.0837 69 MgOH+ 0.13912E-10 -10.8566 0.11473E-10 -10.9403 0.82465E+00 -0.0837 71 MnF+ 0.14415E-12 -12.8412 0.11887E-12 -12.9249 0.82465E+00 -0.0837 72 MnO,aq 0.84045E-09 -9.0755 0.84045E-09 -9.0755 0.10000E+01 0.0000 73 MnOH+ 0.13059E-08 -8.8841 0.10769E-08 -8.9678 0.82465E+00 -0.0837 74 MnO2-2 0.29657E-12 -12.5279 0.14485E-12 -12.8391 0.48842E+00 -0.3112 75 HMnO2- 0.16925E-10 -10.7715 0.13926E-10 -10.8562 0.82279E+00 -0.0847 78 MnCl+ 0.92290E-12 -12.0348 0.76107E-12 -12.1186 0.82465E+00 -0.0837 79 MnSO4,aq 0.14146E-10 -10.8494 0.14146E-10 -10.8494 0.10000E+01 0.0000 80 NaCl,aq 0.46573E-05 -5.3319 0.46573E-05 -5.3319 0.10000E+01 0.0000 81 NaF,aq 0.18787E-06 -6.7261 0.18787E-06 -6.7261 0.10000E+01 0.0000 82 NaOH,aq 0.17398E-04 -4.7595 0.17398E-04 -4.7595 0.10000E+01 0.0000 84 OH- 0.16037E-02 -2.7949 0.13167E-02 -2.8805 0.82104E+00 -0.0856 89 HPO3-2 0.19537E-16 -16.7092 0.95420E-17 -17.0204 0.48842E+00 -0.3112 91 H2PO3- 0.10205E-19 -19.9912 0.83965E-20 -20.0759 0.82279E+00 -0.0847 92 H3PO4,aq 0.30270E-16 -16.5190 0.30270E-16 -16.5190 0.10000E+01 0.0000 93 H2PO4- 0.22089E-09 -9.6558 0.18195E-09 -9.7401 0.82372E+00 -0.0842 94 PO4-3 0.19535E-09 -9.7092 0.41791E-10 -10.3789 0.21393E+00 -0.6697 98 HP2O7-3 0.58442E-17 -17.2333 0.11812E-17 -17.9277 0.20211E+00 -0.6944 99 P2O7-4 0.10546E-16 -16.9769 0.64304E-18 -18.1918 0.60977E-01 -1.2148 100 H2S,aq 0.30661E-05 -5.5134 0.30482E-05 -5.5160 0.99417E+00 -0.0025 101 S2-2 0.16824E-08 -8.7741 0.82169E-09 -9.0853 0.48842E+00 -0.3112 102 S3-2 0.50717E-13 -13.2948 0.24771E-13 -13.6061 0.48842E+00 -0.3112 103 S3- 0.23993E-16 -16.6199 0.19741E-16 -16.7046 0.82279E+00 -0.0847 104 S4-2 0.10100E-17 -17.9957 0.49329E-18 -18.3069 0.48842E+00 -0.3112 106 SO2,aq 0.36734E-19 -19.4349 0.36734E-19 -19.4349 0.10000E+01 0.0000 107 SO3-2 0.11173E-10 -10.9518 0.55509E-11 -11.2556 0.49679E+00 -0.3038 108 HSO3- 0.18536E-12 -12.7320 0.15251E-12 -12.8167 0.82279E+00 -0.0847 109 HSO4- 0.16061E-09 -9.7942 0.13260E-09 -9.8774 0.82561E+00 -0.0832 111 S2O3-2 0.22988E-10 -10.6385 0.11228E-10 -10.9497 0.48842E+00 -0.3112 112 HS2O3- 0.10707E-17 -17.9703 0.88094E-18 -18.0551 0.82279E+00 -0.0847 Charge balance for all species = -.6119E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5295295E-09 -.7401522E-02 -.7447723E+01 0.0000 2 H2O 0.1000000E+01 0.5550659E+02 0.9982834E+06 0.0000 3 Cl- 0.9612036E-03 0.9658628E-03 0.3418505E+02 6.2558 4 SO4-- 0.6403820E-03 0.6410672E-03 0.6147820E+02 15.2118 5 HCO3- 0.7461103E-02 0.9973347E-02 0.6075206E+03 7.1466 6 HS- 0.2731206E-02 0.2734352E-02 0.9027815E+02 6.7094 7 Al+++ 0.3970617E-26 0.1579122E-05 0.4253529E-01 0.9770 8 H4SiO4 0.1024625E-02 0.4301074E-02 0.4127031E+03 -2.9894 9 Ca++ 0.2652031E-07 0.2311644E-06 0.9248998E-02 10.8251 10 Mg++ 0.2644439E-10 0.9296553E-10 0.2256370E-05 7.8215 11 Fe++ 0.8291327E-13 0.2721523E-09 0.1517329E-04 5.3183 12 K+ 0.1560071E-03 0.1568947E-03 0.6124563E+01 5.4670 13 Na+ 0.2160156E-01 0.2225041E-01 0.5106708E+03 7.6074 14 Mn++ 0.3229797E-09 0.2501727E-08 0.1372083E-03 8.9093 15 F- 0.5502032E-04 0.5520834E-04 0.1047081E+01 5.0125 16 HPO4-- 0.4589606E-07 0.4631229E-07 0.4437519E-02 11.0672 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.6675917E-02 -.6662509E-02 -.1340751E-04 0.0000000E+00 2 H2O 0.4994792E+02 0.4996448E+02 -.1655611E-01 0.0000000E+00 3 Cl- 0.8694252E-03 0.8694252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5770672E-03 0.5770591E-03 0.8086823E-08 0.0000000E+00 5 HCO3- 0.8977547E-02 0.8977547E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2461394E-02 0.2461338E-02 0.5660776E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1421452E-05 0.3353900E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.3871629E-02 0.8281391E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.2449790E-09 0.3234729E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002880E-01 0.3353900E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4969600E-04 0.4969600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.901673E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1239900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3354E-05 -5.474 0.8795E-03 -3.056 0.1767 0.3376E-03 pyrite 0.3235E-07 -7.490 0.3881E-05 -5.411 0.7796E-03 0.7743E-06 quartz 0.8271E-02 -2.082 0.4969 -0.304 99.82 0.1877 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.497825 g Volume = 0.188005 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1239900 moles log = -0.9066 Original solution: 1000.0103000 g Original solution / Rock added: 8065.25 (Water/Rock Ratio), log = 3.9066 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0212 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9991E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.5998E-03 1.0071 0.6169E-03 0.6126E-03 CH4,gas 0.6095E-04 1.0125 0.6303E-04 0.6225E-04 H2,gas 0.1750E-03 1.0005 0.1788E-03 0.1788E-03 H2S,gas 0.8238E-04 0.9960 0.8379E-04 0.8413E-04 S2,gas 0.8068E-20 1.0000 0.8239E-20 0.8239E-20 CO,gas 0.2879E-10 1.0000 0.2941E-10 0.2941E-10 SO3,gas 0.2235E-37 1.0000 0.2283E-37 0.2283E-37 SO2,gas 0.1555E-18 1.0000 0.1589E-18 0.1589E-18 HF,gas 0.3262E-12 1.0000 0.3331E-12 0.3331E-12 HCl,gas 0.1099E-15 1.0000 0.1122E-15 0.1122E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.57 -4.91 -1.636 0.83816E+04 -3.210 3 CH4,gas 4.54 -1.36 -5.90 -1.475 0.10073E+05 -4.200 4 H2,gas 8.00 2.55 -5.45 -3.112 0.92997E+04 -3.748 5 H2S,gas -6.23 -12.01 -5.78 -2.888 0.98620E+04 -4.077 6 S2,gas -7.34 -29.12 -21.78 -3.351 0.37194E+05 -20.084 7 CO,gas 3.21 -9.02 -12.23 -3.763 0.20883E+05 -10.532 8 SO3,gas 17.12 -22.22 -39.34 -9.835 0.67173E+05 -37.642 9 SO2,gas 0.83 -19.67 -20.50 -5.466 0.35000E+05 -18.799 10 HF,gas 0.47 -13.70 -14.18 -7.088 0.24206E+05 -12.477 11 HCl,gas 5.19 -12.46 -17.65 -8.824 0.30135E+05 -15.950 12 acmite 7.71 5.67 -2.04 -0.212 0.34824E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.71 -4.74 -0.237 0.80995E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -6.99 -4.86 -0.810 0.82970E+04 34 apatite-F -34.30 -38.67 -4.37 -0.364 0.74576E+04 38 aragonite 0.97 -0.74 -1.71 -0.570 0.29203E+04 39 brucite 12.57 7.82 -4.75 -0.949 0.81055E+04 40 calcite 0.81 -0.74 -1.56 -0.519 0.26561E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.80 -4.79 -0.319 0.81709E+04 45 celadonite 5.34 2.31 -3.03 -0.178 0.51801E+04 46 celadonite-Fe 3.88 -0.20 -4.07 -0.240 0.69526E+04 54 chloritoid-Fe 9.17 4.28 -4.89 -0.326 0.83506E+04 55 chloritoid-Mn 11.40 7.87 -3.53 -0.235 0.60224E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.52 -4.21 -0.351 0.71878E+04 68 diaspore 2.87 0.98 -1.90 -0.316 0.32385E+04 69 diamond -3.10 -6.46 -3.36 -0.960 0.57370E+04 70 diopside 16.18 12.67 -3.51 -0.351 0.59994E+04 71 hedenbergite 14.21 10.16 -4.04 -0.404 0.69045E+04 86 gibbsite 4.08 0.98 -3.10 -0.443 0.52970E+04 89 graphite -3.55 -6.46 -2.92 -0.833 0.49792E+04 93 hematite 12.57 8.08 -4.48 -0.543 0.76542E+04 94 heulandite -5.83 -8.15 -2.32 -0.105 0.39607E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.13 -0.590 0.70506E+04 101 kaolinite -1.33 -4.02 -2.69 -0.245 0.45965E+04 104 laumontite 2.88 0.82 -2.06 -0.137 0.35208E+04 105 lawsonite 9.62 6.80 -2.82 -0.188 0.48078E+04 106 leucite 4.12 0.47 -3.65 -0.365 0.62385E+04 109 magnesite 0.69 -3.75 -4.44 -1.479 0.75777E+04 119 microcline -2.49 -2.52 -0.04 -0.003 0.64446E+02 123 muscovite 2.58 -0.57 -3.15 -0.185 0.53830E+04 124 paragonite 4.24 1.57 -2.67 -0.157 0.45576E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.64 -4.74 -0.279 0.80864E+04 140 prehnite-Fe 22.50 17.70 -4.80 -0.289 0.81911E+04 146 pyrrhotite -4.26 -6.69 -2.43 -0.809 0.41446E+04 147 pyrrhotiteFe0.875 -6.02 -7.67 -1.65 -0.608 0.28209E+04 148 pyroxmangite 7.40 5.92 -1.48 -0.296 0.25250E+04 149 pyrophyllite -6.18 -10.00 -3.83 -0.239 0.65360E+04 154 rhodochrosite -0.98 -2.66 -1.68 -0.561 0.28741E+04 155 rhodonite 7.45 5.92 -1.53 -0.305 0.26052E+04 156 sanidine -1.28 -2.52 -1.25 -0.096 0.21322E+04 158 siderite -2.61 -6.25 -3.64 -1.214 0.62193E+04 166 stilbite -7.52 -8.15 -0.62 -0.030 0.10669E+04 174 talc 16.49 11.51 -4.98 -0.293 0.85106E+04 177 tephroite 18.09 14.83 -3.26 -0.465 0.55605E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.69 -2.28 -0.759 0.38874E+04 190 wairakite 3.95 0.82 -3.13 -0.184 0.53427E+04 191 walstromite 11.51 7.84 -3.67 -0.735 0.62725E+04 192 wollastonite 10.46 7.84 -2.63 -0.525 0.44829E+04 193 pseudo-wollastonite 11.00 7.84 -3.16 -0.633 0.54028E+04 195 akaganeite 7.75 4.04 -3.71 -0.803 0.63396E+04 200 beidellite-Na -1.34 -6.18 -4.84 -0.297 0.82677E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.98 -4.67 -0.583 0.79675E+04 204 montmorillonite-Ca -2.29 -5.96 -3.67 -0.227 0.62632E+04 205 montmorillonite-K -2.24 -5.94 -3.70 -0.227 0.63247E+04 206 montmorillonite-Mg -2.48 -6.45 -3.97 -0.246 0.67865E+04 207 montmorillonite-Na -2.04 -5.23 -3.20 -0.196 0.54584E+04 208 nontronite-Ca 3.21 -0.78 -3.99 -0.259 0.68193E+04 210 nontronite-K 3.34 -0.76 -4.10 -0.263 0.70040E+04 211 nontronite-Mg 3.07 -1.27 -4.35 -0.282 0.74266E+04 212 nontronite-Na 3.52 -0.05 -3.57 -0.229 0.61036E+04 228 tobermorite 9.82 6.03 -3.80 -1.036 0.64802E+04 234 alabandite -0.98 -3.10 -2.12 -0.706 0.36178E+04 237 boehmite 4.41 0.98 -3.43 -0.572 0.58554E+04 239 ferrous-oxide 9.81 5.32 -4.49 -1.123 0.76721E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.05 -0.96 -0.074 0.16474E+04 248 an25ab75 2.65 1.41 -1.23 -0.095 0.21062E+04 249 an30ab70 3.28 1.77 -1.51 -0.116 0.25746E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1239900 MOLES New total amount of reactant added: 0.1279900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1279900 Water: Moles liquid = 0.4997E+02 kg liquid = 0.9002E+00 Moles total = 0.4995E+02 kg total = 0.8999E+00 Activity = 1.0000 Stoichiometric ionic strength = .1961739E-01 Osmotic coef. = 0.9199 True ionic strength = .2489410E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8930E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.57641E-09 -9.2393 0.47767E-09 -9.3209 0.82871E+00 -0.0816 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.98721E-03 -3.0056 0.81229E-03 -3.0903 0.82281E+00 -0.0847 4 SO4-- 0.66153E-03 -3.1795 0.32395E-03 -3.4895 0.48970E+00 -0.3101 5 HCO3- 0.78614E-02 -2.1045 0.64796E-02 -2.1884 0.82424E+00 -0.0839 6 HS- 0.28174E-02 -2.5502 0.23186E-02 -2.6348 0.82296E+00 -0.0846 7 Al+++ 0.55609E-26 -26.2549 0.11228E-26 -26.9497 0.20190E+00 -0.6949 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.27274E-07 -7.5643 0.13240E-07 -7.8781 0.48543E+00 -0.3139 10 Mg++ 0.27216E-10 -10.5652 0.13140E-10 -10.8814 0.48280E+00 -0.3162 11 Fe++ 0.76241E-13 -13.1178 0.36857E-13 -13.4335 0.48343E+00 -0.3157 12 K+ 0.15598E-03 -3.8069 0.12860E-03 -3.8908 0.82447E+00 -0.0838 13 Na+ 0.21651E-01 -1.6645 0.17811E-01 -1.7493 0.82263E+00 -0.0848 14 Mn++ 0.35732E-09 -9.4469 0.17291E-09 -9.7622 0.48390E+00 -0.3152 15 F- 0.56787E-04 -4.2457 0.46612E-04 -4.3315 0.82082E+00 -0.0858 16 HPO4-- 0.45889E-07 -7.3383 0.22476E-07 -7.6483 0.48979E+00 -0.3100 18 HSiO3- 0.24342E-02 -2.6136 0.20029E-02 -2.6983 0.82281E+00 -0.0847 19 Ca(HSiO3)+ 0.73229E-09 -9.1353 0.60391E-09 -9.2190 0.82468E+00 -0.0837 20 Mg(HSiO3)+ 0.90449E-12 -12.0436 0.74591E-12 -12.1273 0.82468E+00 -0.0837 21 NaHSiO3,aq 0.57696E-03 -3.2389 0.57696E-03 -3.2389 0.10000E+01 0.0000 22 AlO+ 0.81173E-15 -15.0906 0.66942E-15 -15.1743 0.82468E+00 -0.0837 24 HAlO2,aq 0.27909E-09 -9.5543 0.27909E-09 -9.5543 0.10000E+01 0.0000 25 AlO2- 0.15752E-05 -5.8027 0.12933E-05 -5.8883 0.82106E+00 -0.0856 26 CH4,aq 0.45316E-07 -7.3437 0.45049E-07 -7.3463 0.99409E+00 -0.0026 27 C2H6,aq 0.26178E-17 -17.5821 0.26023E-17 -17.5846 0.99409E+00 -0.0026 31 CO,aq 0.22149E-13 -13.6546 0.22149E-13 -13.6546 0.10000E+01 0.0000 32 CO2,aq 0.66529E-05 -5.1770 0.66136E-05 -5.1796 0.99409E+00 -0.0026 33 CO3-2 0.24256E-02 -2.6152 0.11849E-02 -2.9263 0.48847E+00 -0.3112 34 CaCO3,aq 0.19670E-06 -6.7062 0.19670E-06 -6.7062 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.26554E-08 -8.5759 0.21898E-08 -8.6596 0.82468E+00 -0.0837 36 CaCl+ 0.21104E-10 -10.6756 0.17404E-10 -10.7594 0.82468E+00 -0.0837 37 CaCl2,aq 0.33587E-14 -14.4738 0.33587E-14 -14.4738 0.10000E+01 0.0000 38 CaF+ 0.10926E-10 -10.9616 0.90100E-11 -11.0453 0.82468E+00 -0.0837 39 CaOH+ 0.23953E-08 -8.6206 0.19754E-08 -8.7044 0.82468E+00 -0.0837 40 CaSO4,aq 0.13620E-08 -8.8658 0.13620E-08 -8.8658 0.10000E+01 0.0000 41 HCl,aq 0.71101E-13 -13.1481 0.71101E-13 -13.1481 0.10000E+01 0.0000 45 HF,aq 0.15242E-09 -9.8170 0.15242E-09 -9.8170 0.10000E+01 0.0000 46 HF2- 0.29152E-14 -14.5353 0.23987E-14 -14.6200 0.82281E+00 -0.0847 48 FeCl+ 0.57463E-16 -16.2406 0.47388E-16 -16.3243 0.82468E+00 -0.0837 51 FeF+ 0.10646E-15 -15.9728 0.87792E-16 -16.0565 0.82468E+00 -0.0837 53 FeO,aq 0.62781E-11 -11.2022 0.62781E-11 -11.2022 0.10000E+01 0.0000 54 FeOH+ 0.30456E-11 -11.5163 0.25116E-11 -11.6000 0.82468E+00 -0.0837 55 HFeO2- 0.16713E-09 -9.7769 0.13752E-09 -9.8616 0.82281E+00 -0.0847 56 FeO+ 0.19896E-16 -16.7012 0.16407E-16 -16.7850 0.82468E+00 -0.0837 58 FeO2- 0.17882E-10 -10.7476 0.14714E-10 -10.8323 0.82281E+00 -0.0847 59 HFeO2,aq 0.89391E-12 -12.0487 0.89391E-12 -12.0487 0.10000E+01 0.0000 60 H2,aq 0.13411E-06 -6.8725 0.13332E-06 -6.8751 0.99409E+00 -0.0026 61 KCl,aq 0.18933E-08 -8.7228 0.18933E-08 -8.7228 0.10000E+01 0.0000 62 KHSO4,aq 0.56265E-16 -16.2498 0.56265E-16 -16.2498 0.10000E+01 0.0000 63 KOH,aq 0.11497E-06 -6.9394 0.11497E-06 -6.9394 0.10000E+01 0.0000 64 KSO4- 0.78568E-06 -6.1048 0.64647E-06 -6.1895 0.82281E+00 -0.0847 65 MgCO3,aq 0.48932E-10 -10.3104 0.48932E-10 -10.3104 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.26929E-11 -11.5698 0.22207E-11 -11.6535 0.82468E+00 -0.0837 67 MgCl+ 0.18983E-13 -13.7216 0.15655E-13 -13.8053 0.82468E+00 -0.0837 68 MgF+ 0.40167E-13 -13.3961 0.33124E-13 -13.4799 0.82468E+00 -0.0837 69 MgOH+ 0.13155E-10 -10.8809 0.10848E-10 -10.9646 0.82468E+00 -0.0837 71 MnF+ 0.16461E-12 -12.7835 0.13575E-12 -12.8672 0.82468E+00 -0.0837 72 MnO,aq 0.78478E-09 -9.1052 0.78478E-09 -9.1052 0.10000E+01 0.0000 73 MnOH+ 0.13273E-08 -8.8770 0.10946E-08 -8.9607 0.82468E+00 -0.0837 74 MnO2-2 0.23368E-12 -12.6314 0.11415E-12 -12.9425 0.48847E+00 -0.3112 75 HMnO2- 0.14518E-10 -10.8381 0.11945E-10 -10.9228 0.82281E+00 -0.0847 78 MnCl+ 0.10488E-11 -11.9793 0.86490E-12 -12.0630 0.82468E+00 -0.0837 79 MnSO4,aq 0.16171E-10 -10.7913 0.16171E-10 -10.7913 0.10000E+01 0.0000 80 NaCl,aq 0.47945E-05 -5.3193 0.47945E-05 -5.3193 0.10000E+01 0.0000 81 NaF,aq 0.19436E-06 -6.7114 0.19436E-06 -6.7114 0.10000E+01 0.0000 82 NaOH,aq 0.16020E-04 -4.7953 0.16020E-04 -4.7953 0.10000E+01 0.0000 84 OH- 0.14732E-02 -2.8317 0.12096E-02 -2.9174 0.82106E+00 -0.0856 89 HPO3-2 0.19116E-16 -16.7186 0.93378E-17 -17.0298 0.48847E+00 -0.3112 91 H2PO3- 0.10871E-19 -19.9637 0.89445E-20 -20.0484 0.82281E+00 -0.0847 92 H3PO4,aq 0.35867E-16 -16.4453 0.35867E-16 -16.4453 0.10000E+01 0.0000 93 H2PO4- 0.24043E-09 -9.6190 0.19805E-09 -9.7032 0.82374E+00 -0.0842 94 PO4-3 0.17940E-09 -9.7462 0.38390E-10 -10.4158 0.21399E+00 -0.6696 98 HP2O7-3 0.63596E-17 -17.1966 0.12857E-17 -17.8909 0.20216E+00 -0.6943 99 P2O7-4 0.10540E-16 -16.9772 0.64299E-18 -18.1918 0.61005E-01 -1.2146 100 H2S,aq 0.34433E-05 -5.4630 0.34229E-05 -5.4656 0.99409E+00 -0.0026 101 S2-2 0.18292E-08 -8.7377 0.89349E-09 -9.0489 0.48847E+00 -0.3112 102 S3-2 0.63273E-13 -13.1988 0.30907E-13 -13.5099 0.48847E+00 -0.3112 103 S3- 0.32940E-16 -16.4823 0.27104E-16 -16.5670 0.82281E+00 -0.0847 104 S4-2 0.14458E-17 -17.8399 0.70623E-18 -18.1511 0.48847E+00 -0.3112 106 SO2,aq 0.44009E-19 -19.3565 0.44009E-19 -19.3565 0.10000E+01 0.0000 107 SO3-2 0.11296E-10 -10.9471 0.56123E-11 -11.2509 0.49684E+00 -0.3038 108 HSO3- 0.20400E-12 -12.6904 0.16785E-12 -12.7751 0.82281E+00 -0.0847 109 HSO4- 0.18062E-09 -9.7432 0.14913E-09 -9.8264 0.82563E+00 -0.0832 111 S2O3-2 0.26666E-10 -10.5740 0.13026E-10 -10.8852 0.48847E+00 -0.3112 112 HS2O3- 0.13521E-17 -17.8690 0.11125E-17 -17.9537 0.82281E+00 -0.0847 Charge balance for all species = -.6118E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5764071E-09 -.6922531E-02 -.6965723E+01 0.0000 2 H2O 0.1000000E+01 0.5550673E+02 0.9982830E+06 0.0000 3 Cl- 0.9872120E-03 0.9920085E-03 0.3511033E+02 6.2306 4 SO4-- 0.6615287E-03 0.6622376E-03 0.6350826E+02 15.1522 5 HCO3- 0.7861359E-02 0.1029388E-01 0.6270437E+03 7.1324 6 HS- 0.2817384E-02 0.2820910E-02 0.9313571E+02 6.6861 7 Al+++ 0.5560883E-26 0.1575465E-05 0.4243668E-01 1.0129 8 H4SiO4 0.1024625E-02 0.4035797E-02 0.3872478E+03 -2.9894 9 Ca++ 0.2727378E-07 0.2311476E-06 0.9248300E-02 10.7636 10 Mg++ 0.2721572E-10 0.9295877E-10 0.2256200E-05 7.7603 11 Fe++ 0.7624132E-13 0.1953063E-09 0.1088887E-04 5.2083 12 K+ 0.1559808E-03 0.1568833E-03 0.6124101E+01 5.4301 13 Na+ 0.2165082E-01 0.2224879E-01 0.5106322E+03 7.5715 14 Mn++ 0.3573225E-09 0.2501545E-08 0.1371980E-03 8.8796 15 F- 0.5678714E-04 0.5698167E-04 0.1080711E+01 4.9894 16 HPO4-- 0.4588909E-07 0.4630893E-07 0.4437185E-02 10.9935 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.6245217E-02 -.6231797E-02 -.1342025E-04 0.0000000E+00 2 H2O 0.4995119E+02 0.4996823E+02 -.1703315E-01 0.0000000E+00 3 Cl- 0.8930252E-03 0.8930252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5961672E-03 0.5961591E-03 0.8104113E-08 0.0000000E+00 5 HCO3- 0.9266747E-02 0.9266747E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2539494E-02 0.2539438E-02 0.5672879E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1418264E-05 0.3357088E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.3633103E-02 0.8519917E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1758185E-09 0.3241645E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002879E-01 0.3357088E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.5129600E-04 0.5129600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.901741E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1279900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3357E-05 -5.474 0.8803E-03 -3.055 0.1719 0.3379E-03 pyrite 0.3242E-07 -7.489 0.3889E-05 -5.410 0.7594E-03 0.7760E-06 quartz 0.8510E-02 -2.070 0.5113 -0.291 99.83 0.1931 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.512156 g Volume = 0.193417 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1279900 moles log = -0.8928 Original solution: 1000.0103000 g Original solution / Rock added: 7813.19 (Water/Rock Ratio), log = 3.8928 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0213 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9990E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.6879E-03 1.0071 0.7076E-03 0.7026E-03 CH4,gas 0.6412E-04 1.0125 0.6631E-04 0.6549E-04 H2,gas 0.1713E-03 1.0005 0.1750E-03 0.1749E-03 H2S,gas 0.9249E-04 0.9960 0.9409E-04 0.9447E-04 S2,gas 0.1062E-19 1.0000 0.1085E-19 0.1085E-19 CO,gas 0.3232E-10 1.0000 0.3301E-10 0.3301E-10 SO3,gas 0.2736E-37 1.0000 0.2795E-37 0.2795E-37 SO2,gas 0.1863E-18 1.0000 0.1903E-18 0.1903E-18 HF,gas 0.3664E-12 1.0000 0.3742E-12 0.3742E-12 HCl,gas 0.1228E-15 1.0000 0.1255E-15 0.1255E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.51 -4.85 -1.616 0.82799E+04 -3.150 3 CH4,gas 4.54 -1.33 -5.88 -1.469 0.10036E+05 -4.178 4 H2,gas 8.00 2.54 -5.46 -3.118 0.93157E+04 -3.757 5 H2S,gas -6.23 -11.96 -5.73 -2.863 0.97760E+04 -4.026 6 S2,gas -7.34 -29.00 -21.66 -3.333 0.36990E+05 -19.965 7 CO,gas 3.21 -8.97 -12.18 -3.748 0.20798E+05 -10.481 8 SO3,gas 17.12 -22.13 -39.25 -9.813 0.67023E+05 -37.554 9 SO2,gas 0.83 -19.59 -20.42 -5.445 0.34866E+05 -18.721 10 HF,gas 0.47 -13.65 -14.13 -7.063 0.24119E+05 -12.427 11 HCl,gas 5.19 -12.41 -17.60 -8.800 0.30052E+05 -15.901 12 acmite 7.71 5.53 -2.18 -0.227 0.37235E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.70 -4.76 -0.238 0.81296E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -7.05 -4.91 -0.819 0.83866E+04 34 apatite-F -34.30 -38.70 -4.40 -0.367 0.75187E+04 38 aragonite 0.97 -0.75 -1.71 -0.571 0.29236E+04 39 brucite 12.57 7.76 -4.81 -0.962 0.82099E+04 40 calcite 0.81 -0.75 -1.56 -0.519 0.26594E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.81 -4.77 -0.318 0.81529E+04 45 celadonite 5.34 2.25 -3.10 -0.182 0.52864E+04 46 celadonite-Fe 3.88 -0.31 -4.18 -0.246 0.71424E+04 54 chloritoid-Fe 9.17 4.24 -4.93 -0.329 0.84162E+04 55 chloritoid-Mn 11.40 7.92 -3.49 -0.232 0.59508E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.21 -0.351 0.71896E+04 68 diaspore 2.87 1.01 -1.86 -0.310 0.31773E+04 69 diamond -3.10 -6.42 -3.32 -0.948 0.56673E+04 70 diopside 16.18 12.55 -3.64 -0.364 0.62089E+04 71 hedenbergite 14.21 9.99 -4.22 -0.422 0.71975E+04 86 gibbsite 4.08 1.01 -3.07 -0.438 0.52358E+04 89 graphite -3.55 -6.42 -2.88 -0.822 0.49096E+04 93 hematite 12.57 7.87 -4.69 -0.569 0.80141E+04 94 heulandite -5.83 -8.14 -2.31 -0.105 0.39432E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.13 -0.590 0.70524E+04 101 kaolinite -1.33 -3.95 -2.62 -0.238 0.44741E+04 104 laumontite 2.88 0.83 -2.05 -0.137 0.35033E+04 105 lawsonite 9.62 6.81 -2.81 -0.187 0.47904E+04 106 leucite 4.12 0.46 -3.65 -0.365 0.62403E+04 109 magnesite 0.69 -3.75 -4.44 -1.480 0.75805E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.66261E+02 123 muscovite 2.58 -0.50 -3.08 -0.181 0.52623E+04 124 paragonite 4.24 1.64 -2.60 -0.153 0.44352E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.58 -4.79 -0.282 0.81740E+04 140 prehnite-Fe 22.50 17.51 -4.99 -0.300 0.85198E+04 146 pyrrhotite -4.26 -6.75 -2.49 -0.829 0.42466E+04 147 pyrrhotiteFe0.875 -6.02 -7.71 -1.70 -0.624 0.28974E+04 148 pyroxmangite 7.40 5.89 -1.51 -0.302 0.25758E+04 149 pyrophyllite -6.18 -9.93 -3.76 -0.235 0.64135E+04 154 rhodochrosite -0.98 -2.63 -1.65 -0.551 0.28232E+04 155 rhodonite 7.45 5.89 -1.56 -0.311 0.26561E+04 156 sanidine -1.28 -2.53 -1.25 -0.096 0.21340E+04 158 siderite -2.61 -6.30 -3.69 -1.231 0.63055E+04 166 stilbite -7.52 -8.14 -0.61 -0.029 0.10494E+04 177 tephroite 18.09 14.77 -3.32 -0.474 0.56622E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.75 -2.34 -0.779 0.39894E+04 190 wairakite 3.95 0.83 -3.12 -0.183 0.53253E+04 191 walstromite 11.51 7.77 -3.74 -0.747 0.63775E+04 192 wollastonite 10.46 7.77 -2.69 -0.537 0.45879E+04 193 pseudo-wollastonite 11.00 7.77 -3.23 -0.645 0.55078E+04 195 akaganeite 7.75 3.94 -3.82 -0.826 0.65196E+04 200 beidellite-Na -1.34 -6.11 -4.77 -0.292 0.81452E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.92 -4.61 -0.576 0.78658E+04 204 montmorillonite-Ca -2.29 -5.93 -3.64 -0.225 0.62128E+04 205 montmorillonite-K -2.24 -5.91 -3.68 -0.225 0.62778E+04 206 montmorillonite-Mg -2.48 -6.42 -3.94 -0.244 0.67359E+04 207 montmorillonite-Na -2.04 -5.21 -3.17 -0.194 0.54108E+04 208 nontronite-Ca 3.21 -0.99 -4.20 -0.273 0.71763E+04 210 nontronite-K 3.34 -0.97 -4.31 -0.277 0.73645E+04 211 nontronite-Mg 3.07 -1.48 -4.56 -0.296 0.77835E+04 212 nontronite-Na 3.52 -0.27 -3.79 -0.243 0.64635E+04 228 tobermorite 9.82 5.98 -3.85 -1.049 0.65676E+04 234 alabandite -0.98 -3.08 -2.10 -0.699 0.35827E+04 237 boehmite 4.41 1.01 -3.39 -0.566 0.57942E+04 239 ferrous-oxide 9.81 5.21 -4.60 -1.151 0.78600E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.06 -0.96 -0.074 0.16439E+04 248 an25ab75 2.65 1.41 -1.23 -0.095 0.21018E+04 249 an30ab70 3.28 1.77 -1.50 -0.116 0.25694E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1279900 MOLES New total amount of reactant added: 0.1319900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1319900 Water: Moles liquid = 0.4997E+02 kg liquid = 0.9003E+00 Moles total = 0.4995E+02 kg total = 0.8999E+00 Activity = 1.0000 Stoichiometric ionic strength = .1987633E-01 Osmotic coef. = 0.9195 True ionic strength = .2487072E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9166E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.63046E-09 -9.2003 0.52250E-09 -9.2819 0.82876E+00 -0.0816 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.10132E-02 -2.9943 0.83374E-03 -3.0790 0.82287E+00 -0.0847 4 SO4-- 0.68267E-03 -3.1658 0.33439E-03 -3.4757 0.48983E+00 -0.3100 5 HCO3- 0.82732E-02 -2.0823 0.68195E-02 -2.1662 0.82429E+00 -0.0839 6 HS- 0.29035E-02 -2.5371 0.23896E-02 -2.6217 0.82301E+00 -0.0846 7 Al+++ 0.79379E-26 -26.1003 0.16036E-26 -26.7949 0.20202E+00 -0.6946 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.28183E-07 -7.5500 0.13685E-07 -7.8638 0.48556E+00 -0.3138 10 Mg++ 0.28090E-10 -10.5515 0.13565E-10 -10.8676 0.48293E+00 -0.3161 11 Fe++ 0.70139E-13 -13.1540 0.33917E-13 -13.4696 0.48356E+00 -0.3155 12 K+ 0.15595E-03 -3.8070 0.12859E-03 -3.8908 0.82452E+00 -0.0838 13 Na+ 0.21699E-01 -1.6636 0.17851E-01 -1.7483 0.82268E+00 -0.0848 14 Mn++ 0.39613E-09 -9.4022 0.19174E-09 -9.7173 0.48403E+00 -0.3151 15 F- 0.58554E-04 -4.2324 0.48065E-04 -4.3182 0.82087E+00 -0.0857 16 HPO4-- 0.45879E-07 -7.3384 0.22477E-07 -7.6483 0.48991E+00 -0.3099 18 HSiO3- 0.22252E-02 -2.6526 0.18311E-02 -2.7373 0.82287E+00 -0.0847 19 Ca(HSiO3)+ 0.69193E-09 -9.1599 0.57066E-09 -9.2436 0.82473E+00 -0.0837 20 Mg(HSiO3)+ 0.85362E-12 -12.0687 0.70400E-12 -12.1524 0.82473E+00 -0.0837 21 NaHSiO3,aq 0.52866E-03 -3.2768 0.52866E-03 -3.2768 0.10000E+01 0.0000 22 AlO+ 0.96896E-15 -15.0137 0.79913E-15 -15.0974 0.82473E+00 -0.0837 24 HAlO2,aq 0.30458E-09 -9.5163 0.30458E-09 -9.5163 0.10000E+01 0.0000 25 AlO2- 0.15715E-05 -5.8037 0.12904E-05 -5.8893 0.82112E+00 -0.0856 26 CH4,aq 0.47623E-07 -7.3222 0.47338E-07 -7.3248 0.99402E+00 -0.0026 27 C2H6,aq 0.29576E-17 -17.5291 0.29399E-17 -17.5317 0.99402E+00 -0.0026 31 CO,aq 0.24924E-13 -13.6034 0.24924E-13 -13.6034 0.10000E+01 0.0000 32 CO2,aq 0.76595E-05 -5.1158 0.76137E-05 -5.1184 0.99402E+00 -0.0026 33 CO3-2 0.23332E-02 -2.6320 0.11400E-02 -2.9431 0.48860E+00 -0.3110 34 CaCO3,aq 0.19562E-06 -6.7086 0.19562E-06 -6.7086 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.28884E-08 -8.5393 0.23822E-08 -8.6230 0.82473E+00 -0.0837 36 CaCl+ 0.22388E-10 -10.6500 0.18464E-10 -10.7337 0.82473E+00 -0.0837 37 CaCl2,aq 0.36574E-14 -14.4368 0.36574E-14 -14.4368 0.10000E+01 0.0000 38 CaF+ 0.11644E-10 -10.9339 0.96032E-11 -11.0176 0.82473E+00 -0.0837 39 CaOH+ 0.22633E-08 -8.6453 0.18666E-08 -8.7289 0.82473E+00 -0.0837 40 CaSO4,aq 0.14531E-08 -8.8377 0.14531E-08 -8.8377 0.10000E+01 0.0000 41 HCl,aq 0.79827E-13 -13.0979 0.79827E-13 -13.0979 0.10000E+01 0.0000 45 HF,aq 0.17192E-09 -9.7647 0.17192E-09 -9.7647 0.10000E+01 0.0000 46 HF2- 0.33905E-14 -14.4697 0.27899E-14 -14.5544 0.82287E+00 -0.0847 48 FeCl+ 0.54271E-16 -16.2654 0.44759E-16 -16.3491 0.82473E+00 -0.0837 51 FeF+ 0.10101E-15 -15.9956 0.83306E-16 -16.0793 0.82473E+00 -0.0837 53 FeO,aq 0.48285E-11 -11.3162 0.48285E-11 -11.3162 0.10000E+01 0.0000 54 FeOH+ 0.25620E-11 -11.5914 0.21130E-11 -11.6751 0.82473E+00 -0.0837 55 HFeO2- 0.11751E-09 -9.9299 0.96691E-10 -10.0146 0.82287E+00 -0.0847 56 FeO+ 0.16928E-16 -16.7714 0.13961E-16 -16.8551 0.82473E+00 -0.0837 58 FeO2- 0.12717E-10 -10.8956 0.10464E-10 -10.9803 0.82287E+00 -0.0847 59 HFeO2,aq 0.69539E-12 -12.1578 0.69539E-12 -12.1578 0.10000E+01 0.0000 60 H2,aq 0.13109E-06 -6.8824 0.13031E-06 -6.8850 0.99402E+00 -0.0026 61 KCl,aq 0.19431E-08 -8.7115 0.19431E-08 -8.7115 0.10000E+01 0.0000 62 KHSO4,aq 0.63522E-16 -16.1971 0.63522E-16 -16.1971 0.10000E+01 0.0000 63 KOH,aq 0.10510E-06 -6.9784 0.10510E-06 -6.9784 0.10000E+01 0.0000 64 KSO4- 0.81087E-06 -6.0911 0.66724E-06 -6.1757 0.82287E+00 -0.0847 65 MgCO3,aq 0.48605E-10 -10.3133 0.48605E-10 -10.3133 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.29257E-11 -11.5338 0.24129E-11 -11.6175 0.82473E+00 -0.0837 67 MgCl+ 0.20114E-13 -13.6965 0.16589E-13 -13.7802 0.82473E+00 -0.0837 68 MgF+ 0.42758E-13 -13.3690 0.35263E-13 -13.4527 0.82473E+00 -0.0837 69 MgOH+ 0.12415E-10 -10.9061 0.10239E-10 -10.9897 0.82473E+00 -0.0837 71 MnF+ 0.18822E-12 -12.7253 0.15523E-12 -12.8090 0.82473E+00 -0.0837 72 MnO,aq 0.72735E-09 -9.1383 0.72735E-09 -9.1383 0.10000E+01 0.0000 73 MnOH+ 0.13455E-08 -8.8711 0.11097E-08 -8.9548 0.82473E+00 -0.0837 74 MnO2-2 0.18096E-12 -12.7424 0.88419E-13 -13.0535 0.48860E+00 -0.3110 75 HMnO2- 0.12300E-10 -10.9101 0.10121E-10 -10.9948 0.82287E+00 -0.0847 78 MnCl+ 0.11936E-11 -11.9231 0.98443E-12 -12.0068 0.82473E+00 -0.0837 79 MnSO4,aq 0.18510E-10 -10.7326 0.18510E-10 -10.7326 0.10000E+01 0.0000 80 NaCl,aq 0.49323E-05 -5.3069 0.49323E-05 -5.3069 0.10000E+01 0.0000 81 NaF,aq 0.20088E-06 -6.6971 0.20088E-06 -6.6971 0.10000E+01 0.0000 82 NaOH,aq 0.14679E-04 -4.8333 0.14679E-04 -4.8333 0.10000E+01 0.0000 84 OH- 0.13467E-02 -2.8707 0.11058E-02 -2.9563 0.82112E+00 -0.0856 89 HPO3-2 0.18681E-16 -16.7286 0.91275E-17 -17.0396 0.48860E+00 -0.3110 91 H2PO3- 0.11622E-19 -19.9347 0.95635E-20 -20.0194 0.82287E+00 -0.0847 92 H3PO4,aq 0.42916E-16 -16.3674 0.42916E-16 -16.3674 0.10000E+01 0.0000 93 H2PO4- 0.26298E-09 -9.5801 0.21664E-09 -9.6643 0.82379E+00 -0.0842 94 PO4-3 0.16393E-09 -9.7853 0.35098E-10 -10.4547 0.21410E+00 -0.6694 98 HP2O7-3 0.69526E-17 -17.1579 0.14064E-17 -17.8519 0.20228E+00 -0.6940 99 P2O7-4 0.10530E-16 -16.9776 0.64303E-18 -18.1918 0.61069E-01 -1.2142 100 H2S,aq 0.38820E-05 -5.4109 0.38588E-05 -5.4135 0.99402E+00 -0.0026 101 S2-2 0.19872E-08 -8.7018 0.97096E-09 -9.0128 0.48860E+00 -0.3110 102 S3-2 0.79282E-13 -13.1008 0.38737E-13 -13.4119 0.48860E+00 -0.3110 103 S3- 0.45675E-16 -16.3403 0.37584E-16 -16.4250 0.82287E+00 -0.0847 104 S4-2 0.20894E-17 -17.6800 0.10209E-17 -17.9910 0.48860E+00 -0.3110 106 SO2,aq 0.53128E-19 -19.2747 0.53128E-19 -19.2747 0.10000E+01 0.0000 107 SO3-2 0.11394E-10 -10.9433 0.56625E-11 -11.2470 0.49696E+00 -0.3037 108 HSO3- 0.22513E-12 -12.6476 0.18525E-12 -12.7322 0.82287E+00 -0.0847 109 HSO4- 0.20393E-09 -9.6905 0.16838E-09 -9.7737 0.82569E+00 -0.0832 111 S2O3-2 0.31023E-10 -10.5083 0.15158E-10 -10.8194 0.48860E+00 -0.3110 112 HS2O3- 0.17209E-17 -17.7642 0.14161E-17 -17.8489 0.82287E+00 -0.0847 Charge balance for all species = -.6118E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6304583E-09 -.6443611E-02 -.6483792E+01 0.0000 2 H2O 0.1000000E+01 0.5550685E+02 0.9982819E+06 0.0000 3 Cl- 0.1013216E-02 0.1018150E-02 0.3603546E+02 6.2029 4 SO4-- 0.6826724E-03 0.6834051E-03 0.6553799E+02 15.0881 5 HCO3- 0.8273211E-02 0.1061436E-01 0.6465636E+03 7.1157 6 HS- 0.2903490E-02 0.2907456E-02 0.9599280E+02 6.6602 7 Al+++ 0.7937939E-26 0.1571810E-05 0.4233807E-01 1.0509 8 H4SiO4 0.1024625E-02 0.3778533E-02 0.3625612E+03 -2.9894 9 Ca++ 0.2818305E-07 0.2311308E-06 0.9247598E-02 10.7001 10 Mg++ 0.2808953E-10 0.9295203E-10 0.2256029E-05 7.6963 11 Fe++ 0.7013949E-13 0.1383781E-09 0.7714937E-05 5.0942 12 K+ 0.1559540E-03 0.1568720E-03 0.6123636E+01 5.3911 13 Na+ 0.2169870E-01 0.2224718E-01 0.5105934E+03 7.5336 14 Mn++ 0.3961332E-09 0.2501363E-08 0.1371876E-03 8.8465 15 F- 0.5855369E-04 0.5875475E-04 0.1114336E+01 4.9637 16 HPO4-- 0.4587866E-07 0.4630557E-07 0.4436848E-02 10.9156 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.5814517E-02 -.5801084E-02 -.1343299E-04 0.0000000E+00 2 H2O 0.4995447E+02 0.4997196E+02 -.1749584E-01 0.0000000E+00 3 Cl- 0.9166252E-03 0.9166252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6152672E-03 0.6152591E-03 0.8116923E-08 0.0000000E+00 5 HCO3- 0.9555947E-02 0.9555947E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2617594E-02 0.2617537E-02 0.5681846E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1415076E-05 0.3360276E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.3401755E-02 0.8751265E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1245797E-09 0.3246769E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002879E-01 0.3360276E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.5289600E-04 0.5289600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1271E-20 Mass of aqueous solution: 0.901809E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1319900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3360E-05 -5.474 0.8811E-03 -3.055 0.1675 0.3382E-03 pyrite 0.3247E-07 -7.489 0.3895E-05 -5.409 0.7405E-03 0.7772E-06 quartz 0.8741E-02 -2.058 0.5252 -0.280 99.83 0.1983 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.526055 g Volume = 0.198666 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1319900 moles log = -0.8795 Original solution: 1000.0103000 g Original solution / Rock added: 7576.41 (Water/Rock Ratio), log = 3.8795 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0215 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9989E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.7919E-03 1.0071 0.8146E-03 0.8089E-03 CH4,gas 0.6737E-04 1.0125 0.6968E-04 0.6882E-04 H2,gas 0.1674E-03 1.0005 0.1711E-03 0.1710E-03 H2S,gas 0.1043E-03 0.9960 0.1061E-03 0.1065E-03 S2,gas 0.1413E-19 1.0000 0.1443E-19 0.1443E-19 CO,gas 0.3636E-10 1.0000 0.3714E-10 0.3714E-10 SO3,gas 0.3379E-37 1.0000 0.3452E-37 0.3452E-37 SO2,gas 0.2249E-18 1.0000 0.2297E-18 0.2297E-18 HF,gas 0.4133E-12 1.0000 0.4221E-12 0.4221E-12 HCl,gas 0.1379E-15 1.0000 0.1409E-15 0.1409E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.13080E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.45 -4.79 -1.596 0.81754E+04 -3.089 3 CH4,gas 4.54 -1.31 -5.86 -1.464 0.99987E+04 -4.157 4 H2,gas 8.00 2.53 -5.47 -3.123 0.93326E+04 -3.767 5 H2S,gas -6.23 -11.90 -5.67 -2.837 0.96871E+04 -3.974 6 S2,gas -7.34 -28.88 -21.54 -3.314 0.36778E+05 -19.841 7 CO,gas 3.21 -8.91 -12.13 -3.732 0.20710E+05 -10.430 8 SO3,gas 17.12 -22.04 -39.16 -9.790 0.66866E+05 -37.462 9 SO2,gas 0.83 -19.51 -20.34 -5.423 0.34726E+05 -18.639 10 HF,gas 0.47 -13.60 -14.07 -7.037 0.24030E+05 -12.375 11 HCl,gas 5.19 -12.36 -17.55 -8.775 0.29966E+05 -15.851 12 acmite 7.71 5.38 -2.33 -0.242 0.39746E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.67 -4.78 -0.239 0.81690E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 26 ankerite -2.14 -7.10 -4.97 -0.828 0.84809E+04 34 apatite-F -34.30 -38.74 -4.44 -0.370 0.75728E+04 38 aragonite 0.97 -0.75 -1.71 -0.572 0.29277E+04 39 brucite 12.57 7.70 -4.87 -0.974 0.83193E+04 40 calcite 0.81 -0.75 -1.56 -0.520 0.26634E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.82 -4.76 -0.318 0.81327E+04 45 celadonite 5.34 2.18 -3.16 -0.186 0.53975E+04 46 celadonite-Fe 3.88 -0.42 -4.30 -0.253 0.73388E+04 54 chloritoid-Fe 9.17 4.21 -4.97 -0.331 0.84812E+04 55 chloritoid-Mn 11.40 7.96 -3.44 -0.229 0.58775E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.21 -0.351 0.71914E+04 68 diaspore 2.87 1.05 -1.82 -0.304 0.31125E+04 69 diamond -3.10 -6.38 -3.28 -0.937 0.55967E+04 70 diopside 16.18 12.42 -3.76 -0.376 0.64268E+04 71 hedenbergite 14.21 9.82 -4.39 -0.439 0.75007E+04 86 gibbsite 4.08 1.05 -3.03 -0.433 0.51710E+04 89 graphite -3.55 -6.38 -2.83 -0.810 0.48390E+04 93 hematite 12.57 7.65 -4.91 -0.595 0.83866E+04 94 heulandite -5.83 -8.12 -2.30 -0.104 0.39221E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.13 -0.590 0.70542E+04 101 kaolinite -1.33 -3.88 -2.54 -0.231 0.43445E+04 104 laumontite 2.88 0.84 -2.04 -0.136 0.34822E+04 105 lawsonite 9.62 6.82 -2.79 -0.186 0.47693E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62421E+04 109 magnesite 0.69 -3.75 -4.44 -1.481 0.75854E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.68027E+02 123 muscovite 2.58 -0.42 -3.01 -0.177 0.51345E+04 124 paragonite 4.24 1.72 -2.52 -0.148 0.43055E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.53 -4.84 -0.285 0.82613E+04 146 pyrrhotite -4.26 -6.81 -2.55 -0.850 0.43524E+04 147 pyrrhotiteFe0.875 -6.02 -7.76 -1.74 -0.641 0.29768E+04 148 pyroxmangite 7.40 5.86 -1.54 -0.308 0.26322E+04 149 pyrophyllite -6.18 -9.86 -3.68 -0.230 0.62839E+04 154 rhodochrosite -0.98 -2.60 -1.63 -0.542 0.27751E+04 155 rhodonite 7.45 5.86 -1.59 -0.318 0.27124E+04 156 sanidine -1.28 -2.53 -1.25 -0.096 0.21358E+04 158 siderite -2.61 -6.35 -3.75 -1.249 0.63958E+04 166 stilbite -7.52 -8.12 -0.60 -0.029 0.10283E+04 177 tephroite 18.09 14.70 -3.38 -0.483 0.57749E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.81 -2.40 -0.799 0.40952E+04 190 wairakite 3.95 0.84 -3.11 -0.183 0.53041E+04 191 walstromite 11.51 7.71 -3.80 -0.760 0.64860E+04 192 wollastonite 10.46 7.71 -2.75 -0.550 0.46964E+04 193 pseudo-wollastonite 11.00 7.71 -3.29 -0.658 0.56163E+04 195 akaganeite 7.75 3.83 -3.93 -0.849 0.67058E+04 200 beidellite-Na -1.34 -6.04 -4.69 -0.287 0.80156E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.86 -4.55 -0.568 0.77614E+04 204 montmorillonite-Ca -2.29 -5.90 -3.61 -0.223 0.61585E+04 205 montmorillonite-K -2.24 -5.88 -3.65 -0.223 0.62276E+04 206 montmorillonite-Mg -2.48 -6.39 -3.91 -0.242 0.66818E+04 207 montmorillonite-Na -2.04 -5.18 -3.14 -0.192 0.53600E+04 208 nontronite-Ca 3.21 -1.20 -4.42 -0.287 0.75453E+04 210 nontronite-K 3.34 -1.19 -4.53 -0.291 0.77376E+04 211 nontronite-Mg 3.07 -1.70 -4.77 -0.310 0.81526E+04 212 nontronite-Na 3.52 -0.48 -4.00 -0.257 0.68360E+04 228 tobermorite 9.82 5.92 -3.90 -1.064 0.66580E+04 234 alabandite -0.98 -3.06 -2.08 -0.693 0.35501E+04 237 boehmite 4.41 1.05 -3.36 -0.559 0.57294E+04 239 ferrous-oxide 9.81 5.09 -4.72 -1.179 0.80547E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.06 -0.96 -0.074 0.16397E+04 248 an25ab75 2.65 1.42 -1.23 -0.094 0.20966E+04 249 an30ab70 3.28 1.78 -1.50 -0.115 0.25631E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1319900 MOLES New total amount of reactant added: 0.1359900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1359900 Water: Moles liquid = 0.4998E+02 kg liquid = 0.9003E+00 Moles total = 0.4996E+02 kg total = 0.9000E+00 Activity = 1.0000 Stoichiometric ionic strength = .2013524E-01 Osmotic coef. = 0.9190 True ionic strength = .2483424E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9402E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.69338E-09 -9.1590 0.57470E-09 -9.2406 0.82884E+00 -0.0815 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.10392E-02 -2.9833 0.85522E-03 -3.0679 0.82295E+00 -0.0846 4 SO4-- 0.70381E-03 -3.1525 0.34489E-03 -3.4623 0.49003E+00 -0.3098 5 HCO3- 0.86965E-02 -2.0607 0.71692E-02 -2.1445 0.82437E+00 -0.0839 6 HS- 0.29895E-02 -2.5244 0.24606E-02 -2.6090 0.82309E+00 -0.0846 7 Al+++ 0.11581E-25 -25.9362 0.23419E-26 -26.6304 0.20221E+00 -0.6942 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.29276E-07 -7.5335 0.14221E-07 -7.8471 0.48576E+00 -0.3136 10 Mg++ 0.29082E-10 -10.5364 0.14051E-10 -10.8523 0.48314E+00 -0.3159 11 Fe++ 0.64539E-13 -13.1902 0.31221E-13 -13.5055 0.48376E+00 -0.3154 12 K+ 0.15593E-03 -3.8071 0.12858E-03 -3.8908 0.82460E+00 -0.0838 13 Na+ 0.21745E-01 -1.6626 0.17891E-01 -1.7474 0.82277E+00 -0.0847 14 Mn++ 0.44013E-09 -9.3564 0.21313E-09 -9.6714 0.48424E+00 -0.3149 15 F- 0.60320E-04 -4.2195 0.49520E-04 -4.3052 0.82096E+00 -0.0857 16 HPO4-- 0.45864E-07 -7.3385 0.22478E-07 -7.6482 0.49011E+00 -0.3097 18 HSiO3- 0.20229E-02 -2.6940 0.16648E-02 -2.7786 0.82295E+00 -0.0846 19 Ca(HSiO3)+ 0.65368E-09 -9.1846 0.53916E-09 -9.2683 0.82481E+00 -0.0836 20 Mg(HSiO3)+ 0.80376E-12 -12.0949 0.66295E-12 -12.1785 0.82481E+00 -0.0836 21 NaHSiO3,aq 0.48172E-03 -3.3172 0.48172E-03 -3.3172 0.10000E+01 0.0000 22 AlO+ 0.11695E-14 -14.9320 0.96462E-15 -15.0156 0.82481E+00 -0.0836 24 HAlO2,aq 0.33426E-09 -9.4759 0.33426E-09 -9.4759 0.10000E+01 0.0000 25 AlO2- 0.15678E-05 -5.8047 0.12875E-05 -5.8903 0.82120E+00 -0.0856 26 CH4,aq 0.49988E-07 -7.3011 0.49685E-07 -7.3038 0.99394E+00 -0.0026 27 C2H6,aq 0.33382E-17 -17.4765 0.33180E-17 -17.4791 0.99394E+00 -0.0026 31 CO,aq 0.28130E-13 -13.5508 0.28130E-13 -13.5508 0.10000E+01 0.0000 32 CO2,aq 0.88574E-05 -5.0527 0.88038E-05 -5.0553 0.99394E+00 -0.0026 33 CO3-2 0.22292E-02 -2.6519 0.10896E-02 -2.9627 0.48880E+00 -0.3109 34 CaCO3,aq 0.19430E-06 -6.7115 0.19430E-06 -6.7115 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31553E-08 -8.5010 0.26025E-08 -8.5846 0.82481E+00 -0.0836 36 CaCl+ 0.23863E-10 -10.6223 0.19682E-10 -10.7059 0.82481E+00 -0.0836 37 CaCl2,aq 0.39991E-14 -14.3980 0.39991E-14 -14.3980 0.10000E+01 0.0000 38 CaF+ 0.12466E-10 -10.9043 0.10282E-10 -10.9879 0.82481E+00 -0.0836 39 CaOH+ 0.21382E-08 -8.6700 0.17636E-08 -8.7536 0.82481E+00 -0.0836 40 CaSO4,aq 0.15575E-08 -8.8076 0.15575E-08 -8.8076 0.10000E+01 0.0000 41 HCl,aq 0.90065E-13 -13.0454 0.90065E-13 -13.0454 0.10000E+01 0.0000 45 HF,aq 0.19482E-09 -9.7104 0.19482E-09 -9.7104 0.10000E+01 0.0000 46 HF2- 0.39580E-14 -14.4025 0.32573E-14 -14.4871 0.82295E+00 -0.0846 48 FeCl+ 0.51240E-16 -16.2904 0.42264E-16 -16.3740 0.82481E+00 -0.0836 51 FeF+ 0.95789E-16 -16.0187 0.79007E-16 -16.1023 0.82481E+00 -0.0836 53 FeO,aq 0.36740E-11 -11.4349 0.36740E-11 -11.4349 0.10000E+01 0.0000 54 FeOH+ 0.21440E-11 -11.6688 0.17684E-11 -11.7524 0.82481E+00 -0.0836 55 HFeO2- 0.81280E-10 -10.0900 0.66889E-10 -10.1746 0.82295E+00 -0.0846 56 FeO+ 0.14339E-16 -16.8435 0.11827E-16 -16.9271 0.82481E+00 -0.0836 58 FeO2- 0.89036E-11 -11.0504 0.73272E-11 -11.1351 0.82295E+00 -0.0846 59 HFeO2,aq 0.53557E-12 -12.2712 0.53557E-12 -12.2712 0.10000E+01 0.0000 60 H2,aq 0.12797E-06 -6.8929 0.12719E-06 -6.8955 0.99394E+00 -0.0026 61 KCl,aq 0.19930E-08 -8.7005 0.19930E-08 -8.7005 0.10000E+01 0.0000 62 KHSO4,aq 0.72056E-16 -16.1423 0.72056E-16 -16.1423 0.10000E+01 0.0000 63 KOH,aq 0.95545E-07 -7.0198 0.95545E-07 -7.0198 0.10000E+01 0.0000 64 KSO4- 0.83617E-06 -6.0777 0.68813E-06 -6.1623 0.82295E+00 -0.0846 65 MgCO3,aq 0.48118E-10 -10.3177 0.48118E-10 -10.3177 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31854E-11 -11.4968 0.26274E-11 -11.5805 0.82481E+00 -0.0836 67 MgCl+ 0.21368E-13 -13.6702 0.17625E-13 -13.7539 0.82481E+00 -0.0836 68 MgF+ 0.45623E-13 -13.3408 0.37630E-13 -13.4245 0.82481E+00 -0.0836 69 MgOH+ 0.11690E-10 -10.9322 0.96417E-11 -11.0158 0.82481E+00 -0.0836 71 MnF+ 0.21553E-12 -12.6665 0.17777E-12 -12.7501 0.82481E+00 -0.0836 72 MnO,aq 0.66826E-09 -9.1751 0.66826E-09 -9.1751 0.10000E+01 0.0000 73 MnOH+ 0.13596E-08 -8.8666 0.11214E-08 -8.9502 0.82481E+00 -0.0836 74 MnO2-2 0.13737E-12 -12.8621 0.67149E-13 -13.1730 0.48880E+00 -0.3109 75 HMnO2- 0.10273E-10 -10.9883 0.84545E-11 -11.0729 0.82295E+00 -0.0846 78 MnCl+ 0.13608E-11 -11.8662 0.11224E-11 -11.9498 0.82481E+00 -0.0836 79 MnSO4,aq 0.21220E-10 -10.6732 0.21220E-10 -10.6732 0.10000E+01 0.0000 80 NaCl,aq 0.50708E-05 -5.2949 0.50708E-05 -5.2949 0.10000E+01 0.0000 81 NaF,aq 0.20742E-06 -6.6831 0.20742E-06 -6.6831 0.10000E+01 0.0000 82 NaOH,aq 0.13376E-04 -4.8737 0.13376E-04 -4.8737 0.10000E+01 0.0000 84 OH- 0.12242E-02 -2.9121 0.10053E-02 -2.9977 0.82120E+00 -0.0856 89 HPO3-2 0.18228E-16 -16.7393 0.89100E-17 -17.0501 0.48880E+00 -0.3109 91 H2PO3- 0.12477E-19 -19.9039 0.10268E-19 -19.9885 0.82295E+00 -0.0846 92 H3PO4,aq 0.51924E-16 -16.2846 0.51924E-16 -16.2846 0.10000E+01 0.0000 93 H2PO4- 0.28925E-09 -9.5387 0.23831E-09 -9.6229 0.82387E+00 -0.0841 94 PO4-3 0.14892E-09 -9.8270 0.31912E-10 -10.4960 0.21429E+00 -0.6690 98 HP2O7-3 0.76415E-17 -17.1168 0.15472E-17 -17.8105 0.20247E+00 -0.6936 99 P2O7-4 0.10514E-16 -16.9782 0.64314E-18 -18.1917 0.61168E-01 -1.2135 100 H2S,aq 0.43972E-05 -5.3568 0.43705E-05 -5.3595 0.99394E+00 -0.0026 101 S2-2 0.21579E-08 -8.6660 0.10548E-08 -8.9768 0.48880E+00 -0.3109 102 S3-2 0.99897E-13 -13.0004 0.48830E-13 -13.3113 0.48880E+00 -0.3109 103 S3- 0.64092E-16 -16.1932 0.52744E-16 -16.2778 0.82295E+00 -0.0846 104 S4-2 0.30549E-17 -17.5150 0.14932E-17 -17.8259 0.48880E+00 -0.3109 106 SO2,aq 0.64706E-19 -19.1891 0.64706E-19 -19.1891 0.10000E+01 0.0000 107 SO3-2 0.11466E-10 -10.9406 0.57006E-11 -11.2441 0.49716E+00 -0.3035 108 HSO3- 0.24926E-12 -12.6034 0.20513E-12 -12.6880 0.82295E+00 -0.0846 109 HSO4- 0.23132E-09 -9.6358 0.19102E-09 -9.7189 0.82577E+00 -0.0831 111 S2O3-2 0.36225E-10 -10.4410 0.17707E-10 -10.7519 0.48880E+00 -0.3109 112 HS2O3- 0.22109E-17 -17.6554 0.18195E-17 -17.7401 0.82295E+00 -0.0846 Charge balance for all species = -.6117E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6933811E-09 -.5964762E-02 -.6001932E+01 0.0000 2 H2O 0.1000000E+01 0.5550698E+02 0.9982800E+06 0.0000 3 Cl- 0.1039216E-02 0.1044289E-02 0.3696043E+02 6.1726 4 SO4-- 0.7038131E-03 0.7045697E-03 0.6756738E+02 15.0188 5 HCO3- 0.8696535E-02 0.1093480E-01 0.6660803E+03 7.0960 6 HS- 0.2989507E-02 0.2993990E-02 0.9884940E+02 6.6316 7 Al+++ 0.1158118E-25 0.1568156E-05 0.4223950E-01 1.0912 8 H4SiO4 0.1024625E-02 0.3529261E-02 0.3386414E+03 -2.9894 9 Ca++ 0.2927579E-07 0.2311141E-06 0.9246892E-02 10.6341 10 Mg++ 0.2908182E-10 0.9294531E-10 0.2255857E-05 7.6288 11 Fe++ 0.6453860E-13 0.9660170E-10 0.5385771E-05 4.9756 12 K+ 0.1559269E-03 0.1568606E-03 0.6123168E+01 5.3497 13 Na+ 0.2174519E-01 0.2224556E-01 0.5105543E+03 7.4932 14 Mn++ 0.4401267E-09 0.2501183E-08 0.1371771E-03 8.8098 15 F- 0.6031997E-04 0.6052760E-04 0.1147954E+01 4.9353 16 HPO4-- 0.4586405E-07 0.4630222E-07 0.4436509E-02 10.8329 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.5383817E-02 -.5370371E-02 -.1344573E-04 0.0000000E+00 2 H2O 0.4995774E+02 0.4997569E+02 -.1794421E-01 0.0000000E+00 3 Cl- 0.9402252E-03 0.9402252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6343672E-03 0.6343591E-03 0.8126324E-08 0.0000000E+00 5 HCO3- 0.9845147E-02 0.9845147E-02 0.0000000E+00 0.0000000E+00 6 HS- 0.2695694E-02 0.2695637E-02 0.5688427E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1411889E-05 0.3363463E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.3177568E-02 0.8975452E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.8697530E-10 0.3250529E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002879E-01 0.3363463E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.5449600E-04 0.5449600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.901878E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1359900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3363E-05 -5.473 0.8820E-03 -3.055 0.1635 0.3386E-03 pyrite 0.3251E-07 -7.488 0.3900E-05 -5.409 0.7229E-03 0.7781E-06 quartz 0.8965E-02 -2.047 0.5386 -0.269 99.84 0.2034 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.539525 g Volume = 0.203753 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1359900 moles log = -0.8665 Original solution: 1000.0103000 g Original solution / Rock added: 7353.56 (Water/Rock Ratio), log = 3.8665 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0216 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9987E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.9155E-03 1.0071 0.9419E-03 0.9353E-03 CH4,gas 0.7070E-04 1.0125 0.7313E-04 0.7223E-04 H2,gas 0.1634E-03 1.0005 0.1670E-03 0.1669E-03 H2S,gas 0.1181E-03 0.9960 0.1201E-03 0.1206E-03 S2,gas 0.1902E-19 1.0000 0.1943E-19 0.1943E-19 CO,gas 0.4103E-10 1.0000 0.4192E-10 0.4192E-10 SO3,gas 0.4216E-37 1.0000 0.4307E-37 0.4307E-37 SO2,gas 0.2739E-18 1.0000 0.2798E-18 0.2798E-18 HF,gas 0.4682E-12 1.0000 0.4784E-12 0.4784E-12 HCl,gas 0.1556E-15 1.0000 0.1589E-15 0.1589E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.39 -4.72 -1.575 0.80677E+04 -3.026 3 CH4,gas 4.54 -1.29 -5.83 -1.459 0.99629E+04 -4.136 4 H2,gas 8.00 2.52 -5.48 -3.129 0.93506E+04 -3.777 5 H2S,gas -6.23 -11.85 -5.62 -2.810 0.95948E+04 -3.920 6 S2,gas -7.34 -28.75 -21.41 -3.294 0.36558E+05 -19.712 7 CO,gas 3.21 -8.86 -12.08 -3.716 0.20620E+05 -10.378 8 SO3,gas 17.12 -21.94 -39.06 -9.766 0.66702E+05 -37.366 9 SO2,gas 0.83 -19.42 -20.25 -5.401 0.34580E+05 -18.553 10 HF,gas 0.47 -13.55 -14.02 -7.010 0.23937E+05 -12.320 11 HCl,gas 5.19 -12.31 -17.50 -8.749 0.29877E+05 -15.799 12 acmite 7.71 5.23 -2.48 -0.258 0.42372E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.64 -4.81 -0.241 0.82196E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.76 -4.46 -0.372 0.76197E+04 38 aragonite 0.97 -0.75 -1.72 -0.573 0.29327E+04 39 brucite 12.57 7.63 -4.94 -0.988 0.84345E+04 40 calcite 0.81 -0.75 -1.56 -0.521 0.26685E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.83 -4.75 -0.317 0.81099E+04 45 celadonite 5.34 2.11 -3.23 -0.190 0.55144E+04 46 celadonite-Fe 3.88 -0.54 -4.42 -0.260 0.75431E+04 55 chloritoid-Mn 11.40 8.00 -3.40 -0.227 0.58025E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.21 -0.351 0.71931E+04 68 diaspore 2.87 1.09 -1.78 -0.297 0.30435E+04 69 diamond -3.10 -6.34 -3.24 -0.924 0.55249E+04 70 diopside 16.18 12.28 -3.90 -0.390 0.66546E+04 71 hedenbergite 14.21 9.63 -4.58 -0.458 0.78160E+04 86 gibbsite 4.08 1.09 -2.99 -0.427 0.51020E+04 89 graphite -3.55 -6.34 -2.79 -0.798 0.47672E+04 94 heulandite -5.83 -8.11 -2.28 -0.104 0.38969E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.13 -0.590 0.70559E+04 101 kaolinite -1.33 -3.80 -2.46 -0.224 0.42066E+04 104 laumontite 2.88 0.86 -2.02 -0.135 0.34570E+04 105 lawsonite 9.62 6.84 -2.78 -0.185 0.47441E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62438E+04 109 magnesite 0.69 -3.76 -4.45 -1.482 0.75929E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.69745E+02 123 muscovite 2.58 -0.34 -2.93 -0.172 0.49983E+04 124 paragonite 4.24 1.80 -2.44 -0.144 0.41676E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.48 -4.89 -0.288 0.83489E+04 146 pyrrhotite -4.26 -6.87 -2.61 -0.871 0.44627E+04 147 pyrrhotiteFe0.875 -6.02 -7.81 -1.79 -0.659 0.30595E+04 148 pyroxmangite 7.40 5.82 -1.58 -0.316 0.26950E+04 149 pyrophyllite -6.18 -9.78 -3.60 -0.225 0.61460E+04 154 rhodochrosite -0.98 -2.58 -1.60 -0.533 0.27303E+04 155 rhodonite 7.45 5.82 -1.63 -0.325 0.27753E+04 156 sanidine -1.28 -2.53 -1.25 -0.096 0.21375E+04 158 siderite -2.61 -6.41 -3.80 -1.267 0.64907E+04 166 stilbite -7.52 -8.11 -0.59 -0.028 0.10031E+04 177 tephroite 18.09 14.63 -3.46 -0.494 0.59005E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.87 -2.46 -0.821 0.42055E+04 190 wairakite 3.95 0.86 -3.09 -0.182 0.52789E+04 191 walstromite 11.51 7.64 -3.86 -0.773 0.65987E+04 192 wollastonite 10.46 7.64 -2.82 -0.563 0.48091E+04 193 pseudo-wollastonite 11.00 7.64 -3.36 -0.671 0.57290E+04 195 akaganeite 7.75 3.71 -4.04 -0.874 0.68995E+04 200 beidellite-Na -1.34 -5.96 -4.61 -0.283 0.78777E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.80 -4.48 -0.560 0.76537E+04 204 montmorillonite-Ca -2.29 -5.86 -3.57 -0.221 0.61000E+04 205 montmorillonite-K -2.24 -5.85 -3.62 -0.221 0.61738E+04 206 montmorillonite-Mg -2.48 -6.36 -3.88 -0.240 0.66237E+04 207 montmorillonite-Na -2.04 -5.15 -3.11 -0.190 0.53056E+04 208 nontronite-Ca 3.21 -1.43 -4.64 -0.301 0.79284E+04 210 nontronite-K 3.34 -1.42 -4.76 -0.305 0.81254E+04 211 nontronite-Mg 3.07 -1.92 -5.00 -0.324 0.85362E+04 212 nontronite-Na 3.52 -0.71 -4.23 -0.272 0.72233E+04 228 tobermorite 9.82 5.87 -3.95 -1.079 0.67519E+04 234 alabandite -0.98 -3.04 -2.06 -0.687 0.35206E+04 237 boehmite 4.41 1.09 -3.32 -0.553 0.56604E+04 239 ferrous-oxide 9.81 4.98 -4.84 -1.209 0.82574E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.06 -0.96 -0.074 0.16346E+04 248 an25ab75 2.65 1.42 -1.22 -0.094 0.20903E+04 249 an30ab70 3.28 1.78 -1.50 -0.115 0.25555E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1359900 MOLES New total amount of reactant added: 0.1399900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1399900 Water: Moles liquid = 0.4998E+02 kg liquid = 0.9004E+00 Moles total = 0.4996E+02 kg total = 0.9001E+00 Activity = 1.0000 Stoichiometric ionic strength = .2039411E-01 Osmotic coef. = 0.9186 True ionic strength = .2478480E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9638E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.76745E-09 -9.1149 0.63617E-09 -9.1964 0.82894E+00 -0.0815 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.10652E-02 -2.9726 0.87674E-03 -3.0571 0.82307E+00 -0.0846 4 SO4-- 0.72495E-03 -3.1397 0.35544E-03 -3.4492 0.49030E+00 -0.3095 5 HCO3- 0.91312E-02 -2.0395 0.75285E-02 -2.1233 0.82449E+00 -0.0838 6 HS- 0.30754E-02 -2.5121 0.25317E-02 -2.5966 0.82321E+00 -0.0845 7 Al+++ 0.17329E-25 -25.7612 0.35087E-26 -26.4549 0.20247E+00 -0.6936 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.30588E-07 -7.5144 0.14867E-07 -7.8278 0.48604E+00 -0.3133 10 Mg++ 0.30212E-10 -10.5198 0.14605E-10 -10.8355 0.48342E+00 -0.3157 11 Fe++ 0.59378E-13 -13.2264 0.28741E-13 -13.5415 0.48404E+00 -0.3151 12 K+ 0.15590E-03 -3.8072 0.12857E-03 -3.8909 0.82471E+00 -0.0837 13 Na+ 0.21790E-01 -1.6617 0.17931E-01 -1.7464 0.82288E+00 -0.0847 14 Mn++ 0.49016E-09 -9.3097 0.23749E-09 -9.6244 0.48451E+00 -0.3147 15 F- 0.62086E-04 -4.2070 0.50977E-04 -4.2926 0.82107E+00 -0.0856 16 HPO4-- 0.45844E-07 -7.3387 0.22481E-07 -7.6482 0.49038E+00 -0.3095 18 HSiO3- 0.18272E-02 -2.7382 0.15039E-02 -2.8228 0.82307E+00 -0.0846 19 Ca(HSiO3)+ 0.61726E-09 -9.2095 0.50919E-09 -9.2931 0.82492E+00 -0.0836 20 Mg(HSiO3)+ 0.75464E-12 -12.1223 0.62252E-12 -12.2058 0.82492E+00 -0.0836 21 NaHSiO3,aq 0.43614E-03 -3.3604 0.43614E-03 -3.3604 0.10000E+01 0.0000 22 AlO+ 0.14297E-14 -14.8447 0.11794E-14 -14.9283 0.82492E+00 -0.0836 24 HAlO2,aq 0.36920E-09 -9.4327 0.36920E-09 -9.4327 0.10000E+01 0.0000 25 AlO2- 0.15641E-05 -5.8057 0.12847E-05 -5.8912 0.82132E+00 -0.0855 26 CH4,aq 0.52410E-07 -7.2806 0.52088E-07 -7.2833 0.99387E+00 -0.0027 27 C2H6,aq 0.37652E-17 -17.4242 0.37421E-17 -17.4269 0.99387E+00 -0.0027 31 CO,aq 0.31866E-13 -13.4967 0.31866E-13 -13.4967 0.10000E+01 0.0000 32 CO2,aq 0.10297E-04 -4.9873 0.10234E-04 -4.9900 0.99387E+00 -0.0027 33 CO3-2 0.21135E-02 -2.6750 0.10337E-02 -2.9856 0.48907E+00 -0.3106 34 CaCO3,aq 0.19269E-06 -6.7151 0.19269E-06 -6.7151 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.34634E-08 -8.4605 0.28571E-08 -8.5441 0.82492E+00 -0.0836 36 CaCl+ 0.25571E-10 -10.5923 0.21094E-10 -10.6758 0.82492E+00 -0.0836 37 CaCl2,aq 0.43938E-14 -14.3572 0.43938E-14 -14.3572 0.10000E+01 0.0000 38 CaF+ 0.13414E-10 -10.8725 0.11065E-10 -10.9560 0.82492E+00 -0.0836 39 CaOH+ 0.20190E-08 -8.6949 0.16655E-08 -8.7784 0.82492E+00 -0.0836 40 CaSO4,aq 0.16781E-08 -8.7752 0.16781E-08 -8.7752 0.10000E+01 0.0000 41 HCl,aq 0.10221E-12 -12.9905 0.10221E-12 -12.9905 0.10000E+01 0.0000 45 HF,aq 0.22201E-09 -9.6536 0.22201E-09 -9.6536 0.10000E+01 0.0000 46 HF2- 0.46424E-14 -14.3333 0.38210E-14 -14.4178 0.82307E+00 -0.0846 48 FeCl+ 0.48350E-16 -16.3156 0.39885E-16 -16.3992 0.82492E+00 -0.0836 51 FeF+ 0.90762E-16 -16.0421 0.74872E-16 -16.1257 0.82492E+00 -0.0836 53 FeO,aq 0.27601E-11 -11.5591 0.27601E-11 -11.5591 0.10000E+01 0.0000 54 FeOH+ 0.17827E-11 -11.7489 0.14706E-11 -11.8325 0.82492E+00 -0.0836 55 HFeO2- 0.55153E-10 -10.2584 0.45395E-10 -10.3430 0.82307E+00 -0.0846 56 FeO+ 0.12078E-16 -16.9180 0.99632E-17 -17.0016 0.82492E+00 -0.0836 58 FeO2- 0.61201E-11 -11.2132 0.50373E-11 -11.2978 0.82307E+00 -0.0846 59 HFeO2,aq 0.40757E-12 -12.3898 0.40757E-12 -12.3898 0.10000E+01 0.0000 60 H2,aq 0.12472E-06 -6.9041 0.12395E-06 -6.9068 0.99387E+00 -0.0027 61 KCl,aq 0.20430E-08 -8.6897 0.20430E-08 -8.6897 0.10000E+01 0.0000 62 KHSO4,aq 0.82201E-16 -16.0851 0.82201E-16 -16.0851 0.10000E+01 0.0000 63 KOH,aq 0.86309E-07 -7.0639 0.86309E-07 -7.0639 0.10000E+01 0.0000 64 KSO4- 0.86160E-06 -6.0647 0.70915E-06 -6.1493 0.82307E+00 -0.0846 65 MgCO3,aq 0.47448E-10 -10.3238 0.47448E-10 -10.3238 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.34766E-11 -11.4588 0.28679E-11 -11.5424 0.82492E+00 -0.0836 67 MgCl+ 0.22768E-13 -13.6427 0.18781E-13 -13.7263 0.82492E+00 -0.0836 68 MgF+ 0.48812E-13 -13.3115 0.40266E-13 -13.3951 0.82492E+00 -0.0836 69 MgOH+ 0.10975E-10 -10.9596 0.90538E-11 -11.0432 0.82492E+00 -0.0836 71 MnF+ 0.24720E-12 -12.6070 0.20392E-12 -12.6905 0.82492E+00 -0.0836 72 MnO,aq 0.60770E-09 -9.2163 0.60770E-09 -9.2163 0.10000E+01 0.0000 73 MnOH+ 0.13684E-08 -8.8638 0.11288E-08 -8.9474 0.82492E+00 -0.0836 74 MnO2-2 0.10189E-12 -12.9919 0.49832E-13 -13.3025 0.48907E+00 -0.3106 75 HMnO2- 0.84384E-11 -11.0737 0.69453E-11 -11.1583 0.82307E+00 -0.0846 78 MnCl+ 0.15543E-11 -11.8085 0.12822E-11 -11.8920 0.82492E+00 -0.0836 79 MnSO4,aq 0.24370E-10 -10.6131 0.24370E-10 -10.6131 0.10000E+01 0.0000 80 NaCl,aq 0.52098E-05 -5.2832 0.52098E-05 -5.2832 0.10000E+01 0.0000 81 NaF,aq 0.21400E-06 -6.6696 0.21400E-06 -6.6696 0.10000E+01 0.0000 82 NaOH,aq 0.12110E-04 -4.9169 0.12110E-04 -4.9169 0.10000E+01 0.0000 84 OH- 0.11058E-02 -2.9563 0.90820E-03 -3.0418 0.82132E+00 -0.0855 89 HPO3-2 0.17756E-16 -16.7507 0.86839E-17 -17.0613 0.48907E+00 -0.3106 91 H2PO3- 0.13460E-19 -19.8710 0.11078E-19 -19.9555 0.82307E+00 -0.0846 92 H3PO4,aq 0.63635E-16 -16.1963 0.63635E-16 -16.1963 0.10000E+01 0.0000 93 H2PO4- 0.32019E-09 -9.4946 0.26383E-09 -9.5787 0.82399E+00 -0.0841 94 PO4-3 0.13439E-09 -9.8716 0.28832E-10 -10.5401 0.21454E+00 -0.6685 97 H2P2O7-2 0.11160E-19 -19.9523 0.54579E-20 -20.2630 0.48907E+00 -0.3106 98 HP2O7-3 0.84502E-17 -17.0731 0.17131E-17 -17.7662 0.20273E+00 -0.6931 99 P2O7-4 0.10494E-16 -16.9791 0.64330E-18 -18.1916 0.61303E-01 -1.2125 100 H2S,aq 0.50085E-05 -5.3003 0.49778E-05 -5.3030 0.99387E+00 -0.0027 101 S2-2 0.23428E-08 -8.6303 0.11458E-08 -8.9409 0.48907E+00 -0.3106 102 S3-2 0.12676E-12 -12.8970 0.61993E-13 -13.2077 0.48907E+00 -0.3106 103 S3- 0.91231E-16 -16.0399 0.75089E-16 -16.1244 0.82307E+00 -0.0846 104 S4-2 0.45303E-17 -17.3439 0.22157E-17 -17.6545 0.48907E+00 -0.3106 106 SO2,aq 0.79632E-19 -19.0989 0.79632E-19 -19.0989 0.10000E+01 0.0000 107 SO3-2 0.11510E-10 -10.9389 0.57253E-11 -11.2422 0.49742E+00 -0.3033 108 HSO3- 0.27707E-12 -12.5574 0.22805E-12 -12.6420 0.82307E+00 -0.0846 109 HSO4- 0.26386E-09 -9.5786 0.21792E-09 -9.6617 0.82588E+00 -0.0831 111 S2O3-2 0.42496E-10 -10.3716 0.20784E-10 -10.6823 0.48907E+00 -0.3106 112 HS2O3- 0.28724E-17 -17.5418 0.23641E-17 -17.6263 0.82307E+00 -0.0846 Charge balance for all species = -.6117E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7674534E-09 -.5485983E-02 -.5520143E+01 0.0000 2 H2O 0.1000000E+01 0.5550710E+02 0.9982774E+06 0.0000 3 Cl- 0.1065212E-02 0.1070424E-02 0.3788524E+02 6.1393 4 SO4-- 0.7249507E-03 0.7257314E-03 0.6959642E+02 14.9436 5 HCO3- 0.9131150E-02 0.1125520E-01 0.6855936E+03 7.0731 6 HS- 0.3075415E-02 0.3080512E-02 0.1017055E+03 6.5998 7 Al+++ 0.1732935E-25 0.1564507E-05 0.4214100E-01 1.1344 8 H4SiO4 0.1024625E-02 0.3287941E-02 0.3154847E+03 -2.9894 9 Ca++ 0.3058844E-07 0.2310975E-06 0.9246181E-02 10.5651 10 Mg++ 0.3021230E-10 0.9293862E-10 0.2255683E-05 7.5574 11 Fe++ 0.5937819E-13 0.6628343E-10 0.3695439E-05 4.8514 12 K+ 0.1558994E-03 0.1568493E-03 0.6122698E+01 5.3056 13 Na+ 0.2179029E-01 0.2224396E-01 0.5105150E+03 7.4500 14 Mn++ 0.4901630E-09 0.2501003E-08 0.1371665E-03 8.7685 15 F- 0.6208596E-04 0.6230019E-04 0.1181567E+01 4.9038 16 HPO4-- 0.4584431E-07 0.4629889E-07 0.4436168E-02 10.7447 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.4953117E-02 -.4939658E-02 -.1345846E-04 0.0000000E+00 2 H2O 0.4996102E+02 0.4997940E+02 -.1837832E-01 0.0000000E+00 3 Cl- 0.9638252E-03 0.9638252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6534672E-03 0.6534591E-03 0.8133147E-08 0.0000000E+00 5 HCO3- 0.1013435E-01 0.1013435E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2773794E-02 0.2773737E-02 0.5693203E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1408705E-05 0.3366647E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.2960510E-02 0.9192510E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.5968256E-10 0.3253259E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002878E-01 0.3366647E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.5609600E-04 0.5609600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.901948E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3367E-05 -5.473 0.8828E-03 -3.054 0.1598 0.3389E-03 pyrite 0.3253E-07 -7.488 0.3903E-05 -5.409 0.7064E-03 0.7788E-06 quartz 0.9182E-02 -2.037 0.5517 -0.258 99.84 0.2083 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.552566 g Volume = 0.208678 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1399900 moles log = -0.8539 Original solution: 1000.0103000 g Original solution / Rock added: 7143.44 (Water/Rock Ratio), log = 3.8539 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0218 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9986E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1064E-02 1.0071 0.1095E-02 0.1087E-02 CH4,gas 0.7411E-04 1.0125 0.7667E-04 0.7572E-04 H2,gas 0.1592E-03 1.0005 0.1627E-03 0.1626E-03 H2S,gas 0.1345E-03 0.9960 0.1368E-03 0.1374E-03 S2,gas 0.2597E-19 1.0000 0.2654E-19 0.2654E-19 CO,gas 0.4647E-10 1.0000 0.4749E-10 0.4749E-10 SO3,gas 0.5323E-37 1.0000 0.5439E-37 0.5439E-37 SO2,gas 0.3370E-18 1.0000 0.3444E-18 0.3444E-18 HF,gas 0.5335E-12 1.0000 0.5451E-12 0.5451E-12 HCl,gas 0.1765E-15 1.0000 0.1803E-15 0.1803E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.32 -4.66 -1.553 0.79561E+04 -2.961 3 CH4,gas 4.54 -1.27 -5.81 -1.454 0.99278E+04 -4.115 4 H2,gas 8.00 2.51 -5.49 -3.136 0.93697E+04 -3.789 5 H2S,gas -6.23 -11.79 -5.56 -2.781 0.94983E+04 -3.864 6 S2,gas -7.34 -28.61 -21.28 -3.273 0.36327E+05 -19.576 7 CO,gas 3.21 -8.81 -12.02 -3.699 0.20528E+05 -10.323 8 SO3,gas 17.12 -21.84 -38.96 -9.741 0.66529E+05 -37.264 9 SO2,gas 0.83 -19.33 -20.16 -5.377 0.34426E+05 -18.463 10 HF,gas 0.47 -13.49 -13.96 -6.981 0.23841E+05 -12.264 11 HCl,gas 5.19 -12.25 -17.44 -8.721 0.29783E+05 -15.744 12 acmite 7.71 5.07 -2.64 -0.275 0.45134E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.61 -4.85 -0.243 0.82835E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.79 -4.49 -0.374 0.76593E+04 38 aragonite 0.97 -0.75 -1.72 -0.574 0.29388E+04 40 calcite 0.81 -0.75 -1.57 -0.522 0.26746E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.85 -4.73 -0.316 0.80845E+04 45 celadonite 5.34 2.04 -3.30 -0.194 0.56381E+04 46 celadonite-Fe 3.88 -0.67 -4.54 -0.267 0.77569E+04 55 chloritoid-Mn 11.40 8.05 -3.35 -0.224 0.57255E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.21 -0.351 0.71948E+04 68 diaspore 2.87 1.13 -1.74 -0.290 0.29698E+04 69 diamond -3.10 -6.30 -3.19 -0.912 0.54516E+04 70 diopside 16.18 12.14 -4.04 -0.404 0.68944E+04 71 hedenbergite 14.21 9.44 -4.77 -0.477 0.81459E+04 86 gibbsite 4.08 1.13 -2.94 -0.421 0.50283E+04 89 graphite -3.55 -6.30 -2.75 -0.785 0.46939E+04 94 heulandite -5.83 -8.09 -2.26 -0.103 0.38672E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.13 -0.590 0.70576E+04 101 kaolinite -1.33 -3.71 -2.38 -0.216 0.40591E+04 104 laumontite 2.88 0.88 -2.01 -0.134 0.34273E+04 105 lawsonite 9.62 6.86 -2.76 -0.184 0.47144E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62455E+04 109 magnesite 0.69 -3.76 -4.45 -1.484 0.76033E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.71415E+02 123 muscovite 2.58 -0.26 -2.84 -0.167 0.48525E+04 124 paragonite 4.24 1.88 -2.35 -0.138 0.40202E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.43 -4.94 -0.291 0.84370E+04 146 pyrrhotite -4.26 -6.94 -2.68 -0.894 0.45783E+04 147 pyrrhotiteFe0.875 -6.02 -7.86 -1.84 -0.678 0.31463E+04 148 pyroxmangite 7.40 5.78 -1.62 -0.324 0.27655E+04 149 pyrophyllite -6.18 -9.69 -3.51 -0.220 0.59985E+04 154 rhodochrosite -0.98 -2.55 -1.57 -0.525 0.26891E+04 155 rhodonite 7.45 5.78 -1.67 -0.333 0.28457E+04 156 sanidine -1.28 -2.53 -1.25 -0.096 0.21392E+04 158 siderite -2.61 -6.47 -3.86 -1.287 0.65912E+04 166 stilbite -7.52 -8.09 -0.57 -0.027 0.97341E+03 177 tephroite 18.09 14.55 -3.54 -0.505 0.60414E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -6.94 -2.53 -0.844 0.43211E+04 190 wairakite 3.95 0.88 -3.07 -0.181 0.52493E+04 191 walstromite 11.51 7.58 -3.93 -0.787 0.67165E+04 192 wollastonite 10.46 7.58 -2.89 -0.577 0.49269E+04 193 pseudo-wollastonite 11.00 7.58 -3.42 -0.685 0.58468E+04 195 akaganeite 7.75 3.60 -4.16 -0.899 0.71020E+04 196 beidellite-Ca -1.65 -6.58 -4.94 -0.306 0.84335E+04 200 beidellite-Na -1.34 -5.87 -4.53 -0.277 0.77302E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.74 -4.42 -0.552 0.75421E+04 204 montmorillonite-Ca -2.29 -5.83 -3.54 -0.219 0.60366E+04 205 montmorillonite-K -2.24 -5.82 -3.58 -0.219 0.61158E+04 206 montmorillonite-Mg -2.48 -6.32 -3.84 -0.238 0.65610E+04 207 montmorillonite-Na -2.04 -5.11 -3.07 -0.188 0.52471E+04 208 nontronite-Ca 3.21 -1.66 -4.88 -0.316 0.83286E+04 210 nontronite-K 3.34 -1.66 -5.00 -0.321 0.85310E+04 212 nontronite-Na 3.52 -0.95 -4.47 -0.287 0.76283E+04 228 tobermorite 9.82 5.81 -4.01 -1.095 0.68500E+04 234 alabandite -0.98 -3.02 -2.05 -0.682 0.34946E+04 237 boehmite 4.41 1.13 -3.27 -0.545 0.55867E+04 239 ferrous-oxide 9.81 4.85 -4.96 -1.240 0.84695E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.06 -0.95 -0.073 0.16287E+04 248 an25ab75 2.65 1.43 -1.22 -0.094 0.20828E+04 249 an30ab70 3.28 1.79 -1.49 -0.115 0.25466E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1399900 MOLES New total amount of reactant added: 0.1439900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1439900 Water: Moles liquid = 0.4998E+02 kg liquid = 0.9005E+00 Moles total = 0.4996E+02 kg total = 0.9001E+00 Activity = 1.0000 Stoichiometric ionic strength = .2065295E-01 Osmotic coef. = 0.9182 True ionic strength = .2472257E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9874E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.85580E-09 -9.0676 0.70953E-09 -9.1490 0.82908E+00 -0.0814 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.10912E-02 -2.9621 0.89829E-03 -3.0466 0.82321E+00 -0.0845 4 SO4-- 0.74609E-03 -3.1272 0.36606E-03 -3.4364 0.49064E+00 -0.3092 5 HCO3- 0.95768E-02 -2.0188 0.78973E-02 -2.1025 0.82463E+00 -0.0837 6 HS- 0.31612E-02 -2.5001 0.26028E-02 -2.5846 0.82335E+00 -0.0844 7 Al+++ 0.26712E-25 -25.5733 0.54170E-26 -26.2662 0.20279E+00 -0.6929 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.32170E-07 -7.4926 0.15647E-07 -7.8056 0.48639E+00 -0.3130 10 Mg++ 0.31506E-10 -10.5016 0.15241E-10 -10.8170 0.48377E+00 -0.3154 11 Fe++ 0.54605E-13 -13.2628 0.26450E-13 -13.5776 0.48439E+00 -0.3148 12 K+ 0.15587E-03 -3.8072 0.12857E-03 -3.8909 0.82485E+00 -0.0836 13 Na+ 0.21834E-01 -1.6609 0.17970E-01 -1.7455 0.82302E+00 -0.0846 14 Mn++ 0.54728E-09 -9.2618 0.26536E-09 -9.5762 0.48486E+00 -0.3144 15 F- 0.63852E-04 -4.1948 0.52436E-04 -4.2804 0.82122E+00 -0.0855 16 HPO4-- 0.45818E-07 -7.3390 0.22484E-07 -7.6481 0.49072E+00 -0.3092 18 HSiO3- 0.16380E-02 -2.7857 0.13484E-02 -2.8702 0.82321E+00 -0.0845 19 Ca(HSiO3)+ 0.58237E-09 -9.2348 0.48049E-09 -9.3183 0.82506E+00 -0.0835 20 Mg(HSiO3)+ 0.70598E-12 -12.1512 0.58248E-12 -12.2347 0.82506E+00 -0.0835 21 NaHSiO3,aq 0.39190E-03 -3.4068 0.39190E-03 -3.4068 0.10000E+01 0.0000 22 AlO+ 0.17743E-14 -14.7510 0.14639E-14 -14.8345 0.82506E+00 -0.0835 23 AlOH+2 0.10654E-19 -19.9725 0.51719E-20 -20.2864 0.48542E+00 -0.3139 24 HAlO2,aq 0.41088E-09 -9.3863 0.41088E-09 -9.3863 0.10000E+01 0.0000 25 AlO2- 0.15605E-05 -5.8067 0.12819E-05 -5.8922 0.82146E+00 -0.0854 26 CH4,aq 0.54885E-07 -7.2605 0.54545E-07 -7.2632 0.99379E+00 -0.0027 27 C2H6,aq 0.42450E-17 -17.3721 0.42187E-17 -17.3748 0.99379E+00 -0.0027 31 CO,aq 0.36262E-13 -13.4406 0.36262E-13 -13.4406 0.10000E+01 0.0000 32 CO2,aq 0.12048E-04 -4.9191 0.11973E-04 -4.9218 0.99379E+00 -0.0027 33 CO3-2 0.19864E-02 -2.7019 0.97220E-03 -3.0122 0.48942E+00 -0.3103 34 CaCO3,aq 0.19074E-06 -6.7196 0.19074E-06 -6.7196 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.38230E-08 -8.4176 0.31542E-08 -8.5011 0.82506E+00 -0.0835 36 CaCl+ 0.27569E-10 -10.5596 0.22746E-10 -10.6431 0.82506E+00 -0.0835 37 CaCl2,aq 0.48543E-14 -14.3139 0.48543E-14 -14.3139 0.10000E+01 0.0000 38 CaF+ 0.14519E-10 -10.8381 0.11979E-10 -10.9216 0.82506E+00 -0.0835 39 CaOH+ 0.19049E-08 -8.7201 0.15717E-08 -8.8036 0.82506E+00 -0.0835 40 CaSO4,aq 0.18188E-08 -8.7402 0.18188E-08 -8.7402 0.10000E+01 0.0000 41 HCl,aq 0.11679E-12 -12.9326 0.11679E-12 -12.9326 0.10000E+01 0.0000 45 HF,aq 0.25469E-09 -9.5940 0.25469E-09 -9.5940 0.10000E+01 0.0000 46 HF2- 0.54774E-14 -14.2614 0.45090E-14 -14.3459 0.82321E+00 -0.0845 48 FeCl+ 0.45582E-16 -16.3412 0.37608E-16 -16.4247 0.82506E+00 -0.0835 51 FeF+ 0.85902E-16 -16.0660 0.70875E-16 -16.1495 0.82506E+00 -0.0835 53 FeO,aq 0.20420E-11 -11.6899 0.20420E-11 -11.6899 0.10000E+01 0.0000 54 FeOH+ 0.14707E-11 -11.8325 0.12135E-11 -11.9160 0.82506E+00 -0.0835 55 HFeO2- 0.36579E-10 -10.4368 0.30113E-10 -10.5213 0.82321E+00 -0.0845 56 FeO+ 0.10103E-16 -16.9955 0.83357E-17 -17.0791 0.82506E+00 -0.0835 58 FeO2- 0.41157E-11 -11.3856 0.33881E-11 -11.4700 0.82321E+00 -0.0845 59 HFeO2,aq 0.30574E-12 -12.5146 0.30574E-12 -12.5146 0.10000E+01 0.0000 60 H2,aq 0.12132E-06 -6.9161 0.12056E-06 -6.9188 0.99379E+00 -0.0027 61 KCl,aq 0.20932E-08 -8.6792 0.20932E-08 -8.6792 0.10000E+01 0.0000 62 KHSO4,aq 0.94417E-16 -16.0250 0.94417E-16 -16.0250 0.10000E+01 0.0000 63 KOH,aq 0.77386E-07 -7.1113 0.77386E-07 -7.1113 0.10000E+01 0.0000 64 KSO4- 0.88718E-06 -6.0520 0.73033E-06 -6.1365 0.82321E+00 -0.0845 65 MgCO3,aq 0.46571E-10 -10.3319 0.46571E-10 -10.3319 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.38051E-11 -11.4196 0.31395E-11 -11.5031 0.82506E+00 -0.0835 67 MgCl+ 0.24339E-13 -13.6137 0.20081E-13 -13.6972 0.82506E+00 -0.0835 68 MgF+ 0.52388E-13 -13.2808 0.43223E-13 -13.3643 0.82506E+00 -0.0835 69 MgOH+ 0.10268E-10 -10.9885 0.84714E-11 -11.0720 0.82506E+00 -0.0835 71 MnF+ 0.28406E-12 -12.5466 0.23437E-12 -12.6301 0.82506E+00 -0.0835 72 MnO,aq 0.54587E-09 -9.2629 0.54587E-09 -9.2629 0.10000E+01 0.0000 73 MnOH+ 0.13707E-08 -8.8631 0.11309E-08 -8.9466 0.82506E+00 -0.0835 74 MnO2-2 0.73527E-13 -13.1336 0.35985E-13 -13.4439 0.48942E+00 -0.3103 75 HMnO2- 0.67950E-11 -11.1678 0.55937E-11 -11.2523 0.82321E+00 -0.0845 78 MnCl+ 0.17791E-11 -11.7498 0.14679E-11 -11.8333 0.82506E+00 -0.0835 79 MnSO4,aq 0.28043E-10 -10.5522 0.28043E-10 -10.5522 0.10000E+01 0.0000 80 NaCl,aq 0.53496E-05 -5.2717 0.53496E-05 -5.2717 0.10000E+01 0.0000 81 NaF,aq 0.22060E-06 -6.6564 0.22060E-06 -6.6564 0.10000E+01 0.0000 82 NaOH,aq 0.10882E-04 -4.9633 0.10882E-04 -4.9633 0.10000E+01 0.0000 84 OH- 0.99129E-03 -3.0038 0.81431E-03 -3.0892 0.82146E+00 -0.0854 89 HPO3-2 0.17260E-16 -16.7629 0.84475E-17 -17.0733 0.48942E+00 -0.3103 91 H2PO3- 0.14600E-19 -19.8356 0.12019E-19 -19.9201 0.82321E+00 -0.0845 92 H3PO4,aq 0.79165E-16 -16.1015 0.79165E-16 -16.1015 0.10000E+01 0.0000 93 H2PO4- 0.35709E-09 -9.4472 0.29429E-09 -9.5312 0.82413E+00 -0.0840 94 PO4-3 0.12033E-09 -9.9196 0.25855E-10 -10.5875 0.21487E+00 -0.6678 97 H2P2O7-2 0.13875E-19 -19.8578 0.67908E-20 -20.1681 0.48942E+00 -0.3103 98 HP2O7-3 0.94118E-17 -17.0263 0.19111E-17 -17.7187 0.20305E+00 -0.6924 99 P2O7-4 0.10467E-16 -16.9802 0.64346E-18 -18.1915 0.61474E-01 -1.2113 100 H2S,aq 0.57432E-05 -5.2408 0.57075E-05 -5.2436 0.99379E+00 -0.0027 101 S2-2 0.25440E-08 -8.5945 0.12451E-08 -8.9048 0.48942E+00 -0.3103 102 S3-2 0.16226E-12 -12.7898 0.79411E-13 -13.1001 0.48942E+00 -0.3103 103 S3- 0.13213E-15 -15.8790 0.10877E-15 -15.9635 0.82321E+00 -0.0845 104 S4-2 0.68362E-17 -17.1652 0.33457E-17 -17.4755 0.48942E+00 -0.3103 106 SO2,aq 0.99224E-19 -19.0034 0.99224E-19 -19.0034 0.10000E+01 0.0000 107 SO3-2 0.11522E-10 -10.9385 0.57351E-11 -11.2415 0.49776E+00 -0.3030 108 HSO3- 0.30950E-12 -12.5093 0.25478E-12 -12.5938 0.82321E+00 -0.0845 109 HSO4- 0.30303E-09 -9.5185 0.25031E-09 -9.6015 0.82602E+00 -0.0830 111 S2O3-2 0.50147E-10 -10.2998 0.24543E-10 -10.6101 0.48942E+00 -0.3103 112 HS2O3- 0.37823E-17 -17.4222 0.31136E-17 -17.5067 0.82321E+00 -0.0845 Charge balance for all species = -.6116E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.8558026E-09 -.5007273E-02 -.5038425E+01 0.0000 2 H2O 0.1000000E+01 0.5550721E+02 0.9982740E+06 0.0000 3 Cl- 0.1091204E-02 0.1096555E-02 0.3880988E+02 6.1024 4 SO4-- 0.7460853E-03 0.7468902E-03 0.7162512E+02 14.8616 5 HCO3- 0.9576810E-02 0.1157556E-01 0.7051036E+03 7.0465 6 HS- 0.3161189E-02 0.3167022E-02 0.1045611E+03 6.5645 7 Al+++ 0.2671201E-25 0.1560863E-05 0.4204261E-01 1.1809 8 H4SiO4 0.1024625E-02 0.3054525E-02 0.2930863E+03 -2.9894 9 Ca++ 0.3216969E-07 0.2310809E-06 0.9245466E-02 10.4925 10 Mg++ 0.3150555E-10 0.9293194E-10 0.2255509E-05 7.4811 11 Fe++ 0.5460476E-13 0.4456841E-10 0.2484768E-05 4.7205 12 K+ 0.1558714E-03 0.1568380E-03 0.6122224E+01 5.2582 13 Na+ 0.2183400E-01 0.2224236E-01 0.5104754E+03 7.4036 14 Mn++ 0.5472838E-09 0.2500823E-08 0.1371559E-03 8.7219 15 F- 0.6385168E-04 0.6407255E-04 0.1215175E+01 4.8687 16 HPO4-- 0.4581814E-07 0.4629556E-07 0.4435825E-02 10.6499 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.4522417E-02 -.4508946E-02 -.1347117E-04 0.0000000E+00 2 H2O 0.4996429E+02 0.4998309E+02 -.1879826E-01 0.0000000E+00 3 Cl- 0.9874252E-03 0.9874252E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6725672E-03 0.6725591E-03 0.8138034E-08 0.0000000E+00 5 HCO3- 0.1042355E-01 0.1042355E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2851894E-02 0.2851837E-02 0.5696624E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1405525E-05 0.3369827E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.2750536E-02 0.9402484E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.4013293E-10 0.3255214E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002878E-01 0.3369827E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.5769600E-04 0.5769600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2541E-20 Mass of aqueous solution: 0.902017E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1439900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3370E-05 -5.472 0.8836E-03 -3.054 0.1563 0.3392E-03 pyrite 0.3255E-07 -7.487 0.3906E-05 -5.408 0.6910E-03 0.7793E-06 quartz 0.9392E-02 -2.027 0.5643 -0.248 99.84 0.2131 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.565181 g Volume = 0.213442 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1439900 moles log = -0.8417 Original solution: 1000.0103000 g Original solution / Rock added: 6945.00 (Water/Rock Ratio), log = 3.8417 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0220 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9984E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1245E-02 1.0071 0.1281E-02 0.1272E-02 CH4,gas 0.7759E-04 1.0125 0.8029E-04 0.7929E-04 H2,gas 0.1548E-03 1.0005 0.1583E-03 0.1582E-03 H2S,gas 0.1541E-03 0.9960 0.1569E-03 0.1575E-03 S2,gas 0.3609E-19 1.0000 0.3688E-19 0.3688E-19 CO,gas 0.5287E-10 1.0000 0.5404E-10 0.5404E-10 SO3,gas 0.6818E-37 1.0000 0.6968E-37 0.6968E-37 SO2,gas 0.4199E-18 1.0000 0.4291E-18 0.4291E-18 HF,gas 0.6119E-12 1.0000 0.6254E-12 0.6254E-12 HCl,gas 0.2017E-15 1.0000 0.2061E-15 0.2061E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.13080E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.75827E-12 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.25 -4.59 -1.530 0.78397E+04 -2.892 3 CH4,gas 4.54 -1.25 -5.79 -1.449 0.98937E+04 -4.095 4 H2,gas 8.00 2.50 -5.50 -3.143 0.93903E+04 -3.801 5 H2S,gas -6.23 -11.73 -5.50 -2.752 0.93968E+04 -3.804 6 S2,gas -7.34 -28.47 -21.13 -3.251 0.36083E+05 -19.433 7 CO,gas 3.21 -8.75 -11.97 -3.682 0.20432E+05 -10.267 8 SO3,gas 17.12 -21.73 -38.86 -9.714 0.66345E+05 -37.157 9 SO2,gas 0.83 -19.23 -20.07 -5.351 0.34263E+05 -18.367 10 HF,gas 0.47 -13.43 -13.90 -6.951 0.23739E+05 -12.204 11 HCl,gas 5.19 -12.20 -17.38 -8.692 0.29684E+05 -15.686 12 acmite 7.71 4.90 -2.81 -0.292 0.48059E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.56 -4.90 -0.245 0.83636E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.81 -4.50 -0.375 0.76914E+04 38 aragonite 0.97 -0.76 -1.73 -0.575 0.29464E+04 40 calcite 0.81 -0.76 -1.57 -0.524 0.26822E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.86 -4.72 -0.315 0.80561E+04 45 celadonite 5.34 1.96 -3.38 -0.199 0.57699E+04 46 celadonite-Fe 3.88 -0.80 -4.67 -0.275 0.79820E+04 55 chloritoid-Mn 11.40 8.09 -3.31 -0.220 0.56464E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.21 -0.351 0.71964E+04 68 diaspore 2.87 1.18 -1.69 -0.282 0.28905E+04 69 diamond -3.10 -6.25 -3.15 -0.900 0.53763E+04 70 diopside 16.18 11.99 -4.19 -0.419 0.71486E+04 71 hedenbergite 14.21 9.23 -4.97 -0.497 0.84933E+04 86 gibbsite 4.08 1.18 -2.90 -0.414 0.49490E+04 89 graphite -3.55 -6.25 -2.70 -0.773 0.46186E+04 94 heulandite -5.83 -8.07 -2.24 -0.102 0.38326E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.13 -0.591 0.70592E+04 101 kaolinite -1.33 -3.62 -2.28 -0.208 0.39005E+04 104 laumontite 2.88 0.90 -1.99 -0.132 0.33926E+04 105 lawsonite 9.62 6.88 -2.74 -0.183 0.46797E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62471E+04 109 magnesite 0.69 -3.77 -4.46 -1.487 0.76171E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.73037E+02 123 muscovite 2.58 -0.17 -2.75 -0.162 0.46955E+04 124 paragonite 4.24 1.98 -2.26 -0.133 0.38616E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 139 prehnite 19.37 14.38 -4.99 -0.294 0.85262E+04 146 pyrrhotite -4.26 -7.01 -2.75 -0.918 0.47003E+04 147 pyrrhotiteFe0.875 -6.02 -7.91 -1.90 -0.697 0.32378E+04 148 pyroxmangite 7.40 5.73 -1.67 -0.333 0.28450E+04 149 pyrophyllite -6.18 -9.60 -3.42 -0.214 0.58399E+04 154 rhodochrosite -0.98 -2.53 -1.55 -0.518 0.26523E+04 155 rhodonite 7.45 5.73 -1.71 -0.343 0.29253E+04 156 sanidine -1.28 -2.53 -1.25 -0.096 0.21408E+04 158 siderite -2.61 -6.53 -3.92 -1.308 0.66983E+04 166 stilbite -7.52 -8.07 -0.55 -0.026 0.93874E+03 177 tephroite 18.09 14.45 -3.63 -0.519 0.62006E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.01 -2.60 -0.867 0.44431E+04 190 wairakite 3.95 0.90 -3.05 -0.180 0.52146E+04 191 walstromite 11.51 7.50 -4.01 -0.801 0.68404E+04 192 wollastonite 10.46 7.50 -2.96 -0.592 0.50509E+04 193 pseudo-wollastonite 11.00 7.50 -3.50 -0.699 0.59707E+04 195 akaganeite 7.75 3.47 -4.28 -0.926 0.73152E+04 196 beidellite-Ca -1.65 -6.49 -4.84 -0.300 0.82692E+04 198 beidellite-K -1.52 -6.48 -4.96 -0.304 0.84766E+04 200 beidellite-Na -1.34 -5.78 -4.43 -0.272 0.75716E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.67 -4.35 -0.544 0.74257E+04 204 montmorillonite-Ca -2.29 -5.79 -3.49 -0.216 0.59676E+04 205 montmorillonite-K -2.24 -5.78 -3.55 -0.217 0.60530E+04 206 montmorillonite-Mg -2.48 -6.28 -3.80 -0.235 0.64930E+04 207 montmorillonite-Na -2.04 -5.07 -3.04 -0.186 0.51838E+04 212 nontronite-Na 3.52 -1.20 -4.72 -0.303 0.80547E+04 228 tobermorite 9.82 5.75 -4.07 -1.111 0.69532E+04 234 alabandite -0.98 -3.01 -2.03 -0.678 0.34727E+04 237 boehmite 4.41 1.18 -3.23 -0.538 0.55074E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.07 -0.95 -0.073 0.16218E+04 248 an25ab75 2.65 1.43 -1.21 -0.093 0.20742E+04 249 an30ab70 3.28 1.79 -1.49 -0.114 0.25362E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1439900 MOLES New total amount of reactant added: 0.1479900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1479900 Water: Moles liquid = 0.4999E+02 kg liquid = 0.9005E+00 Moles total = 0.4997E+02 kg total = 0.9002E+00 Activity = 1.0000 Stoichiometric ionic strength = .2091176E-01 Osmotic coef. = 0.9177 True ionic strength = .2464778E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1011E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.96284E-09 -9.0164 0.79842E-09 -9.0978 0.82924E+00 -0.0813 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.11172E-02 -2.9519 0.91988E-03 -3.0363 0.82338E+00 -0.0844 4 SO4-- 0.76722E-03 -3.1151 0.37674E-03 -3.4240 0.49105E+00 -0.3089 5 HCO3- 0.10033E-01 -1.9986 0.82754E-02 -2.0822 0.82480E+00 -0.0837 6 HS- 0.32468E-02 -2.4885 0.26738E-02 -2.5729 0.82352E+00 -0.0843 7 Al+++ 0.42658E-25 -25.3700 0.86674E-26 -26.0621 0.20319E+00 -0.6921 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.34086E-07 -7.4674 0.16593E-07 -7.7801 0.48680E+00 -0.3126 10 Mg++ 0.32992E-10 -10.4816 0.15975E-10 -10.7966 0.48419E+00 -0.3150 11 Fe++ 0.50170E-13 -13.2996 0.24323E-13 -13.6140 0.48481E+00 -0.3144 12 K+ 0.15584E-03 -3.8073 0.12857E-03 -3.8908 0.82502E+00 -0.0835 13 Na+ 0.21876E-01 -1.6600 0.18009E-01 -1.7445 0.82320E+00 -0.0845 14 Mn++ 0.61276E-09 -9.2127 0.29736E-09 -9.5267 0.48528E+00 -0.3140 15 F- 0.65617E-04 -4.1830 0.53898E-04 -4.2684 0.82140E+00 -0.0854 16 HPO4-- 0.45784E-07 -7.3393 0.22486E-07 -7.6481 0.49113E+00 -0.3088 18 HSiO3- 0.14553E-02 -2.8370 0.11983E-02 -2.9214 0.82338E+00 -0.0844 19 Ca(HSiO3)+ 0.54871E-09 -9.2607 0.45281E-09 -9.3441 0.82523E+00 -0.0834 20 Mg(HSiO3)+ 0.65742E-12 -12.1822 0.54253E-12 -12.2656 0.82523E+00 -0.0834 21 NaHSiO3,aq 0.34902E-03 -3.4572 0.34902E-03 -3.4572 0.10000E+01 0.0000 22 AlO+ 0.22414E-14 -14.6495 0.18497E-14 -14.7329 0.82523E+00 -0.0834 23 AlOH+2 0.15136E-19 -19.8200 0.73538E-20 -20.1335 0.48584E+00 -0.3135 24 HAlO2,aq 0.46136E-09 -9.3360 0.46136E-09 -9.3360 0.10000E+01 0.0000 25 AlO2- 0.15568E-05 -5.8078 0.12791E-05 -5.8931 0.82164E+00 -0.0853 26 CH4,aq 0.57411E-07 -7.2410 0.57051E-07 -7.2437 0.99372E+00 -0.0027 27 C2H6,aq 0.47857E-17 -17.3201 0.47556E-17 -17.3228 0.99372E+00 -0.0027 31 CO,aq 0.41496E-13 -13.3820 0.41496E-13 -13.3820 0.10000E+01 0.0000 32 CO2,aq 0.14207E-04 -4.8475 0.14118E-04 -4.8502 0.99372E+00 -0.0027 33 CO3-2 0.18482E-02 -2.7332 0.90531E-03 -3.0432 0.48983E+00 -0.3100 34 CaCO3,aq 0.18836E-06 -6.7250 0.18836E-06 -6.7250 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.42474E-08 -8.3719 0.35051E-08 -8.4553 0.82523E+00 -0.0834 36 CaCl+ 0.29932E-10 -10.5239 0.24701E-10 -10.6073 0.82523E+00 -0.0834 37 CaCl2,aq 0.53983E-14 -14.2677 0.53983E-14 -14.2677 0.10000E+01 0.0000 38 CaF+ 0.15822E-10 -10.8007 0.13057E-10 -10.8841 0.82523E+00 -0.0834 39 CaOH+ 0.17948E-08 -8.7460 0.14811E-08 -8.8294 0.82523E+00 -0.0834 40 CaSO4,aq 0.19851E-08 -8.7022 0.19851E-08 -8.7022 0.10000E+01 0.0000 41 HCl,aq 0.13458E-12 -12.8710 0.13458E-12 -12.8710 0.10000E+01 0.0000 45 HF,aq 0.29459E-09 -9.5308 0.29459E-09 -9.5308 0.10000E+01 0.0000 46 HF2- 0.65107E-14 -14.1864 0.53608E-14 -14.2708 0.82338E+00 -0.0844 48 FeCl+ 0.42915E-16 -16.3674 0.35415E-16 -16.4508 0.82523E+00 -0.0834 51 FeF+ 0.81180E-16 -16.0906 0.66992E-16 -16.1740 0.82523E+00 -0.0834 53 FeO,aq 0.14829E-11 -11.8289 0.14829E-11 -11.8289 0.10000E+01 0.0000 54 FeOH+ 0.12016E-11 -11.9202 0.99163E-12 -12.0036 0.82523E+00 -0.0834 55 HFeO2- 0.23602E-10 -10.6271 0.19433E-10 -10.7115 0.82338E+00 -0.0844 56 FeO+ 0.83792E-17 -17.0768 0.69148E-17 -17.1602 0.82523E+00 -0.0834 58 FeO2- 0.26956E-11 -11.5693 0.22195E-11 -11.6537 0.82338E+00 -0.0844 59 HFeO2,aq 0.22539E-12 -12.6471 0.22539E-12 -12.6471 0.10000E+01 0.0000 60 H2,aq 0.11774E-06 -6.9291 0.11700E-06 -6.9318 0.99372E+00 -0.0027 61 KCl,aq 0.21436E-08 -8.6689 0.21436E-08 -8.6689 0.10000E+01 0.0000 62 KHSO4,aq 0.10935E-15 -15.9612 0.10935E-15 -15.9612 0.10000E+01 0.0000 63 KOH,aq 0.68771E-07 -7.1626 0.68771E-07 -7.1626 0.10000E+01 0.0000 64 KSO4- 0.91290E-06 -6.0396 0.75167E-06 -6.1240 0.82338E+00 -0.0844 65 MgCO3,aq 0.45453E-10 -10.3424 0.45453E-10 -10.3424 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.41782E-11 -11.3790 0.34480E-11 -11.4624 0.82523E+00 -0.0834 67 MgCl+ 0.26118E-13 -13.5831 0.21553E-13 -13.6665 0.82523E+00 -0.0834 68 MgF+ 0.56427E-13 -13.2485 0.46565E-13 -13.3319 0.82523E+00 -0.0834 69 MgOH+ 0.95614E-11 -11.0195 0.78904E-11 -11.1029 0.82523E+00 -0.0834 71 MnF+ 0.32713E-12 -12.4853 0.26995E-12 -12.5687 0.82523E+00 -0.0834 72 MnO,aq 0.48307E-09 -9.3160 0.48307E-09 -9.3160 0.10000E+01 0.0000 73 MnOH+ 0.13647E-08 -8.8650 0.11262E-08 -8.9484 0.82523E+00 -0.0834 74 MnO2-2 0.51342E-13 -13.2895 0.25149E-13 -13.5995 0.48983E+00 -0.3100 75 HMnO2- 0.53427E-11 -11.2722 0.43991E-11 -11.3566 0.82338E+00 -0.0844 78 MnCl+ 0.20411E-11 -11.6901 0.16844E-11 -11.7736 0.82523E+00 -0.0834 79 MnSO4,aq 0.32342E-10 -10.4902 0.32342E-10 -10.4902 0.10000E+01 0.0000 80 NaCl,aq 0.54899E-05 -5.2604 0.54899E-05 -5.2604 0.10000E+01 0.0000 81 NaF,aq 0.22724E-06 -6.6435 0.22724E-06 -6.6435 0.10000E+01 0.0000 82 NaOH,aq 0.96908E-05 -5.0136 0.96908E-05 -5.0136 0.10000E+01 0.0000 84 OH- 0.88073E-03 -3.0552 0.72364E-03 -3.1405 0.82164E+00 -0.0853 89 HPO3-2 0.16738E-16 -16.7763 0.81988E-17 -17.0862 0.48983E+00 -0.3100 91 H2PO3- 0.15943E-19 -19.7974 0.13127E-19 -19.8818 0.82338E+00 -0.0844 92 H3PO4,aq 0.10025E-15 -15.9989 0.10025E-15 -15.9989 0.10000E+01 0.0000 93 H2PO4- 0.40178E-09 -9.3960 0.33119E-09 -9.4799 0.82430E+00 -0.0839 94 PO4-3 0.10675E-09 -9.9716 0.22978E-10 -10.6387 0.21525E+00 -0.6671 97 H2P2O7-2 0.17558E-19 -19.7555 0.86006E-20 -20.0655 0.48983E+00 -0.3100 98 HP2O7-3 0.10572E-16 -16.9758 0.21509E-17 -17.6674 0.20344E+00 -0.6916 99 P2O7-4 0.10434E-16 -16.9816 0.64357E-18 -18.1914 0.61681E-01 -1.2098 100 H2S,aq 0.66397E-05 -5.1779 0.65980E-05 -5.1806 0.99372E+00 -0.0027 101 S2-2 0.27641E-08 -8.5584 0.13539E-08 -8.8684 0.48983E+00 -0.3100 102 S3-2 0.21000E-12 -12.6778 0.10286E-12 -12.9877 0.48983E+00 -0.3100 103 S3- 0.19547E-15 -15.7089 0.16095E-15 -15.7933 0.82338E+00 -0.0844 104 S4-2 0.10539E-16 -16.9772 0.51624E-17 -17.2872 0.48983E+00 -0.3100 106 SO2,aq 0.12549E-18 -18.9014 0.12549E-18 -18.9014 0.10000E+01 0.0000 107 SO3-2 0.11499E-10 -10.9393 0.57282E-11 -11.2420 0.49816E+00 -0.3026 108 HSO3- 0.34778E-12 -12.4587 0.28636E-12 -12.5431 0.82338E+00 -0.0844 109 HSO4- 0.35087E-09 -9.4548 0.28989E-09 -9.5378 0.82618E+00 -0.0829 111 S2O3-2 0.59612E-10 -10.2247 0.29200E-10 -10.5346 0.48983E+00 -0.3100 112 HS2O3- 0.50627E-17 -17.2956 0.41685E-17 -17.3800 0.82338E+00 -0.0844 Charge balance for all species = -.6116E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9628407E-09 -.4528634E-02 -.4556780E+01 0.0000 2 H2O 0.1000000E+01 0.5550733E+02 0.9982698E+06 0.0000 3 Cl- 0.1117191E-02 0.1122683E-02 0.3973437E+02 6.0615 4 SO4-- 0.7672169E-03 0.7680461E-03 0.7365347E+02 14.7716 5 HCO3- 0.1003319E-01 0.1189587E-01 0.7246103E+03 7.0156 6 HS- 0.3246789E-02 0.3253520E-02 0.1074163E+03 6.5249 7 Al+++ 0.4265765E-25 0.1557227E-05 0.4194442E-01 1.2312 8 H4SiO4 0.1024625E-02 0.2828952E-02 0.2714406E+03 -2.9894 9 Ca++ 0.3408559E-07 0.2310643E-06 0.9244747E-02 10.4155 10 Mg++ 0.3299248E-10 0.9292529E-10 0.2255333E-05 7.3990 11 Fe++ 0.5017029E-13 0.2925753E-10 0.1631149E-05 4.5816 12 K+ 0.1558430E-03 0.1568268E-03 0.6121748E+01 5.2069 13 Na+ 0.2187634E-01 0.2224076E-01 0.5104356E+03 7.3532 14 Mn++ 0.6127595E-09 0.2500644E-08 0.1371453E-03 8.6688 15 F- 0.6561712E-04 0.6584467E-04 0.1248776E+01 4.8293 16 HPO4-- 0.4578371E-07 0.4629225E-07 0.4435480E-02 10.5474 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.4091717E-02 -.4078233E-02 -.1348386E-04 0.0000000E+00 2 H2O 0.4996757E+02 0.4998677E+02 -.1920414E-01 0.0000000E+00 3 Cl- 0.1011025E-02 0.1011025E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6916672E-03 0.6916590E-03 0.8141481E-08 0.0000000E+00 5 HCO3- 0.1071275E-01 0.1071275E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2929994E-02 0.2929937E-02 0.5699036E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1402351E-05 0.3373001E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.2547595E-02 0.9605425E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.2634768E-10 0.3256592E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002878E-01 0.3373001E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.5929600E-04 0.5929600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.902087E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1479900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3373E-05 -5.472 0.8845E-03 -3.053 0.1532 0.3395E-03 pyrite 0.3257E-07 -7.487 0.3907E-05 -5.408 0.6767E-03 0.7796E-06 quartz 0.9595E-02 -2.018 0.5765 -0.239 99.85 0.2177 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.577374 g Volume = 0.218046 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1479900 moles log = -0.8298 Original solution: 1000.0103000 g Original solution / Rock added: 6757.28 (Water/Rock Ratio), log = 3.8298 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0222 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9981E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1467E-02 1.0071 0.1510E-02 0.1500E-02 CH4,gas 0.8113E-04 1.0125 0.8397E-04 0.8294E-04 H2,gas 0.1502E-03 1.0005 0.1536E-03 0.1535E-03 H2S,gas 0.1781E-03 0.9960 0.1814E-03 0.1821E-03 S2,gas 0.5119E-19 1.0000 0.5233E-19 0.5233E-19 CO,gas 0.6049E-10 1.0000 0.6184E-10 0.6184E-10 SO3,gas 0.8883E-37 1.0000 0.9081E-37 0.9081E-37 SO2,gas 0.5309E-18 1.0000 0.5427E-18 0.5427E-18 HF,gas 0.7076E-12 1.0000 0.7233E-12 0.7233E-12 HCl,gas 0.2323E-15 1.0000 0.2375E-15 0.2375E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 -0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.18 -4.52 -1.507 0.77175E+04 -2.821 3 CH4,gas 4.54 -1.23 -5.77 -1.444 0.98604E+04 -4.076 4 H2,gas 8.00 2.49 -5.51 -3.150 0.94125E+04 -3.814 5 H2S,gas -6.23 -11.67 -5.44 -2.720 0.92893E+04 -3.741 6 S2,gas -7.34 -28.32 -20.98 -3.228 0.35823E+05 -19.281 7 CO,gas 3.21 -8.69 -11.91 -3.664 0.20332E+05 -10.209 8 SO3,gas 17.12 -21.62 -38.74 -9.685 0.66149E+05 -37.042 9 SO2,gas 0.83 -19.13 -19.96 -5.324 0.34089E+05 -18.265 10 HF,gas 0.47 -13.37 -13.84 -6.920 0.23631E+05 -12.141 11 HCl,gas 5.19 -12.13 -17.32 -8.662 0.29579E+05 -15.624 12 acmite 7.71 4.71 -3.00 -0.311 0.51180E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 20 spessartine 24.46 19.50 -4.96 -0.248 0.84636E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.82 -4.52 -0.377 0.77157E+04 38 aragonite 0.97 -0.76 -1.73 -0.577 0.29557E+04 40 calcite 0.81 -0.76 -1.58 -0.525 0.26915E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.88 -4.70 -0.313 0.80245E+04 45 celadonite 5.34 1.88 -3.46 -0.204 0.59117E+04 46 celadonite-Fe 3.88 -0.94 -4.81 -0.283 0.82208E+04 55 chloritoid-Mn 11.40 8.14 -3.26 -0.217 0.55652E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.22 -0.351 0.71980E+04 68 diaspore 2.87 1.23 -1.64 -0.274 0.28045E+04 69 diamond -3.10 -6.21 -3.10 -0.887 0.52986E+04 70 diopside 16.18 11.84 -4.35 -0.435 0.74203E+04 86 gibbsite 4.08 1.23 -2.85 -0.407 0.48631E+04 89 graphite -3.55 -6.21 -2.66 -0.760 0.45408E+04 94 heulandite -5.83 -8.05 -2.22 -0.101 0.37922E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.14 -0.591 0.70608E+04 101 kaolinite -1.33 -3.52 -2.18 -0.199 0.37286E+04 104 laumontite 2.88 0.92 -1.96 -0.131 0.33523E+04 105 lawsonite 9.62 6.90 -2.72 -0.181 0.46394E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62487E+04 109 magnesite 0.69 -3.78 -4.47 -1.491 0.76352E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.74613E+02 123 muscovite 2.58 -0.07 -2.65 -0.156 0.45252E+04 124 paragonite 4.24 2.08 -2.16 -0.127 0.36897E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.09 -2.83 -0.943 0.48300E+04 147 pyrrhotiteFe0.875 -6.02 -7.97 -1.95 -0.718 0.33351E+04 148 pyroxmangite 7.40 5.68 -1.72 -0.344 0.29356E+04 149 pyrophyllite -6.18 -9.50 -3.32 -0.207 0.56681E+04 154 rhodochrosite -0.98 -2.51 -1.53 -0.512 0.26207E+04 155 rhodonite 7.45 5.68 -1.77 -0.353 0.30159E+04 156 sanidine -1.28 -2.53 -1.25 -0.097 0.21424E+04 158 siderite -2.61 -6.60 -3.99 -1.330 0.68133E+04 166 stilbite -7.52 -8.05 -0.53 -0.025 0.89839E+03 177 tephroite 18.09 14.35 -3.74 -0.534 0.63818E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.09 -2.68 -0.893 0.45728E+04 190 wairakite 3.95 0.92 -3.03 -0.178 0.51743E+04 191 walstromite 11.51 7.43 -4.08 -0.817 0.69720E+04 192 wollastonite 10.46 7.43 -3.04 -0.607 0.51824E+04 193 pseudo-wollastonite 11.00 7.43 -3.57 -0.715 0.61022E+04 195 akaganeite 7.75 3.34 -4.42 -0.955 0.75413E+04 196 beidellite-Ca -1.65 -6.38 -4.74 -0.293 0.80907E+04 198 beidellite-K -1.52 -6.38 -4.86 -0.298 0.83052E+04 200 beidellite-Na -1.34 -5.68 -4.33 -0.265 0.73998E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.60 -4.28 -0.535 0.73035E+04 204 montmorillonite-Ca -2.29 -5.74 -3.45 -0.213 0.58920E+04 205 montmorillonite-K -2.24 -5.74 -3.50 -0.215 0.59847E+04 206 montmorillonite-Mg -2.48 -6.24 -3.76 -0.233 0.64189E+04 207 montmorillonite-Na -2.04 -5.03 -3.00 -0.183 0.51149E+04 212 nontronite-Na 3.52 -1.46 -4.98 -0.320 0.85069E+04 228 tobermorite 9.82 5.69 -4.14 -1.129 0.70628E+04 234 alabandite -0.98 -3.00 -2.02 -0.675 0.34558E+04 237 boehmite 4.41 1.23 -3.18 -0.529 0.54215E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.07 -0.95 -0.073 0.16137E+04 248 an25ab75 2.65 1.44 -1.21 -0.093 0.20641E+04 249 an30ab70 3.28 1.80 -1.48 -0.114 0.25241E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1479900 MOLES New total amount of reactant added: 0.1519900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1519900 Water: Moles liquid = 0.4999E+02 kg liquid = 0.9006E+00 Moles total = 0.4997E+02 kg total = 0.9002E+00 Activity = 1.0000 Stoichiometric ionic strength = .2117054E-01 Osmotic coef. = 0.9173 True ionic strength = .2456073E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1035E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.10950E-08 -8.9606 0.90821E-09 -9.0418 0.82943E+00 -0.0812 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.11432E-02 -2.9419 0.94150E-03 -3.0262 0.82359E+00 -0.0843 4 SO4-- 0.78835E-03 -3.1033 0.38750E-03 -3.4117 0.49153E+00 -0.3084 5 HCO3- 0.10500E-01 -1.9788 0.86624E-02 -2.0624 0.82500E+00 -0.0835 6 HS- 0.33322E-02 -2.4773 0.27448E-02 -2.5615 0.82373E+00 -0.0842 7 Al+++ 0.71108E-25 -25.1481 0.14481E-25 -25.8392 0.20364E+00 -0.6911 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.36428E-07 -7.4386 0.17751E-07 -7.7508 0.48729E+00 -0.3122 10 Mg++ 0.34712E-10 -10.4595 0.16824E-10 -10.7741 0.48468E+00 -0.3145 11 Fe++ 0.46031E-13 -13.3370 0.22339E-13 -13.6509 0.48530E+00 -0.3140 12 K+ 0.15581E-03 -3.8074 0.12858E-03 -3.8908 0.82522E+00 -0.0834 13 Na+ 0.21917E-01 -1.6592 0.18047E-01 -1.7436 0.82340E+00 -0.0844 14 Mn++ 0.68815E-09 -9.1623 0.33429E-09 -9.4759 0.48577E+00 -0.3136 15 F- 0.67382E-04 -4.1715 0.55362E-04 -4.2568 0.82161E+00 -0.0853 16 HPO4-- 0.45738E-07 -7.3397 0.22486E-07 -7.6481 0.49162E+00 -0.3084 18 HSiO3- 0.12791E-02 -2.8931 0.10534E-02 -2.9774 0.82359E+00 -0.0843 19 Ca(HSiO3)+ 0.51592E-09 -9.2874 0.42585E-09 -9.3707 0.82543E+00 -0.0833 20 Mg(HSiO3)+ 0.60855E-12 -12.2157 0.50232E-12 -12.2990 0.82543E+00 -0.0833 21 NaHSiO3,aq 0.30747E-03 -3.5122 0.30747E-03 -3.5122 0.10000E+01 0.0000 22 AlO+ 0.28934E-14 -14.5386 0.23883E-14 -14.6219 0.82543E+00 -0.0833 23 AlOH+2 0.22209E-19 -19.6535 0.10801E-19 -19.9665 0.48633E+00 -0.3131 24 HAlO2,aq 0.52369E-09 -9.2809 0.52369E-09 -9.2809 0.10000E+01 0.0000 25 AlO2- 0.15531E-05 -5.8088 0.12764E-05 -5.8940 0.82185E+00 -0.0852 26 CH4,aq 0.59984E-07 -7.2220 0.59603E-07 -7.2247 0.99364E+00 -0.0028 27 C2H6,aq 0.53975E-17 -17.2678 0.53631E-17 -17.2706 0.99364E+00 -0.0028 31 CO,aq 0.47820E-13 -13.3204 0.47820E-13 -13.3204 0.10000E+01 0.0000 32 CO2,aq 0.16918E-04 -4.7716 0.16811E-04 -4.7744 0.99364E+00 -0.0028 33 CO3-2 0.16991E-02 -2.7698 0.83309E-03 -3.0793 0.49031E+00 -0.3095 34 CaCO3,aq 0.18543E-06 -6.7318 0.18543E-06 -6.7318 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.47551E-08 -8.3228 0.39250E-08 -8.4062 0.82543E+00 -0.0833 36 CaCl+ 0.32766E-10 -10.4846 0.27046E-10 -10.5679 0.82543E+00 -0.0833 37 CaCl2,aq 0.60497E-14 -14.2183 0.60497E-14 -14.2183 0.10000E+01 0.0000 38 CaF+ 0.17382E-10 -10.7599 0.14348E-10 -10.8432 0.82543E+00 -0.0833 39 CaOH+ 0.16875E-08 -8.7727 0.13930E-08 -8.8561 0.82543E+00 -0.0833 40 CaSO4,aq 0.21842E-08 -8.6607 0.21842E-08 -8.6607 0.10000E+01 0.0000 41 HCl,aq 0.15669E-12 -12.8050 0.15669E-12 -12.8050 0.10000E+01 0.0000 45 HF,aq 0.34420E-09 -9.4632 0.34420E-09 -9.4632 0.10000E+01 0.0000 46 HF2- 0.78118E-14 -14.1072 0.64337E-14 -14.1915 0.82359E+00 -0.0843 48 FeCl+ 0.40331E-16 -16.3944 0.33290E-16 -16.4777 0.82543E+00 -0.0833 51 FeF+ 0.76564E-16 -16.1160 0.63198E-16 -16.1993 0.82543E+00 -0.0833 53 FeO,aq 0.10526E-11 -11.9778 0.10526E-11 -11.9778 0.10000E+01 0.0000 54 FeOH+ 0.96996E-12 -12.0132 0.80064E-12 -12.0966 0.82543E+00 -0.0833 55 HFeO2- 0.14724E-10 -10.8320 0.12126E-10 -10.9163 0.82359E+00 -0.0843 56 FeO+ 0.68752E-17 -17.1627 0.56750E-17 -17.2460 0.82543E+00 -0.0833 58 FeO2- 0.17093E-11 -11.7672 0.14078E-11 -11.8515 0.82359E+00 -0.0843 59 HFeO2,aq 0.16261E-12 -12.7888 0.16261E-12 -12.7888 0.10000E+01 0.0000 60 H2,aq 0.11396E-06 -6.9432 0.11324E-06 -6.9460 0.99364E+00 -0.0028 61 KCl,aq 0.21941E-08 -8.6587 0.21941E-08 -8.6587 0.10000E+01 0.0000 62 KHSO4,aq 0.12794E-15 -15.8930 0.12794E-15 -15.8930 0.10000E+01 0.0000 63 KOH,aq 0.60461E-07 -7.2185 0.60461E-07 -7.2185 0.10000E+01 0.0000 64 KSO4- 0.93878E-06 -6.0274 0.77317E-06 -6.1117 0.82359E+00 -0.0843 65 MgCO3,aq 0.44053E-10 -10.3560 0.44053E-10 -10.3560 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.46052E-11 -11.3367 0.38013E-11 -11.4201 0.82543E+00 -0.0833 67 MgCl+ 0.28147E-13 -13.5506 0.23234E-13 -13.6339 0.82543E+00 -0.0833 68 MgF+ 0.61028E-13 -13.2145 0.50375E-13 -13.2978 0.82543E+00 -0.0833 69 MgOH+ 0.88506E-11 -11.0530 0.73056E-11 -11.1363 0.82543E+00 -0.0833 71 MnF+ 0.37764E-12 -12.4229 0.31172E-12 -12.5062 0.82543E+00 -0.0833 72 MnO,aq 0.41969E-09 -9.3771 0.41969E-09 -9.3771 0.10000E+01 0.0000 73 MnOH+ 0.13484E-08 -8.8702 0.11130E-08 -8.9535 0.82543E+00 -0.0833 74 MnO2-2 0.34439E-13 -13.4629 0.16886E-13 -13.7725 0.49031E+00 -0.3095 75 HMnO2- 0.40796E-11 -11.3894 0.33599E-11 -11.4737 0.82359E+00 -0.0843 78 MnCl+ 0.23480E-11 -11.6293 0.19381E-11 -11.7126 0.82543E+00 -0.0833 79 MnSO4,aq 0.37396E-10 -10.4272 0.37396E-10 -10.4272 0.10000E+01 0.0000 80 NaCl,aq 0.56309E-05 -5.2494 0.56309E-05 -5.2494 0.10000E+01 0.0000 81 NaF,aq 0.23391E-06 -6.6310 0.23391E-06 -6.6310 0.10000E+01 0.0000 82 NaOH,aq 0.85374E-05 -5.0687 0.85374E-05 -5.0687 0.10000E+01 0.0000 84 OH- 0.77406E-03 -3.1112 0.63616E-03 -3.1964 0.82185E+00 -0.0852 89 HPO3-2 0.16184E-16 -16.7909 0.79350E-17 -17.1005 0.49031E+00 -0.3095 91 H2PO3- 0.17547E-19 -19.7558 0.14452E-19 -19.8401 0.82359E+00 -0.0843 92 H3PO4,aq 0.12972E-15 -15.8870 0.12972E-15 -15.8870 0.10000E+01 0.0000 93 H2PO4- 0.45692E-09 -9.3402 0.37673E-09 -9.4240 0.82450E+00 -0.0838 94 PO4-3 0.93647E-10 -10.0285 0.20200E-10 -10.6946 0.21570E+00 -0.6661 97 H2P2O7-2 0.22696E-19 -19.6440 0.11128E-19 -19.9536 0.49031E+00 -0.3095 98 HP2O7-3 0.11999E-16 -16.9209 0.24466E-17 -17.6114 0.20390E+00 -0.6906 99 P2O7-4 0.10393E-16 -16.9833 0.64356E-18 -18.1914 0.61923E-01 -1.2081 100 H2S,aq 0.77538E-05 -5.1105 0.77045E-05 -5.1133 0.99364E+00 -0.0028 101 S2-2 0.30066E-08 -8.5219 0.14742E-08 -8.8314 0.49031E+00 -0.3095 102 S3-2 0.27560E-12 -12.5597 0.13513E-12 -12.8692 0.49031E+00 -0.3095 103 S3- 0.29684E-15 -15.5275 0.24447E-15 -15.6118 0.82359E+00 -0.0843 104 S4-2 0.16688E-16 -16.7776 0.81823E-17 -17.0871 0.49031E+00 -0.3095 106 SO2,aq 0.16164E-18 -18.7914 0.16164E-18 -18.7914 0.10000E+01 0.0000 107 SO3-2 0.11436E-10 -10.9417 0.57022E-11 -11.2440 0.49862E+00 -0.3022 108 HSO3- 0.39371E-12 -12.4048 0.32426E-12 -12.4891 0.82359E+00 -0.0843 109 HSO4- 0.41042E-09 -9.3868 0.33916E-09 -9.4696 0.82638E+00 -0.0828 111 S2O3-2 0.71526E-10 -10.1455 0.35070E-10 -10.4551 0.49031E+00 -0.3095 112 HS2O3- 0.69149E-17 -17.1602 0.56950E-17 -17.2445 0.82359E+00 -0.0843 Charge balance for all species = -.6115E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1094992E-08 -.4050064E-02 -.4075208E+01 0.0000 2 H2O 0.1000000E+01 0.5550743E+02 0.9982650E+06 0.0000 3 Cl- 0.1143174E-02 0.1148807E-02 0.4065869E+02 6.0156 4 SO4-- 0.7883453E-03 0.7891991E-03 0.7568147E+02 14.6719 5 HCO3- 0.1049986E-01 0.1221613E-01 0.7441135E+03 6.9794 6 HS- 0.3332160E-02 0.3340007E-02 0.1102709E+03 6.4803 7 Al+++ 0.7110824E-25 0.1553603E-05 0.4184653E-01 1.2862 8 H4SiO4 0.1024624E-02 0.2611167E-02 0.2505422E+03 -2.9894 9 Ca++ 0.3642775E-07 0.2310478E-06 0.9244024E-02 10.3328 10 Mg++ 0.3471248E-10 0.9291865E-10 0.2255157E-05 7.3096 11 Fe++ 0.4603082E-13 0.1866417E-10 0.1040547E-05 4.4327 12 K+ 0.1558142E-03 0.1568156E-03 0.6121269E+01 5.1510 13 Na+ 0.2191729E-01 0.2223917E-01 0.5103956E+03 7.2982 14 Mn++ 0.6881515E-09 0.2500465E-08 0.1371345E-03 8.6077 15 F- 0.6738227E-04 0.6761654E-04 0.1282372E+01 4.7850 16 HPO4-- 0.4573838E-07 0.4628894E-07 0.4435133E-02 10.4355 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.3661017E-02 -.3647520E-02 -.1349651E-04 0.0000000E+00 2 H2O 0.4997084E+02 0.4999044E+02 -.1959604E-01 0.0000000E+00 3 Cl- 0.1034625E-02 0.1034625E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7107672E-03 0.7107590E-03 0.8143865E-08 0.0000000E+00 5 HCO3- 0.1100195E-01 0.1100195E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3008094E-02 0.3008037E-02 0.5700706E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1399188E-05 0.3376164E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.2351638E-02 0.9801382E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1680910E-10 0.3257546E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002877E-01 0.3376164E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6089600E-04 0.6089600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2118E-20 Mass of aqueous solution: 0.902158E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1519900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3376E-05 -5.472 0.8853E-03 -3.053 0.1503 0.3398E-03 pyrite 0.3258E-07 -7.487 0.3908E-05 -5.408 0.6634E-03 0.7798E-06 quartz 0.9791E-02 -2.009 0.5883 -0.230 99.85 0.2222 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.589148 g Volume = 0.222493 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1519900 moles log = -0.8182 Original solution: 1000.0103000 g Original solution / Rock added: 6579.45 (Water/Rock Ratio), log = 3.8182 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0226 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9978E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.1747E-02 1.0071 0.1799E-02 0.1786E-02 CH4,gas 0.8474E-04 1.0125 0.8773E-04 0.8665E-04 H2,gas 0.1453E-03 1.0005 0.1487E-03 0.1486E-03 H2S,gas 0.2079E-03 0.9960 0.2118E-03 0.2126E-03 S2,gas 0.7450E-19 1.0000 0.7618E-19 0.7618E-19 CO,gas 0.6969E-10 1.0000 0.7126E-10 0.7126E-10 SO3,gas 0.1182E-36 1.0000 0.1209E-36 0.1209E-36 SO2,gas 0.6836E-18 1.0000 0.6990E-18 0.6990E-18 HF,gas 0.8265E-12 1.0000 0.8451E-12 0.8451E-12 HCl,gas 0.2704E-15 1.0000 0.2765E-15 0.2765E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.13080E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.10 -4.44 -1.481 0.75881E+04 -2.745 3 CH4,gas 4.54 -1.21 -5.76 -1.439 0.98279E+04 -4.057 4 H2,gas 8.00 2.47 -5.53 -3.158 0.94368E+04 -3.828 5 H2S,gas -6.23 -11.60 -5.37 -2.687 0.91744E+04 -3.674 6 S2,gas -7.34 -28.15 -20.82 -3.203 0.35545E+05 -19.118 7 CO,gas 3.21 -8.63 -11.85 -3.645 0.20227E+05 -10.147 8 SO3,gas 17.12 -21.50 -38.62 -9.654 0.65937E+05 -36.918 9 SO2,gas 0.83 -19.02 -19.85 -5.295 0.33901E+05 -18.156 10 HF,gas 0.47 -13.30 -13.77 -6.886 0.23515E+05 -12.073 11 HCl,gas 5.19 -12.07 -17.26 -8.629 0.29466E+05 -15.558 12 acmite 7.71 4.52 -3.19 -0.332 0.54540E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.83 -4.53 -0.377 0.77324E+04 38 aragonite 0.97 -0.77 -1.74 -0.579 0.29673E+04 40 calcite 0.81 -0.77 -1.58 -0.528 0.27031E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.90 -4.68 -0.312 0.79892E+04 45 celadonite 5.34 1.79 -3.55 -0.209 0.60659E+04 46 celadonite-Fe 3.88 -1.09 -4.96 -0.292 0.84765E+04 55 chloritoid-Mn 11.40 8.19 -3.21 -0.214 0.54815E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.22 -0.351 0.71995E+04 68 diaspore 2.87 1.29 -1.59 -0.265 0.27106E+04 69 diamond -3.10 -6.16 -3.06 -0.873 0.52176E+04 70 diopside 16.18 11.66 -4.52 -0.452 0.77141E+04 86 gibbsite 4.08 1.29 -2.79 -0.399 0.47691E+04 89 graphite -3.55 -6.16 -2.61 -0.746 0.44599E+04 94 heulandite -5.83 -8.02 -2.19 -0.100 0.37453E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.14 -0.591 0.70623E+04 101 kaolinite -1.33 -3.41 -2.07 -0.189 0.35407E+04 104 laumontite 2.88 0.95 -1.94 -0.129 0.33054E+04 105 lawsonite 9.62 6.93 -2.69 -0.179 0.45925E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62502E+04 109 magnesite 0.69 -3.79 -4.49 -1.495 0.76584E+04 119 microcline -2.49 -2.53 -0.04 -0.003 0.76141E+02 123 muscovite 2.58 0.04 -2.54 -0.149 0.43388E+04 124 paragonite 4.24 2.19 -2.05 -0.121 0.35018E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.17 -2.91 -0.970 0.49693E+04 147 pyrrhotiteFe0.875 -6.02 -8.03 -2.01 -0.741 0.34395E+04 148 pyroxmangite 7.40 5.62 -1.78 -0.356 0.30399E+04 149 pyrophyllite -6.18 -9.39 -3.21 -0.201 0.54801E+04 154 rhodochrosite -0.98 -2.50 -1.52 -0.507 0.25955E+04 155 rhodonite 7.45 5.62 -1.83 -0.365 0.31202E+04 156 sanidine -1.28 -2.53 -1.26 -0.097 0.21439E+04 158 siderite -2.61 -6.67 -4.06 -1.354 0.69381E+04 166 stilbite -7.52 -8.02 -0.50 -0.024 0.85151E+03 172 sulfur -9.15 -14.08 -4.92 -1.515 0.84076E+04 177 tephroite 18.09 14.23 -3.86 -0.551 0.65904E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.17 -2.76 -0.920 0.47121E+04 190 wairakite 3.95 0.95 -3.00 -0.177 0.51274E+04 191 walstromite 11.51 7.34 -4.17 -0.833 0.71130E+04 192 wollastonite 10.46 7.34 -3.12 -0.624 0.53235E+04 193 pseudo-wollastonite 11.00 7.34 -3.66 -0.731 0.62433E+04 195 akaganeite 7.75 3.20 -4.56 -0.986 0.77834E+04 196 beidellite-Ca -1.65 -6.27 -4.62 -0.286 0.78950E+04 198 beidellite-K -1.52 -6.27 -4.75 -0.291 0.81178E+04 199 beidellite-Mg -1.79 -6.77 -4.98 -0.308 0.85006E+04 200 beidellite-Na -1.34 -5.57 -4.22 -0.259 0.72118E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.52 -4.20 -0.525 0.71740E+04 204 montmorillonite-Ca -2.29 -5.69 -3.40 -0.210 0.58087E+04 205 montmorillonite-K -2.24 -5.70 -3.46 -0.212 0.59096E+04 206 montmorillonite-Mg -2.48 -6.19 -3.71 -0.230 0.63375E+04 207 montmorillonite-Na -2.04 -4.99 -2.95 -0.181 0.50394E+04 228 tobermorite 9.82 5.62 -4.21 -1.147 0.71803E+04 234 alabandite -0.98 -3.00 -2.02 -0.673 0.34452E+04 237 boehmite 4.41 1.29 -3.12 -0.520 0.53275E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.08 -0.94 -0.072 0.16043E+04 248 an25ab75 2.65 1.44 -1.20 -0.092 0.20524E+04 249 an30ab70 3.28 1.81 -1.47 -0.113 0.25100E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1519900 MOLES New total amount of reactant added: 0.1559900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1559900 Water: Moles liquid = 0.4999E+02 kg liquid = 0.9007E+00 Moles total = 0.4997E+02 kg total = 0.9003E+00 Activity = 1.0000 Stoichiometric ionic strength = .2142928E-01 Osmotic coef. = 0.9169 True ionic strength = .2446177E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1058E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.12620E-08 -8.8990 0.10470E-08 -8.9801 0.82964E+00 -0.0811 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.11692E-02 -2.9321 0.96317E-03 -3.0163 0.82382E+00 -0.0842 4 SO4-- 0.80947E-03 -3.0918 0.39833E-03 -3.3998 0.49208E+00 -0.3080 5 HCO3- 0.10976E-01 -1.9595 0.90579E-02 -2.0430 0.82523E+00 -0.0834 6 HS- 0.34172E-02 -2.4663 0.28156E-02 -2.5504 0.82396E+00 -0.0841 7 Al+++ 0.12500E-24 -24.9031 0.25521E-25 -25.5931 0.20417E+00 -0.6900 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.39326E-07 -7.4053 0.19185E-07 -7.7170 0.48785E+00 -0.3117 10 Mg++ 0.36716E-10 -10.4351 0.17816E-10 -10.7492 0.48524E+00 -0.3140 11 Fe++ 0.42145E-13 -13.3753 0.20477E-13 -13.6887 0.48586E+00 -0.3135 12 K+ 0.15578E-03 -3.8075 0.12859E-03 -3.8908 0.82545E+00 -0.0833 13 Na+ 0.21957E-01 -1.6584 0.18084E-01 -1.7427 0.82364E+00 -0.0843 14 Mn++ 0.77539E-09 -9.1105 0.37710E-09 -9.4235 0.48633E+00 -0.3131 15 F- 0.69147E-04 -4.1602 0.56828E-04 -4.2454 0.82184E+00 -0.0852 16 HPO4-- 0.45678E-07 -7.3403 0.22481E-07 -7.6482 0.49216E+00 -0.3079 18 HSiO3- 0.11092E-02 -2.9550 0.91380E-03 -3.0391 0.82382E+00 -0.0842 19 Ca(HSiO3)+ 0.48356E-09 -9.3155 0.39926E-09 -9.3987 0.82566E+00 -0.0832 20 Mg(HSiO3)+ 0.55886E-12 -12.2527 0.46143E-12 -12.3359 0.82566E+00 -0.0832 21 NaHSiO3,aq 0.26728E-03 -3.5730 0.26728E-03 -3.5730 0.10000E+01 0.0000 22 AlO+ 0.38361E-14 -14.4161 0.31673E-14 -14.4993 0.82566E+00 -0.0832 23 AlOH+2 0.33914E-19 -19.4696 0.16512E-19 -19.7822 0.48689E+00 -0.3126 24 HAlO2,aq 0.60245E-09 -9.2201 0.60245E-09 -9.2201 0.10000E+01 0.0000 25 AlO2- 0.15494E-05 -5.8098 0.12737E-05 -5.8949 0.82209E+00 -0.0851 26 CH4,aq 0.62598E-07 -7.2034 0.62195E-07 -7.2062 0.99357E+00 -0.0028 27 C2H6,aq 0.60935E-17 -17.2151 0.60543E-17 -17.2179 0.99357E+00 -0.0028 31 CO,aq 0.55602E-13 -13.2549 0.55602E-13 -13.2549 0.10000E+01 0.0000 32 CO2,aq 0.20395E-04 -4.6905 0.20264E-04 -4.6933 0.99357E+00 -0.0028 33 CO3-2 0.15395E-02 -2.8126 0.75567E-03 -3.1217 0.49086E+00 -0.3090 34 CaCO3,aq 0.18179E-06 -6.7404 0.18179E-06 -6.7404 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.53725E-08 -8.2698 0.44359E-08 -8.3530 0.82566E+00 -0.0832 36 CaCl+ 0.36219E-10 -10.4411 0.29904E-10 -10.5243 0.82566E+00 -0.0832 37 CaCl2,aq 0.68430E-14 -14.1648 0.68430E-14 -14.1648 0.10000E+01 0.0000 38 CaF+ 0.19279E-10 -10.7149 0.15918E-10 -10.7981 0.82566E+00 -0.0832 39 CaOH+ 0.15817E-08 -8.8009 0.13060E-08 -8.8841 0.82566E+00 -0.0832 40 CaSO4,aq 0.24267E-08 -8.6150 0.24267E-08 -8.6150 0.10000E+01 0.0000 41 HCl,aq 0.18479E-12 -12.7333 0.18479E-12 -12.7333 0.10000E+01 0.0000 45 HF,aq 0.40731E-09 -9.3901 0.40731E-09 -9.3901 0.10000E+01 0.0000 46 HF2- 0.94861E-14 -14.0229 0.78148E-14 -14.1071 0.82382E+00 -0.0842 48 FeCl+ 0.37809E-16 -16.4224 0.31218E-16 -16.5056 0.82566E+00 -0.0832 51 FeF+ 0.72021E-16 -16.1425 0.59465E-16 -16.2257 0.82566E+00 -0.0832 53 FeO,aq 0.72601E-12 -12.1391 0.72601E-12 -12.1391 0.10000E+01 0.0000 54 FeOH+ 0.77105E-12 -12.1129 0.63663E-12 -12.1961 0.82566E+00 -0.0832 55 HFeO2- 0.88071E-11 -11.0552 0.72555E-11 -11.1393 0.82382E+00 -0.0842 56 FeO+ 0.55647E-17 -17.2546 0.45946E-17 -17.3378 0.82566E+00 -0.0832 58 FeO2- 0.10411E-11 -11.9825 0.85766E-12 -12.0667 0.82382E+00 -0.0842 59 HFeO2,aq 0.11421E-12 -12.9423 0.11421E-12 -12.9423 0.10000E+01 0.0000 60 H2,aq 0.10993E-06 -6.9589 0.10923E-06 -6.9617 0.99357E+00 -0.0028 61 KCl,aq 0.22448E-08 -8.6488 0.22448E-08 -8.6488 0.10000E+01 0.0000 62 KHSO4,aq 0.15163E-15 -15.8192 0.15163E-15 -15.8192 0.10000E+01 0.0000 63 KOH,aq 0.52452E-07 -7.2802 0.52452E-07 -7.2802 0.10000E+01 0.0000 64 KSO4- 0.96482E-06 -6.0156 0.79484E-06 -6.0997 0.82382E+00 -0.0842 65 MgCO3,aq 0.42314E-10 -10.3735 0.42314E-10 -10.3735 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.50980E-11 -11.2926 0.42092E-11 -11.3758 0.82566E+00 -0.0832 67 MgCl+ 0.30484E-13 -13.5159 0.25170E-13 -13.5991 0.82566E+00 -0.0832 68 MgF+ 0.66320E-13 -13.1784 0.54757E-13 -13.2616 0.82566E+00 -0.0832 69 MgOH+ 0.81279E-11 -11.0900 0.67109E-11 -11.1732 0.82566E+00 -0.0832 71 MnF+ 0.43717E-12 -12.3593 0.36095E-12 -12.4425 0.82566E+00 -0.0832 72 MnO,aq 0.35626E-09 -9.4482 0.35626E-09 -9.4482 0.10000E+01 0.0000 73 MnOH+ 0.13191E-08 -8.8797 0.10891E-08 -8.9629 0.82566E+00 -0.0832 74 MnO2-2 0.21973E-13 -13.6581 0.10786E-13 -13.9671 0.49086E+00 -0.3090 75 HMnO2- 0.30032E-11 -11.5224 0.24741E-11 -11.6066 0.82382E+00 -0.0842 78 MnCl+ 0.27089E-11 -11.5672 0.22366E-11 -11.6504 0.82566E+00 -0.0832 79 MnSO4,aq 0.43364E-10 -10.3629 0.43364E-10 -10.3629 0.10000E+01 0.0000 80 NaCl,aq 0.57725E-05 -5.2386 0.57725E-05 -5.2386 0.10000E+01 0.0000 81 NaF,aq 0.24060E-06 -6.6187 0.24060E-06 -6.6187 0.10000E+01 0.0000 82 NaOH,aq 0.74213E-05 -5.1295 0.74213E-05 -5.1295 0.10000E+01 0.0000 84 OH- 0.67127E-03 -3.1731 0.55185E-03 -3.2582 0.82209E+00 -0.0851 89 HPO3-2 0.15590E-16 -16.8072 0.76524E-17 -17.1162 0.49086E+00 -0.3090 91 H2PO3- 0.19502E-19 -19.7099 0.16066E-19 -19.7941 0.82382E+00 -0.0842 92 H3PO4,aq 0.17235E-15 -15.7636 0.17235E-15 -15.7636 0.10000E+01 0.0000 93 H2PO4- 0.52648E-09 -9.2786 0.43420E-09 -9.3623 0.82473E+00 -0.0837 94 PO4-3 0.81025E-10 -10.0914 0.17519E-10 -10.7565 0.21622E+00 -0.6651 97 H2P2O7-2 0.30116E-19 -19.5212 0.14783E-19 -19.8302 0.49086E+00 -0.3090 98 HP2O7-3 0.13791E-16 -16.8604 0.28193E-17 -17.5499 0.20442E+00 -0.6895 99 P2O7-4 0.10342E-16 -16.9854 0.64330E-18 -18.1916 0.62200E-01 -1.2062 100 H2S,aq 0.91700E-05 -5.0376 0.91110E-05 -5.0404 0.99357E+00 -0.0028 101 S2-2 0.32764E-08 -8.4846 0.16083E-08 -8.7936 0.49086E+00 -0.3090 102 S3-2 0.36820E-12 -12.4339 0.18073E-12 -12.7430 0.49086E+00 -0.3090 103 S3- 0.46587E-15 -15.3317 0.38379E-15 -15.4159 0.82382E+00 -0.0842 104 S4-2 0.27333E-16 -16.5633 0.13417E-16 -16.8724 0.49086E+00 -0.3090 106 SO2,aq 0.21299E-18 -18.6716 0.21299E-18 -18.6716 0.10000E+01 0.0000 107 SO3-2 0.11327E-10 -10.9459 0.56539E-11 -11.2477 0.49916E+00 -0.3018 108 HSO3- 0.44990E-12 -12.3469 0.37064E-12 -12.4311 0.82382E+00 -0.0842 109 HSO4- 0.48622E-09 -9.3132 0.40191E-09 -9.3959 0.82660E+00 -0.0827 111 S2O3-2 0.86849E-10 -10.0612 0.42631E-10 -10.3703 0.49086E+00 -0.3090 112 HS2O3- 0.96873E-17 -17.0138 0.79806E-17 -17.0980 0.82382E+00 -0.0842 Charge balance for all species = -.6115E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1261971E-08 -.3571563E-02 -.3593710E+01 0.0000 2 H2O 0.1000000E+01 0.5550754E+02 0.9982593E+06 0.0000 3 Cl- 0.1169154E-02 0.1174928E-02 0.4158285E+02 5.9638 4 SO4-- 0.8094707E-03 0.8103493E-03 0.7770912E+02 14.5604 5 HCO3- 0.1097624E-01 0.1253636E-01 0.7636134E+03 6.9371 6 HS- 0.3417216E-02 0.3426482E-02 0.1131251E+03 6.4296 7 Al+++ 0.1249985E-24 0.1549999E-05 0.4174912E-01 1.3471 8 H4SiO4 0.1024624E-02 0.2401128E-02 0.2303872E+03 -2.9894 9 Ca++ 0.3932623E-07 0.2310313E-06 0.9243296E-02 10.2431 10 Mg++ 0.3671624E-10 0.9291203E-10 0.2254979E-05 7.2109 11 Fe++ 0.4214501E-13 0.1150174E-10 0.6412294E-06 4.2714 12 K+ 0.1557849E-03 0.1568044E-03 0.6120787E+01 5.0893 13 Na+ 0.2195687E-01 0.2223758E-01 0.5103554E+03 7.2374 14 Mn++ 0.7753891E-09 0.2500287E-08 0.1371237E-03 8.5366 15 F- 0.6914715E-04 0.6938818E-04 0.1315962E+01 4.7346 16 HPO4-- 0.4567814E-07 0.4628564E-07 0.4434784E-02 10.3119 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.3230317E-02 -.3216808E-02 -.1350910E-04 0.0000000E+00 2 H2O 0.4997412E+02 0.4999409E+02 -.1997406E-01 0.0000000E+00 3 Cl- 0.1058225E-02 0.1058225E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7298672E-03 0.7298590E-03 0.8145478E-08 0.0000000E+00 5 HCO3- 0.1129115E-01 0.1129115E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3086194E-02 0.3086137E-02 0.5701834E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1396041E-05 0.3379311E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.2162629E-02 0.9990391E-02 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1035930E-10 0.3258191E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002877E-01 0.3379311E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6249600E-04 0.6249600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.902229E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1559900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3379E-05 -5.471 0.8861E-03 -3.053 0.1476 0.3402E-03 pyrite 0.3258E-07 -7.487 0.3909E-05 -5.408 0.6510E-03 0.7800E-06 quartz 0.9980E-02 -2.001 0.5996 -0.222 99.85 0.2264 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.600504 g Volume = 0.226781 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1559900 moles log = -0.8069 Original solution: 1000.0103000 g Original solution / Rock added: 6410.73 (Water/Rock Ratio), log = 3.8069 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0230 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9974E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.2104E-02 1.0071 0.2168E-02 0.2153E-02 CH4,gas 0.8839E-04 1.0125 0.9155E-04 0.9042E-04 H2,gas 0.1401E-03 1.0005 0.1434E-03 0.1433E-03 H2S,gas 0.2458E-03 0.9960 0.2505E-03 0.2515E-03 S2,gas 0.1119E-18 1.0000 0.1145E-18 0.1145E-18 CO,gas 0.8100E-10 1.0000 0.8286E-10 0.8286E-10 SO3,gas 0.1614E-36 1.0000 0.1651E-36 0.1651E-36 SO2,gas 0.9004E-18 1.0000 0.9211E-18 0.9211E-18 HF,gas 0.9776E-12 1.0000 0.1000E-11 0.1000E-11 HCl,gas 0.3187E-15 1.0000 0.3261E-15 0.3261E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -11.02 -4.36 -1.454 0.74495E+04 -2.664 3 CH4,gas 4.54 -1.19 -5.74 -1.434 0.97963E+04 -4.038 4 H2,gas 8.00 2.46 -5.54 -3.167 0.94635E+04 -3.843 5 H2S,gas -6.23 -11.53 -5.30 -2.650 0.90500E+04 -3.601 6 S2,gas -7.34 -27.98 -20.64 -3.175 0.35243E+05 -18.941 7 CO,gas 3.21 -8.57 -11.78 -3.625 0.20115E+05 -10.082 8 SO3,gas 17.12 -21.36 -38.48 -9.620 0.65706E+05 -36.782 9 SO2,gas 0.83 -18.90 -19.73 -5.263 0.33696E+05 -18.036 10 HF,gas 0.47 -13.23 -13.70 -6.849 0.23391E+05 -12.000 11 HCl,gas 5.19 -12.00 -17.19 -8.593 0.29344E+05 -15.487 12 acmite 7.71 4.30 -3.41 -0.354 0.58199E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.83 -4.53 -0.378 0.77416E+04 38 aragonite 0.97 -0.78 -1.75 -0.582 0.29820E+04 40 calcite 0.81 -0.78 -1.59 -0.531 0.27178E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.93 -4.66 -0.310 0.79498E+04 45 celadonite 5.34 1.69 -3.65 -0.215 0.62358E+04 55 chloritoid-Mn 11.40 8.24 -3.16 -0.211 0.53953E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.22 -0.351 0.72010E+04 68 diaspore 2.87 1.35 -1.53 -0.254 0.26067E+04 69 diamond -3.10 -6.11 -3.01 -0.859 0.51326E+04 70 diopside 16.18 11.48 -4.71 -0.471 0.80357E+04 86 gibbsite 4.08 1.35 -2.73 -0.390 0.46652E+04 89 graphite -3.55 -6.11 -2.56 -0.732 0.43748E+04 94 heulandite -5.83 -7.99 -2.16 -0.098 0.36908E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.14 -0.591 0.70638E+04 101 kaolinite -1.33 -3.28 -1.95 -0.177 0.33329E+04 104 laumontite 2.88 0.98 -1.90 -0.127 0.32509E+04 105 lawsonite 9.62 6.96 -2.66 -0.177 0.45380E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62517E+04 109 magnesite 0.69 -3.81 -4.50 -1.501 0.76882E+04 119 microcline -2.49 -2.53 -0.05 -0.003 0.77623E+02 123 muscovite 2.58 0.16 -2.42 -0.142 0.41325E+04 124 paragonite 4.24 2.31 -1.93 -0.113 0.32940E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.26 -3.00 -1.000 0.51203E+04 147 pyrrhotiteFe0.875 -6.02 -8.10 -2.08 -0.765 0.35529E+04 148 pyroxmangite 7.40 5.55 -1.85 -0.370 0.31615E+04 149 pyrophyllite -6.18 -9.26 -3.09 -0.193 0.52723E+04 154 rhodochrosite -0.98 -2.49 -1.51 -0.503 0.25785E+04 155 rhodonite 7.45 5.55 -1.90 -0.380 0.32417E+04 156 sanidine -1.28 -2.53 -1.26 -0.097 0.21454E+04 158 siderite -2.61 -6.75 -4.14 -1.381 0.70749E+04 166 stilbite -7.52 -7.99 -0.47 -0.022 0.79698E+03 172 sulfur -9.15 -13.99 -4.84 -1.488 0.82565E+04 177 tephroite 18.09 14.08 -4.00 -0.572 0.68334E+04 180 topaz-H 4.62 -0.30 -4.91 -0.447 0.83901E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.26 -2.85 -0.949 0.48631E+04 190 wairakite 3.95 0.98 -2.97 -0.175 0.50729E+04 191 walstromite 11.51 7.25 -4.26 -0.851 0.72663E+04 192 wollastonite 10.46 7.25 -3.21 -0.641 0.54767E+04 193 pseudo-wollastonite 11.00 7.25 -3.75 -0.749 0.63965E+04 195 akaganeite 7.75 3.04 -4.71 -1.019 0.80454E+04 196 beidellite-Ca -1.65 -6.14 -4.50 -0.278 0.76782E+04 198 beidellite-K -1.52 -6.15 -4.63 -0.284 0.79105E+04 199 beidellite-Mg -1.79 -6.64 -4.85 -0.300 0.82863E+04 200 beidellite-Na -1.34 -5.44 -4.10 -0.251 0.70040E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.44 -4.12 -0.515 0.70355E+04 204 montmorillonite-Ca -2.29 -5.64 -3.35 -0.207 0.57161E+04 205 montmorillonite-K -2.24 -5.65 -3.41 -0.209 0.58265E+04 206 montmorillonite-Mg -2.48 -6.14 -3.66 -0.226 0.62474E+04 207 montmorillonite-Na -2.04 -4.94 -2.90 -0.178 0.49558E+04 228 tobermorite 9.82 5.54 -4.28 -1.168 0.73080E+04 234 alabandite -0.98 -2.99 -2.02 -0.672 0.34423E+04 237 boehmite 4.41 1.35 -3.06 -0.510 0.52236E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.08 -0.93 -0.072 0.15934E+04 248 an25ab75 2.65 1.45 -1.19 -0.092 0.20387E+04 249 an30ab70 3.28 1.82 -1.46 -0.112 0.24937E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1559900 MOLES New total amount of reactant added: 0.1599900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1599900 Water: Moles liquid = 0.5000E+02 kg liquid = 0.9007E+00 Moles total = 0.4998E+02 kg total = 0.9004E+00 Activity = 1.0000 Stoichiometric ionic strength = .2168799E-01 Osmotic coef. = 0.9165 True ionic strength = .2435139E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1082E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.14792E-08 -8.8300 0.12275E-08 -8.9110 0.82988E+00 -0.0810 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.11951E-02 -2.9226 0.98488E-03 -3.0066 0.82408E+00 -0.0840 4 SO4-- 0.83059E-03 -3.0806 0.40923E-03 -3.3880 0.49270E+00 -0.3074 5 HCO3- 0.11462E-01 -1.9408 0.94613E-02 -2.0240 0.82548E+00 -0.0833 6 HS- 0.35018E-02 -2.4557 0.28863E-02 -2.5397 0.82422E+00 -0.0840 7 Al+++ 0.23504E-24 -24.6289 0.48125E-25 -25.3176 0.20475E+00 -0.6888 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.42971E-07 -7.3668 0.20990E-07 -7.6780 0.48847E+00 -0.3112 10 Mg++ 0.39070E-10 -10.4082 0.18983E-10 -10.7216 0.48587E+00 -0.3135 11 Fe++ 0.38473E-13 -13.4148 0.18717E-13 -13.7278 0.48649E+00 -0.3129 12 K+ 0.15576E-03 -3.8076 0.12861E-03 -3.8907 0.82571E+00 -0.0832 13 Na+ 0.21995E-01 -1.6577 0.18122E-01 -1.7418 0.82390E+00 -0.0841 14 Mn++ 0.87686E-09 -9.0571 0.42700E-09 -9.3696 0.48696E+00 -0.3125 15 F- 0.70912E-04 -4.1493 0.58297E-04 -4.2344 0.82211E+00 -0.0851 16 HPO4-- 0.45597E-07 -7.3411 0.22469E-07 -7.6484 0.49278E+00 -0.3073 18 HSiO3- 0.94578E-03 -3.0242 0.77939E-03 -3.1082 0.82408E+00 -0.0840 19 Ca(HSiO3)+ 0.45110E-09 -9.3457 0.37257E-09 -9.4288 0.82591E+00 -0.0831 20 Mg(HSiO3)+ 0.50772E-12 -12.2944 0.41933E-12 -12.3774 0.82591E+00 -0.0831 21 NaHSiO3,aq 0.22843E-03 -3.6412 0.22843E-03 -3.6412 0.10000E+01 0.0000 22 AlO+ 0.52608E-14 -14.2790 0.43449E-14 -14.3620 0.82591E+00 -0.0831 23 AlOH+2 0.54476E-19 -19.2638 0.26558E-19 -19.5758 0.48752E+00 -0.3120 24 HAlO2,aq 0.70490E-09 -9.1519 0.70490E-09 -9.1519 0.10000E+01 0.0000 25 AlO2- 0.15457E-05 -5.8109 0.12711E-05 -5.8958 0.82235E+00 -0.0849 26 CH4,aq 0.65244E-07 -7.1855 0.64820E-07 -7.1883 0.99349E+00 -0.0028 27 C2H6,aq 0.68916E-17 -17.1617 0.68467E-17 -17.1645 0.99349E+00 -0.0028 31 CO,aq 0.65402E-13 -13.1844 0.65402E-13 -13.1844 0.10000E+01 0.0000 32 CO2,aq 0.24979E-04 -4.6024 0.24817E-04 -4.6053 0.99349E+00 -0.0028 33 CO3-2 0.13698E-02 -2.8633 0.67322E-03 -3.1718 0.49148E+00 -0.3085 34 CaCO3,aq 0.17719E-06 -6.7516 0.17719E-06 -6.7516 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61379E-08 -8.2120 0.50694E-08 -8.2950 0.82591E+00 -0.0831 36 CaCl+ 0.40507E-10 -10.3925 0.33455E-10 -10.4755 0.82591E+00 -0.0831 37 CaCl2,aq 0.78281E-14 -14.1063 0.78281E-14 -14.1063 0.10000E+01 0.0000 38 CaF+ 0.21632E-10 -10.6649 0.17866E-10 -10.7480 0.82591E+00 -0.0831 39 CaOH+ 0.14756E-08 -8.8310 0.12187E-08 -8.9141 0.82591E+00 -0.0831 40 CaSO4,aq 0.27277E-08 -8.5642 0.27277E-08 -8.5642 0.10000E+01 0.0000 41 HCl,aq 0.22154E-12 -12.6545 0.22154E-12 -12.6545 0.10000E+01 0.0000 45 HF,aq 0.48989E-09 -9.3099 0.48989E-09 -9.3099 0.10000E+01 0.0000 46 HF2- 0.11701E-13 -13.9318 0.96423E-14 -14.0158 0.82408E+00 -0.0840 48 FeCl+ 0.35327E-16 -16.4519 0.29177E-16 -16.5350 0.82591E+00 -0.0831 51 FeF+ 0.67511E-16 -16.1706 0.55758E-16 -16.2537 0.82591E+00 -0.0831 53 FeO,aq 0.48275E-12 -12.3163 0.48275E-12 -12.3163 0.10000E+01 0.0000 54 FeOH+ 0.60093E-12 -12.2212 0.49632E-12 -12.3042 0.82591E+00 -0.0831 55 HFeO2- 0.49932E-11 -11.3016 0.41148E-11 -11.3856 0.82408E+00 -0.0840 56 FeO+ 0.44253E-17 -17.3541 0.36549E-17 -17.4371 0.82591E+00 -0.0831 58 FeO2- 0.60226E-12 -12.2202 0.49631E-12 -12.3042 0.82408E+00 -0.0840 59 HFeO2,aq 0.77486E-13 -13.1108 0.77486E-13 -13.1108 0.10000E+01 0.0000 60 H2,aq 0.10560E-06 -6.9763 0.10491E-06 -6.9792 0.99349E+00 -0.0028 61 KCl,aq 0.22957E-08 -8.6391 0.22957E-08 -8.6391 0.10000E+01 0.0000 62 KHSO4,aq 0.18266E-15 -15.7383 0.18266E-15 -15.7383 0.10000E+01 0.0000 63 KOH,aq 0.44742E-07 -7.3493 0.44742E-07 -7.3493 0.10000E+01 0.0000 64 KSO4- 0.99104E-06 -6.0039 0.81670E-06 -6.0879 0.82408E+00 -0.0840 65 MgCO3,aq 0.40166E-10 -10.3961 0.40166E-10 -10.3961 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.56720E-11 -11.2463 0.46846E-11 -11.3293 0.82591E+00 -0.0831 67 MgCl+ 0.33202E-13 -13.4788 0.27422E-13 -13.5619 0.82591E+00 -0.0831 68 MgF+ 0.72467E-13 -13.1399 0.59851E-13 -13.2229 0.82591E+00 -0.0831 69 MgOH+ 0.73841E-11 -11.1317 0.60986E-11 -11.2148 0.82591E+00 -0.0831 71 MnF+ 0.50766E-12 -12.2944 0.41929E-12 -12.3775 0.82591E+00 -0.0831 72 MnO,aq 0.29346E-09 -9.5324 0.29346E-09 -9.5324 0.10000E+01 0.0000 73 MnOH+ 0.12736E-08 -8.8950 0.10519E-08 -8.9780 0.82591E+00 -0.0831 74 MnO2-2 0.13151E-13 -13.8811 0.64633E-14 -14.1895 0.49148E+00 -0.3085 75 HMnO2- 0.21093E-11 -11.6759 0.17382E-11 -11.7599 0.82408E+00 -0.0840 78 MnCl+ 0.31355E-11 -11.5037 0.25897E-11 -11.5868 0.82591E+00 -0.0831 79 MnSO4,aq 0.50446E-10 -10.2972 0.50446E-10 -10.2972 0.10000E+01 0.0000 80 NaCl,aq 0.59147E-05 -5.2281 0.59147E-05 -5.2281 0.10000E+01 0.0000 81 NaF,aq 0.24733E-06 -6.6067 0.24733E-06 -6.6067 0.10000E+01 0.0000 82 NaOH,aq 0.63427E-05 -5.1977 0.63427E-05 -5.1977 0.10000E+01 0.0000 84 OH- 0.57236E-03 -3.2423 0.47068E-03 -3.3273 0.82235E+00 -0.0849 89 HPO3-2 0.14947E-16 -16.8255 0.73459E-17 -17.1340 0.49148E+00 -0.3085 91 H2PO3- 0.21943E-19 -19.6587 0.18083E-19 -19.7427 0.82408E+00 -0.0840 92 H3PO4,aq 0.23680E-15 -15.6256 0.23680E-15 -15.6256 0.10000E+01 0.0000 93 H2PO4- 0.61674E-09 -9.2099 0.50881E-09 -9.2934 0.82499E+00 -0.0836 94 PO4-3 0.68886E-10 -10.1619 0.14934E-10 -10.8258 0.21680E+00 -0.6639 97 H2P2O7-2 0.41302E-19 -19.3840 0.20299E-19 -19.6925 0.49148E+00 -0.3085 98 HP2O7-3 0.16106E-16 -16.7930 0.33019E-17 -17.4812 0.20501E+00 -0.6882 99 P2O7-4 0.10280E-16 -16.9880 0.64261E-18 -18.1921 0.62511E-01 -1.2040 100 H2S,aq 0.11022E-04 -4.9577 0.10950E-04 -4.9606 0.99349E+00 -0.0028 101 S2-2 0.35800E-08 -8.4461 0.17595E-08 -8.7546 0.49148E+00 -0.3085 102 S3-2 0.50342E-12 -12.2981 0.24742E-12 -12.6066 0.49148E+00 -0.3085 103 S3- 0.76275E-15 -15.1176 0.62856E-15 -15.2017 0.82408E+00 -0.0840 104 S4-2 0.46764E-16 -16.3301 0.22983E-16 -16.6386 0.49148E+00 -0.3085 106 SO2,aq 0.28891E-18 -18.5392 0.28891E-18 -18.5392 0.10000E+01 0.0000 107 SO3-2 0.11163E-10 -10.9522 0.55790E-11 -11.2534 0.49976E+00 -0.3012 108 HSO3- 0.52034E-12 -12.2837 0.42880E-12 -12.3677 0.82408E+00 -0.0840 109 HSO4- 0.58549E-09 -9.2325 0.48412E-09 -9.3150 0.82686E+00 -0.0826 111 S2O3-2 0.10710E-09 -9.9702 0.52639E-10 -10.2787 0.49148E+00 -0.3085 112 HS2O3- 0.14020E-16 -16.8533 0.11553E-16 -16.9373 0.82408E+00 -0.0840 Charge balance for all species = -.6115E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1479166E-08 -.3093131E-02 -.3112286E+01 0.0000 2 H2O 0.1000000E+01 0.5550763E+02 0.9982530E+06 0.0000 3 Cl- 0.1195129E-02 0.1201046E-02 0.4250685E+02 5.9043 4 SO4-- 0.8305928E-03 0.8314966E-03 0.7973641E+02 14.4339 5 HCO3- 0.1146152E-01 0.1285654E-01 0.7831098E+03 6.8869 6 HS- 0.3501826E-02 0.3512946E-02 0.1159787E+03 6.3713 7 Al+++ 0.2350393E-24 0.1546423E-05 0.4165248E-01 1.4153 8 H4SiO4 0.1024624E-02 0.2198836E-02 0.2109756E+03 -2.9894 9 Ca++ 0.4297117E-07 0.2310149E-06 0.9242565E-02 10.1440 10 Mg++ 0.3906973E-10 0.9290543E-10 0.2254801E-05 7.1003 11 Fe++ 0.3847254E-13 0.6795252E-11 0.3788365E-06 4.0942 12 K+ 0.1557552E-03 0.1567933E-03 0.6120303E+01 5.0202 13 Na+ 0.2199506E-01 0.2223600E-01 0.5103149E+03 7.1692 14 Mn++ 0.8768633E-09 0.2500110E-08 0.1371129E-03 8.4524 15 F- 0.7091173E-04 0.7115957E-04 0.1349546E+01 4.6766 16 HPO4-- 0.4559673E-07 0.4628236E-07 0.4434433E-02 10.1735 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.2799617E-02 -.2786095E-02 -.1352158E-04 0.0000000E+00 2 H2O 0.4997739E+02 0.4999773E+02 -.2033816E-01 0.0000000E+00 3 Cl- 0.1081825E-02 0.1081825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7489672E-03 0.7489590E-03 0.8146537E-08 0.0000000E+00 5 HCO3- 0.1158035E-01 0.1158035E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3164294E-02 0.3164237E-02 0.5702576E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1392919E-05 0.3382433E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1980571E-02 0.1017245E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.6120729E-11 0.3258615E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002877E-01 0.3382433E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6409600E-04 0.6409600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.902300E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3382E-05 -5.471 0.8869E-03 -3.052 0.1451 0.3405E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.6394E-03 0.7801E-06 quartz 0.1016E-01 -1.993 0.6106 -0.214 99.85 0.2306 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.611442 g Volume = 0.230912 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1599900 moles log = -0.7959 Original solution: 1000.0103000 g Original solution / Rock added: 6250.46 (Water/Rock Ratio), log = 3.7959 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0235 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9969E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.2576E-02 1.0071 0.2655E-02 0.2636E-02 CH4,gas 0.9207E-04 1.0125 0.9541E-04 0.9423E-04 H2,gas 0.1345E-03 1.0005 0.1377E-03 0.1377E-03 H2S,gas 0.2953E-03 0.9960 0.3010E-03 0.3022E-03 S2,gas 0.1752E-18 1.0000 0.1793E-18 0.1793E-18 CO,gas 0.9522E-10 1.0000 0.9746E-10 0.9746E-10 SO3,gas 0.2278E-36 1.0000 0.2332E-36 0.2332E-36 SO2,gas 0.1221E-17 1.0000 0.1249E-17 0.1249E-17 HF,gas 0.1175E-11 1.0000 0.1203E-11 0.1203E-11 HCl,gas 0.3819E-15 1.0000 0.3909E-15 0.3909E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.94 -4.27 -1.425 0.72993E+04 -2.576 3 CH4,gas 4.54 -1.18 -5.72 -1.430 0.97657E+04 -4.020 4 H2,gas 8.00 2.44 -5.56 -3.177 0.94934E+04 -3.861 5 H2S,gas -6.23 -11.45 -5.22 -2.610 0.89137E+04 -3.521 6 S2,gas -7.34 -27.78 -20.45 -3.145 0.34910E+05 -18.746 7 CO,gas 3.21 -8.50 -11.71 -3.603 0.19995E+05 -10.011 8 SO3,gas 17.12 -21.21 -38.33 -9.583 0.65450E+05 -36.632 9 SO2,gas 0.83 -18.77 -19.60 -5.227 0.33470E+05 -17.903 10 HF,gas 0.47 -13.15 -13.62 -6.809 0.23254E+05 -11.920 11 HCl,gas 5.19 -11.92 -17.11 -8.553 0.29210E+05 -15.408 12 acmite 7.71 4.06 -3.65 -0.379 0.62240E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.84 -4.54 -0.378 0.77444E+04 38 aragonite 0.97 -0.79 -1.76 -0.586 0.30010E+04 40 calcite 0.81 -0.79 -1.60 -0.534 0.27368E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.95 -4.63 -0.309 0.79058E+04 45 celadonite 5.34 1.58 -3.76 -0.221 0.64261E+04 55 chloritoid-Mn 11.40 8.29 -3.11 -0.207 0.53061E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.22 -0.352 0.72024E+04 68 diaspore 2.87 1.42 -1.46 -0.243 0.24902E+04 69 diamond -3.10 -6.06 -2.95 -0.844 0.50421E+04 70 diopside 16.18 11.27 -4.92 -0.492 0.83939E+04 86 gibbsite 4.08 1.42 -2.66 -0.381 0.45488E+04 89 graphite -3.55 -6.06 -2.51 -0.717 0.42843E+04 94 heulandite -5.83 -7.95 -2.12 -0.097 0.36272E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.14 -0.591 0.70652E+04 101 kaolinite -1.33 -3.15 -1.82 -0.165 0.31000E+04 104 laumontite 2.88 1.02 -1.87 -0.124 0.31873E+04 105 lawsonite 9.62 7.00 -2.62 -0.175 0.44743E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62531E+04 109 magnesite 0.69 -3.83 -4.53 -1.508 0.77269E+04 119 microcline -2.49 -2.53 -0.05 -0.004 0.79059E+02 123 muscovite 2.58 0.30 -2.28 -0.134 0.39010E+04 124 paragonite 4.24 2.45 -1.79 -0.105 0.30611E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.36 -3.10 -1.032 0.52866E+04 147 pyrrhotiteFe0.875 -6.02 -8.17 -2.15 -0.792 0.36776E+04 148 pyroxmangite 7.40 5.46 -1.94 -0.387 0.33052E+04 149 pyrophyllite -6.18 -9.13 -2.95 -0.184 0.50394E+04 154 rhodochrosite -0.98 -2.48 -1.51 -0.502 0.25720E+04 155 rhodonite 7.45 5.46 -1.98 -0.397 0.33855E+04 156 sanidine -1.28 -2.53 -1.26 -0.097 0.21468E+04 158 siderite -2.61 -6.84 -4.23 -1.411 0.72272E+04 166 stilbite -7.52 -7.95 -0.43 -0.020 0.73335E+03 172 sulfur -9.15 -13.89 -4.74 -1.458 0.80902E+04 177 tephroite 18.09 13.92 -4.17 -0.596 0.71210E+04 180 topaz-H 4.62 -0.16 -4.78 -0.434 0.81572E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.36 -2.95 -0.982 0.50294E+04 190 wairakite 3.95 1.02 -2.93 -0.173 0.50092E+04 191 walstromite 11.51 7.15 -4.35 -0.871 0.74356E+04 192 wollastonite 10.46 7.15 -3.31 -0.661 0.56460E+04 193 pseudo-wollastonite 11.00 7.15 -3.85 -0.769 0.65658E+04 195 akaganeite 7.75 2.87 -4.88 -1.055 0.83330E+04 196 beidellite-Ca -1.65 -6.00 -4.35 -0.269 0.74348E+04 198 beidellite-K -1.52 -6.02 -4.50 -0.275 0.76780E+04 199 beidellite-Mg -1.79 -6.50 -4.71 -0.292 0.80461E+04 200 beidellite-Na -1.34 -5.31 -3.97 -0.243 0.67711E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.35 -4.03 -0.504 0.68852E+04 204 montmorillonite-Ca -2.29 -5.58 -3.29 -0.203 0.56119E+04 205 montmorillonite-K -2.24 -5.59 -3.36 -0.206 0.57332E+04 206 montmorillonite-Mg -2.48 -6.08 -3.60 -0.223 0.61464E+04 207 montmorillonite-Na -2.04 -4.89 -2.85 -0.174 0.48621E+04 228 tobermorite 9.82 5.46 -4.36 -1.190 0.74490E+04 234 alabandite -0.98 -3.00 -2.02 -0.673 0.34498E+04 237 boehmite 4.41 1.42 -2.99 -0.499 0.51071E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.09 -0.93 -0.071 0.15807E+04 248 an25ab75 2.65 1.46 -1.18 -0.091 0.20228E+04 249 an30ab70 3.28 1.83 -1.45 -0.111 0.24746E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1599900 MOLES New total amount of reactant added: 0.1639900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1639900 Water: Moles liquid = 0.5000E+02 kg liquid = 0.9008E+00 Moles total = 0.4998E+02 kg total = 0.9004E+00 Activity = 1.0000 Stoichiometric ionic strength = .2194667E-01 Osmotic coef. = 0.9161 True ionic strength = .2423021E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1105E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.17724E-08 -8.7514 0.14713E-08 -8.8323 0.83015E+00 -0.0808 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.12211E-02 -2.9132 0.10066E-02 -2.9971 0.82436E+00 -0.0839 4 SO4-- 0.85171E-03 -3.0697 0.42021E-03 -3.3765 0.49338E+00 -0.3068 5 HCO3- 0.11954E-01 -1.9225 0.98716E-02 -2.0056 0.82576E+00 -0.0831 6 HS- 0.35858E-02 -2.4454 0.29565E-02 -2.5292 0.82450E+00 -0.0838 7 Al+++ 0.48261E-24 -24.3164 0.99129E-25 -25.0038 0.20540E+00 -0.6874 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.47650E-07 -7.3219 0.23309E-07 -7.6325 0.48916E+00 -0.3105 10 Mg++ 0.41859E-10 -10.3782 0.20367E-10 -10.6911 0.48657E+00 -0.3129 11 Fe++ 0.34972E-13 -13.4563 0.17038E-13 -13.7686 0.48719E+00 -0.3123 12 K+ 0.15573E-03 -3.8076 0.12863E-03 -3.8907 0.82599E+00 -0.0830 13 Na+ 0.22032E-01 -1.6569 0.18158E-01 -1.7409 0.82418E+00 -0.0840 14 Mn++ 0.99552E-09 -9.0019 0.48547E-09 -9.3138 0.48765E+00 -0.3119 15 F- 0.72676E-04 -4.1386 0.59769E-04 -4.2235 0.82240E+00 -0.0849 16 HPO4-- 0.45484E-07 -7.3421 0.22444E-07 -7.6489 0.49346E+00 -0.3068 18 HSiO3- 0.78879E-03 -3.1030 0.65025E-03 -3.1869 0.82436E+00 -0.0839 19 Ca(HSiO3)+ 0.41778E-09 -9.3791 0.34517E-09 -9.4620 0.82619E+00 -0.0829 20 Mg(HSiO3)+ 0.45433E-12 -12.3426 0.37536E-12 -12.4255 0.82619E+00 -0.0829 21 NaHSiO3,aq 0.19097E-03 -3.7190 0.19097E-03 -3.7190 0.10000E+01 0.0000 22 AlO+ 0.75401E-14 -14.1226 0.62296E-14 -14.2055 0.82619E+00 -0.0829 23 AlOH+2 0.93485E-19 -19.0293 0.45640E-19 -19.3407 0.48821E+00 -0.3114 24 HAlO2,aq 0.84319E-09 -9.0741 0.84319E-09 -9.0741 0.10000E+01 0.0000 25 AlO2- 0.15421E-05 -5.8119 0.12686E-05 -5.8967 0.82264E+00 -0.0848 26 CH4,aq 0.67912E-07 -7.1681 0.67465E-07 -7.1709 0.99342E+00 -0.0029 27 C2H6,aq 0.78168E-17 -17.1070 0.77654E-17 -17.1098 0.99342E+00 -0.0029 31 CO,aq 0.78121E-13 -13.1072 0.78121E-13 -13.1072 0.10000E+01 0.0000 32 CO2,aq 0.31241E-04 -4.5053 0.31035E-04 -4.5081 0.99342E+00 -0.0029 33 CO3-2 0.11907E-02 -2.9242 0.58603E-03 -3.2321 0.49216E+00 -0.3079 34 CaCO3,aq 0.17127E-06 -6.7663 0.17127E-06 -6.7663 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.71089E-08 -8.1482 0.58733E-08 -8.2311 0.82619E+00 -0.0829 36 CaCl+ 0.45959E-10 -10.3376 0.37971E-10 -10.4206 0.82619E+00 -0.0829 37 CaCl2,aq 0.90808E-14 -14.0419 0.90808E-14 -14.0419 0.10000E+01 0.0000 38 CaF+ 0.24619E-10 -10.6087 0.20340E-10 -10.6917 0.82619E+00 -0.0829 39 CaOH+ 0.13666E-08 -8.8644 0.11290E-08 -8.9473 0.82619E+00 -0.0829 40 CaSO4,aq 0.31102E-08 -8.5072 0.31102E-08 -8.5072 0.10000E+01 0.0000 41 HCl,aq 0.27140E-12 -12.5664 0.27140E-12 -12.5664 0.10000E+01 0.0000 45 HF,aq 0.60201E-09 -9.2204 0.60201E-09 -9.2204 0.10000E+01 0.0000 46 HF2- 0.14736E-13 -13.8316 0.12148E-13 -13.9155 0.82436E+00 -0.0839 48 FeCl+ 0.32858E-16 -16.4834 0.27147E-16 -16.5663 0.82619E+00 -0.0829 51 FeF+ 0.62986E-16 -16.2008 0.52039E-16 -16.2837 0.82619E+00 -0.0829 53 FeO,aq 0.30589E-12 -12.5144 0.30589E-12 -12.5144 0.10000E+01 0.0000 54 FeOH+ 0.45624E-12 -12.3408 0.37694E-12 -12.4237 0.82619E+00 -0.0829 55 HFeO2- 0.26387E-11 -11.5786 0.21753E-11 -11.6625 0.82436E+00 -0.0839 56 FeO+ 0.34377E-17 -17.4637 0.28402E-17 -17.5466 0.82619E+00 -0.0829 58 FeO2- 0.32566E-12 -12.4872 0.26846E-12 -12.5711 0.82436E+00 -0.0839 59 HFeO2,aq 0.50238E-13 -13.2990 0.50238E-13 -13.2990 0.10000E+01 0.0000 60 H2,aq 0.10087E-06 -6.9963 0.10020E-06 -6.9991 0.99342E+00 -0.0029 61 KCl,aq 0.23467E-08 -8.6295 0.23467E-08 -8.6295 0.10000E+01 0.0000 62 KHSO4,aq 0.22485E-15 -15.6481 0.22485E-15 -15.6481 0.10000E+01 0.0000 63 KOH,aq 0.37334E-07 -7.4279 0.37334E-07 -7.4279 0.10000E+01 0.0000 64 KSO4- 0.10174E-05 -5.9925 0.83874E-06 -6.0764 0.82436E+00 -0.0839 65 MgCO3,aq 0.37514E-10 -10.4258 0.37514E-10 -10.4258 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.63474E-11 -11.1974 0.52442E-11 -11.2803 0.82619E+00 -0.0829 67 MgCl+ 0.36398E-13 -13.4389 0.30072E-13 -13.5218 0.82619E+00 -0.0829 68 MgF+ 0.79688E-13 -13.0986 0.65838E-13 -13.1815 0.82619E+00 -0.0829 69 MgOH+ 0.66077E-11 -11.1800 0.54592E-11 -11.2629 0.82619E+00 -0.0829 71 MnF+ 0.59155E-12 -12.2280 0.48874E-12 -12.3109 0.82619E+00 -0.0829 72 MnO,aq 0.23224E-09 -9.6341 0.23224E-09 -9.6341 0.10000E+01 0.0000 73 MnOH+ 0.12076E-08 -8.9181 0.99774E-09 -9.0010 0.82619E+00 -0.0829 74 MnO2-2 0.72340E-14 -14.1406 0.35603E-14 -14.4485 0.49216E+00 -0.3079 75 HMnO2- 0.13922E-11 -11.8563 0.11476E-11 -11.9402 0.82436E+00 -0.0839 78 MnCl+ 0.36424E-11 -11.4386 0.30093E-11 -11.5215 0.82619E+00 -0.0829 79 MnSO4,aq 0.58894E-10 -10.2299 0.58894E-10 -10.2299 0.10000E+01 0.0000 80 NaCl,aq 0.60576E-05 -5.2177 0.60576E-05 -5.2177 0.10000E+01 0.0000 81 NaF,aq 0.25409E-06 -6.5950 0.25409E-06 -6.5950 0.10000E+01 0.0000 82 NaOH,aq 0.53025E-05 -5.2755 0.53025E-05 -5.2755 0.10000E+01 0.0000 84 OH- 0.47735E-03 -3.3212 0.39269E-03 -3.4060 0.82264E+00 -0.0848 89 HPO3-2 0.14240E-16 -16.8465 0.70086E-17 -17.1544 0.49216E+00 -0.3079 91 H2PO3- 0.25084E-19 -19.6006 0.20679E-19 -19.6845 0.82436E+00 -0.0839 92 H3PO4,aq 0.33982E-15 -15.4688 0.33982E-15 -15.4688 0.10000E+01 0.0000 93 H2PO4- 0.73816E-09 -9.1318 0.60918E-09 -9.2153 0.82527E+00 -0.0834 94 PO4-3 0.57239E-10 -10.2423 0.12446E-10 -10.9050 0.21744E+00 -0.6627 97 H2P2O7-2 0.59123E-19 -19.2282 0.29098E-19 -19.5361 0.49216E+00 -0.3079 98 HP2O7-3 0.19201E-16 -16.7167 0.39490E-17 -17.4035 0.20566E+00 -0.6869 99 P2O7-4 0.10201E-16 -16.9914 0.64118E-18 -18.1930 0.62855E-01 -1.2017 100 H2S,aq 0.13533E-04 -4.8686 0.13444E-04 -4.8715 0.99342E+00 -0.0029 101 S2-2 0.39273E-08 -8.4059 0.19329E-08 -8.7138 0.49216E+00 -0.3079 102 S3-2 0.70989E-12 -12.1488 0.34938E-12 -12.4567 0.49216E+00 -0.3079 103 S3- 0.13205E-14 -14.8793 0.10886E-14 -14.9631 0.82436E+00 -0.0839 104 S4-2 0.84764E-16 -16.0718 0.41718E-16 -16.3797 0.49216E+00 -0.3079 106 SO2,aq 0.40709E-18 -18.3903 0.40709E-18 -18.3903 0.10000E+01 0.0000 107 SO3-2 0.10934E-10 -10.9612 0.54718E-11 -11.2619 0.50042E+00 -0.3007 108 HSO3- 0.61147E-12 -12.2136 0.50408E-12 -12.2975 0.82436E+00 -0.0839 109 HSO4- 0.72037E-09 -9.1424 0.59584E-09 -9.2249 0.82713E+00 -0.0824 111 S2O3-2 0.13484E-09 -9.8702 0.66362E-10 -10.1781 0.49216E+00 -0.3079 112 HS2O3- 0.21178E-16 -16.6741 0.17458E-16 -16.7580 0.82436E+00 -0.0839 Charge balance for all species = -.6114E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1772366E-08 -.2614768E-02 -.2630937E+01 0.0000 2 H2O 0.1000000E+01 0.5550773E+02 0.9982459E+06 0.0000 3 Cl- 0.1221099E-02 0.1227159E-02 0.4343068E+02 5.8352 4 SO4-- 0.8517118E-03 0.8526411E-03 0.8176335E+02 14.2881 5 HCO3- 0.1195446E-01 0.1317667E-01 0.8026028E+03 6.8267 6 HS- 0.3585764E-02 0.3599398E-02 0.1188319E+03 6.3031 7 Al+++ 0.4826059E-24 0.1542895E-05 0.4155709E-01 1.4931 8 H4SiO4 0.1024624E-02 0.2004385E-02 0.1923165E+03 -2.9894 9 Ca++ 0.4764977E-07 0.2309986E-06 0.9241829E-02 10.0321 10 Mg++ 0.4185934E-10 0.9289885E-10 0.2254621E-05 6.9735 11 Fe++ 0.3497208E-13 0.3811814E-11 0.2125074E-06 3.8960 12 K+ 0.1557251E-03 0.1567822E-03 0.6119815E+01 4.9416 13 Na+ 0.2203184E-01 0.2223442E-01 0.5102742E+03 7.0914 14 Mn++ 0.9955246E-09 0.2499932E-08 0.1371020E-03 8.3507 15 F- 0.7267602E-04 0.7293073E-04 0.1383124E+01 4.6088 16 HPO4-- 0.4548368E-07 0.4627908E-07 0.4434080E-02 10.0157 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.2368917E-02 -.2355383E-02 -.1353390E-04 0.0000000E+00 2 H2O 0.4998067E+02 0.5000136E+02 -.2068820E-01 0.0000000E+00 3 Cl- 0.1105425E-02 0.1105425E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7680672E-03 0.7680590E-03 0.8147209E-08 0.0000000E+00 5 HCO3- 0.1186955E-01 0.1186955E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3242394E-02 0.3242337E-02 0.5703046E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1389840E-05 0.3385512E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1805550E-02 0.1034747E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.3433682E-11 0.3258884E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002876E-01 0.3385512E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6569600E-04 0.6569600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8470E-21 Mass of aqueous solution: 0.902372E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1639900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3386E-05 -5.470 0.8877E-03 -3.052 0.1427 0.3408E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.6287E-03 0.7801E-06 quartz 0.1034E-01 -1.986 0.6211 -0.207 99.86 0.2345 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.621957 g Volume = 0.234883 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1639900 moles log = -0.7852 Original solution: 1000.0103000 g Original solution / Rock added: 6098.00 (Water/Rock Ratio), log = 3.7852 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0242 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9962E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.3219E-02 1.0071 0.3320E-02 0.3297E-02 CH4,gas 0.9576E-04 1.0125 0.9930E-04 0.9808E-04 H2,gas 0.1284E-03 1.0005 0.1316E-03 0.1315E-03 H2S,gas 0.3623E-03 0.9960 0.3696E-03 0.3710E-03 S2,gas 0.2892E-18 1.0000 0.2962E-18 0.2962E-18 CO,gas 0.1137E-09 1.0000 0.1164E-09 0.1164E-09 SO3,gas 0.3358E-36 1.0000 0.3440E-36 0.3440E-36 SO2,gas 0.1719E-17 1.0000 0.1760E-17 0.1760E-17 HF,gas 0.1443E-11 1.0000 0.1478E-11 0.1478E-11 HCl,gas 0.4676E-15 1.0000 0.4789E-15 0.4789E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.84 -4.18 -1.393 0.71334E+04 -2.479 3 CH4,gas 4.54 -1.16 -5.70 -1.426 0.97360E+04 -4.003 4 H2,gas 8.00 2.42 -5.58 -3.188 0.95275E+04 -3.881 5 H2S,gas -6.23 -11.36 -5.13 -2.566 0.87615E+04 -3.432 6 S2,gas -7.34 -27.56 -20.23 -3.112 0.34538E+05 -18.528 7 CO,gas 3.21 -8.42 -11.63 -3.579 0.19863E+05 -9.934 8 SO3,gas 17.12 -21.04 -38.16 -9.541 0.65161E+05 -36.463 9 SO2,gas 0.83 -18.62 -19.45 -5.188 0.33216E+05 -17.754 10 HF,gas 0.47 -13.06 -13.53 -6.765 0.23101E+05 -11.830 11 HCl,gas 5.19 -11.83 -17.02 -8.509 0.29059E+05 -15.320 12 acmite 7.71 3.80 -3.91 -0.406 0.66782E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 34 apatite-F -34.30 -38.84 -4.53 -0.378 0.77430E+04 38 aragonite 0.97 -0.81 -1.77 -0.591 0.30262E+04 40 calcite 0.81 -0.81 -1.62 -0.539 0.27620E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 3.98 -4.60 -0.307 0.78566E+04 45 celadonite 5.34 1.45 -3.89 -0.229 0.66440E+04 55 chloritoid-Mn 11.40 8.35 -3.05 -0.204 0.52140E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.22 -0.352 0.72038E+04 68 diaspore 2.87 1.49 -1.38 -0.230 0.23574E+04 69 diamond -3.10 -6.00 -2.90 -0.827 0.49444E+04 86 gibbsite 4.08 1.49 -2.59 -0.369 0.44159E+04 89 graphite -3.55 -6.00 -2.45 -0.701 0.41866E+04 94 heulandite -5.83 -7.91 -2.08 -0.095 0.35525E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.45 -4.14 -0.591 0.70666E+04 101 kaolinite -1.33 -2.99 -1.66 -0.151 0.28343E+04 102 kyanite 4.88 0.00 -4.88 -0.488 0.83315E+04 104 laumontite 2.88 1.06 -1.82 -0.122 0.31126E+04 105 lawsonite 9.62 7.04 -2.58 -0.172 0.43996E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62545E+04 109 magnesite 0.69 -3.86 -4.55 -1.518 0.77775E+04 119 microcline -2.49 -2.53 -0.05 -0.004 0.80448E+02 123 muscovite 2.58 0.45 -2.13 -0.125 0.36367E+04 124 paragonite 4.24 2.60 -1.64 -0.096 0.27954E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.47 -3.21 -1.068 0.54728E+04 147 pyrrhotiteFe0.875 -6.02 -8.25 -2.24 -0.822 0.38173E+04 148 pyroxmangite 7.40 5.36 -2.04 -0.407 0.34788E+04 149 pyrophyllite -6.18 -8.97 -2.80 -0.175 0.47737E+04 154 rhodochrosite -0.98 -2.49 -1.51 -0.504 0.25797E+04 155 rhodonite 7.45 5.36 -2.08 -0.417 0.35590E+04 156 sanidine -1.28 -2.53 -1.26 -0.097 0.21482E+04 158 siderite -2.61 -6.94 -4.33 -1.445 0.73998E+04 166 stilbite -7.52 -7.91 -0.39 -0.018 0.65866E+03 172 sulfur -9.15 -13.78 -4.63 -1.424 0.79040E+04 177 tephroite 18.09 13.71 -4.37 -0.625 0.74680E+04 180 topaz-H 4.62 0.00 -4.62 -0.420 0.78916E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.47 -3.05 -1.018 0.52156E+04 190 wairakite 3.95 1.06 -2.89 -0.170 0.49345E+04 191 walstromite 11.51 7.04 -4.47 -0.893 0.76265E+04 192 wollastonite 10.46 7.04 -3.42 -0.684 0.58370E+04 193 pseudo-wollastonite 11.00 7.04 -3.96 -0.791 0.67568E+04 196 beidellite-Ca -1.65 -5.84 -4.19 -0.259 0.71568E+04 198 beidellite-K -1.52 -5.86 -4.34 -0.266 0.74128E+04 199 beidellite-Mg -1.79 -6.34 -4.55 -0.282 0.77723E+04 200 beidellite-Na -1.34 -5.15 -3.81 -0.233 0.65054E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.25 -3.94 -0.492 0.67194E+04 204 montmorillonite-Ca -2.29 -5.51 -3.22 -0.199 0.54930E+04 205 montmorillonite-K -2.24 -5.53 -3.30 -0.202 0.56271E+04 206 montmorillonite-Mg -2.48 -6.01 -3.53 -0.219 0.60317E+04 207 montmorillonite-Na -2.04 -4.82 -2.79 -0.171 0.47555E+04 228 tobermorite 9.82 5.37 -4.46 -1.216 0.76081E+04 234 alabandite -0.98 -3.01 -2.03 -0.678 0.34711E+04 237 boehmite 4.41 1.49 -2.91 -0.486 0.49743E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.10 -0.92 -0.071 0.15657E+04 248 an25ab75 2.65 1.47 -1.17 -0.090 0.20042E+04 249 an30ab70 3.28 1.84 -1.44 -0.110 0.24522E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1639900 MOLES New total amount of reactant added: 0.1679900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1679900 Water: Moles liquid = 0.5001E+02 kg liquid = 0.9009E+00 Moles total = 0.4998E+02 kg total = 0.9005E+00 Activity = 1.0000 Stoichiometric ionic strength = .2220533E-01 Osmotic coef. = 0.9157 True ionic strength = .2409917E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1129E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21880E-08 -8.6600 0.18170E-08 -8.7406 0.83044E+00 -0.0807 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.12471E-02 -2.9041 0.10284E-02 -2.9878 0.82468E+00 -0.0837 4 SO4-- 0.87283E-03 -3.0591 0.43127E-03 -3.3652 0.49411E+00 -0.3062 5 HCO3- 0.12453E-01 -1.9047 0.10287E-01 -1.9877 0.82607E+00 -0.0830 6 HS- 0.36686E-02 -2.4355 0.30259E-02 -2.5191 0.82482E+00 -0.0836 7 Al+++ 0.11164E-23 -23.9522 0.23010E-24 -24.6381 0.20611E+00 -0.6859 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.53812E-07 -7.2691 0.26363E-07 -7.5790 0.48991E+00 -0.3099 10 Mg++ 0.45198E-10 -10.3449 0.22026E-10 -10.6571 0.48732E+00 -0.3122 11 Fe++ 0.31599E-13 -13.5003 0.15418E-13 -13.8120 0.48794E+00 -0.3116 12 K+ 0.15569E-03 -3.8077 0.12865E-03 -3.8906 0.82629E+00 -0.0829 13 Na+ 0.22067E-01 -1.6563 0.18194E-01 -1.7401 0.82450E+00 -0.0838 14 Mn++ 0.11349E-08 -8.9450 0.55431E-09 -9.2562 0.48841E+00 -0.3112 15 F- 0.74440E-04 -4.1282 0.61243E-04 -4.2129 0.82272E+00 -0.0847 16 HPO4-- 0.45320E-07 -7.3437 0.22397E-07 -7.6498 0.49419E+00 -0.3061 18 HSiO3- 0.63849E-03 -3.1948 0.52655E-03 -3.2786 0.82468E+00 -0.0837 19 Ca(HSiO3)+ 0.38250E-09 -9.4174 0.31613E-09 -9.5001 0.82650E+00 -0.0828 20 Mg(HSiO3)+ 0.39771E-12 -12.4004 0.32871E-12 -12.4832 0.82650E+00 -0.0828 21 NaHSiO3,aq 0.15495E-03 -3.8098 0.15495E-03 -3.8098 0.10000E+01 0.0000 22 AlO+ 0.11472E-13 -13.9404 0.94816E-14 -14.0231 0.82650E+00 -0.0828 23 AlOH+2 0.17544E-18 -18.7559 0.85785E-19 -19.0666 0.48896E+00 -0.3107 24 HAlO2,aq 0.10392E-08 -8.9833 0.10392E-08 -8.9833 0.10000E+01 0.0000 25 AlO2- 0.15384E-05 -5.8129 0.12661E-05 -5.8975 0.82296E+00 -0.0846 26 CH4,aq 0.70581E-07 -7.1513 0.70111E-07 -7.1542 0.99334E+00 -0.0029 27 C2H6,aq 0.89061E-17 -17.0503 0.88468E-17 -17.0532 0.99334E+00 -0.0029 31 CO,aq 0.95303E-13 -13.0209 0.95303E-13 -13.0209 0.10000E+01 0.0000 32 CO2,aq 0.40207E-04 -4.3957 0.39939E-04 -4.3986 0.99334E+00 -0.0029 33 CO3-2 0.10033E-02 -2.9986 0.49452E-03 -3.3058 0.49290E+00 -0.3072 34 CaCO3,aq 0.16347E-06 -6.7866 0.16347E-06 -6.7866 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.83758E-08 -8.0770 0.69226E-08 -8.1597 0.82650E+00 -0.0828 36 CaCl+ 0.53087E-10 -10.2750 0.43876E-10 -10.3578 0.82650E+00 -0.0828 37 CaCl2,aq 0.10720E-13 -13.9698 0.10720E-13 -13.9698 0.10000E+01 0.0000 38 CaF+ 0.28521E-10 -10.5448 0.23573E-10 -10.6276 0.82650E+00 -0.0828 39 CaOH+ 0.12511E-08 -8.9027 0.10341E-08 -8.9855 0.82650E+00 -0.0828 40 CaSO4,aq 0.36104E-08 -8.4424 0.36104E-08 -8.4424 0.10000E+01 0.0000 41 HCl,aq 0.34242E-12 -12.4654 0.34242E-12 -12.4654 0.10000E+01 0.0000 45 HF,aq 0.76178E-09 -9.1182 0.76178E-09 -9.1182 0.10000E+01 0.0000 46 HF2- 0.19100E-13 -13.7190 0.15751E-13 -13.8027 0.82468E+00 -0.0837 48 FeCl+ 0.30367E-16 -16.5176 0.25098E-16 -16.6004 0.82650E+00 -0.0828 51 FeF+ 0.58383E-16 -16.2337 0.48253E-16 -16.3165 0.82650E+00 -0.0828 53 FeO,aq 0.18151E-12 -12.7411 0.18151E-12 -12.7411 0.10000E+01 0.0000 54 FeOH+ 0.33420E-12 -12.4760 0.27622E-12 -12.5588 0.82650E+00 -0.0828 55 HFeO2- 0.12674E-11 -11.8971 0.10452E-11 -11.9808 0.82468E+00 -0.0837 56 FeO+ 0.25864E-17 -17.5873 0.21377E-17 -17.6701 0.82650E+00 -0.0828 58 FeO2- 0.16066E-12 -12.7941 0.13249E-12 -12.8778 0.82468E+00 -0.0837 59 HFeO2,aq 0.30617E-13 -13.5140 0.30617E-13 -13.5140 0.10000E+01 0.0000 60 H2,aq 0.95625E-07 -7.0194 0.94989E-07 -7.0223 0.99334E+00 -0.0029 61 KCl,aq 0.23979E-08 -8.6202 0.23979E-08 -8.6202 0.10000E+01 0.0000 62 KHSO4,aq 0.28503E-15 -15.5451 0.28503E-15 -15.5451 0.10000E+01 0.0000 63 KOH,aq 0.30237E-07 -7.5195 0.30237E-07 -7.5195 0.10000E+01 0.0000 64 KSO4- 0.10440E-05 -5.9813 0.86096E-06 -6.0650 0.82468E+00 -0.0837 65 MgCO3,aq 0.34234E-10 -10.4655 0.34234E-10 -10.4655 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.71505E-11 -11.1457 0.59099E-11 -11.2284 0.82650E+00 -0.0828 67 MgCl+ 0.40199E-13 -13.3958 0.33225E-13 -13.4785 0.82650E+00 -0.0828 68 MgF+ 0.88270E-13 -13.0542 0.72955E-13 -13.1369 0.82650E+00 -0.0828 69 MgOH+ 0.57842E-11 -11.2378 0.47806E-11 -11.3205 0.82650E+00 -0.0828 71 MnF+ 0.69184E-12 -12.1600 0.57180E-12 -12.2428 0.82650E+00 -0.0828 72 MnO,aq 0.17388E-09 -9.7598 0.17388E-09 -9.7598 0.10000E+01 0.0000 73 MnOH+ 0.11161E-08 -8.9523 0.92249E-09 -9.0350 0.82650E+00 -0.0828 74 MnO2-2 0.35461E-14 -14.4503 0.17479E-14 -14.7575 0.49290E+00 -0.3072 75 HMnO2- 0.84370E-12 -12.0738 0.69578E-12 -12.1575 0.82468E+00 -0.0837 78 MnCl+ 0.42473E-11 -11.3719 0.35104E-11 -11.4546 0.82650E+00 -0.0828 79 MnSO4,aq 0.69014E-10 -10.1611 0.69014E-10 -10.1611 0.10000E+01 0.0000 80 NaCl,aq 0.62010E-05 -5.2075 0.62010E-05 -5.2075 0.10000E+01 0.0000 81 NaF,aq 0.26087E-06 -6.5836 0.26087E-06 -6.5836 0.10000E+01 0.0000 82 NaOH,aq 0.43022E-05 -5.3663 0.43022E-05 -5.3663 0.10000E+01 0.0000 84 OH- 0.38639E-03 -3.4130 0.31798E-03 -3.4976 0.82296E+00 -0.0846 89 HPO3-2 0.13451E-16 -16.8713 0.66299E-17 -17.1785 0.49290E+00 -0.3072 91 H2PO3- 0.29292E-19 -19.5332 0.24157E-19 -19.6170 0.82468E+00 -0.0837 92 H3PO4,aq 0.51715E-15 -15.2864 0.51715E-15 -15.2864 0.10000E+01 0.0000 93 H2PO4- 0.90932E-09 -9.0413 0.75071E-09 -9.1245 0.82558E+00 -0.0832 94 PO4-3 0.46105E-10 -10.3363 0.10057E-10 -10.9975 0.21813E+00 -0.6613 97 H2P2O7-2 0.89652E-19 -19.0474 0.44190E-19 -19.3547 0.49290E+00 -0.3072 98 HP2O7-3 0.23532E-16 -16.6283 0.48562E-17 -17.3137 0.20637E+00 -0.6854 99 P2O7-4 0.10098E-16 -16.9958 0.63849E-18 -18.1948 0.63232E-01 -1.1991 100 H2S,aq 0.17106E-04 -4.7668 0.16993E-04 -4.7697 0.99334E+00 -0.0029 101 S2-2 0.43333E-08 -8.3632 0.21359E-08 -8.6704 0.49290E+00 -0.3072 102 S3-2 0.10444E-11 -11.9811 0.51478E-12 -12.2884 0.49290E+00 -0.3072 103 S3- 0.24668E-14 -14.6079 0.20343E-14 -14.6916 0.82468E+00 -0.0837 104 S4-2 0.16627E-15 -15.7792 0.81956E-16 -16.0864 0.49290E+00 -0.3072 105 S5-2 0.17651E-19 -19.7532 0.87004E-20 -20.0605 0.49290E+00 -0.3072 106 SO2,aq 0.60401E-18 -18.2190 0.60401E-18 -18.2190 0.10000E+01 0.0000 107 SO3-2 0.10623E-10 -10.9738 0.53235E-11 -11.2738 0.50114E+00 -0.3000 108 HSO3- 0.73439E-12 -12.1341 0.60564E-12 -12.2178 0.82468E+00 -0.0837 109 HSO4- 0.91269E-09 -9.0397 0.75519E-09 -9.1219 0.82743E+00 -0.0823 111 S2O3-2 0.17465E-09 -9.7578 0.86086E-10 -10.0651 0.49290E+00 -0.3072 112 HS2O3- 0.33914E-16 -16.4696 0.27968E-16 -16.5533 0.82468E+00 -0.0837 Charge balance for all species = -.6114E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2187984E-08 -.2136473E-02 -.2149664E+01 0.0000 2 H2O 0.1000000E+01 0.5550781E+02 0.9982380E+06 0.0000 3 Cl- 0.1247066E-02 0.1253270E-02 0.4435434E+02 5.7528 4 SO4-- 0.8728273E-03 0.8737827E-03 0.8378992E+02 14.1161 5 HCO3- 0.1245304E-01 0.1349677E-01 0.8220922E+03 6.7529 6 HS- 0.3668629E-02 0.3685838E-02 0.1216845E+03 6.2215 7 Al+++ 0.1116374E-23 0.1539449E-05 0.4146387E-01 1.5839 8 H4SiO4 0.1024623E-02 0.1818063E-02 0.1744377E+03 -2.9894 9 Ca++ 0.5381153E-07 0.2309822E-06 0.9241089E-02 9.9023 10 Mg++ 0.4519761E-10 0.9289229E-10 0.2254441E-05 6.8242 11 Fe++ 0.3159865E-13 0.2006097E-11 0.1118382E-06 3.6693 12 K+ 0.1556945E-03 0.1567711E-03 0.6119325E+01 4.8501 13 Na+ 0.2206714E-01 0.2223285E-01 0.5102332E+03 7.0006 14 Mn++ 0.1134929E-08 0.2499756E-08 0.1370910E-03 8.2250 15 F- 0.7443999E-04 0.7470165E-04 0.1416696E+01 4.5277 16 HPO4-- 0.4532038E-07 0.4627581E-07 0.4433725E-02 9.8315 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1938217E-02 -.1924671E-02 -.1354593E-04 0.0000000E+00 2 H2O 0.4998394E+02 0.5000497E+02 -.2102364E-01 0.0000000E+00 3 Cl- 0.1129025E-02 0.1129025E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7871672E-03 0.7871590E-03 0.8147616E-08 0.0000000E+00 5 HCO3- 0.1215875E-01 0.1215875E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3320494E-02 0.3320437E-02 0.5703331E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1386833E-05 0.3388519E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1637827E-02 0.1051519E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1807220E-11 0.3259046E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002876E-01 0.3388519E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6729600E-04 0.6729600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.902445E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1679900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3389E-05 -5.470 0.8885E-03 -3.051 0.1406 0.3411E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.6187E-03 0.7802E-06 quartz 0.1051E-01 -1.979 0.6311 -0.200 99.86 0.2383 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.632035 g Volume = 0.238689 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1679900 moles log = -0.7747 Original solution: 1000.0103000 g Original solution / Rock added: 5952.80 (Water/Rock Ratio), log = 3.7747 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0253 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9952E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.4138E-02 1.0070 0.4273E-02 0.4243E-02 CH4,gas 0.9941E-04 1.0125 0.1032E-03 0.1019E-03 H2,gas 0.1216E-03 1.0005 0.1247E-03 0.1246E-03 H2S,gas 0.4574E-03 0.9960 0.4671E-03 0.4690E-03 S2,gas 0.5136E-18 1.0000 0.5266E-18 0.5266E-18 CO,gas 0.1385E-09 1.0000 0.1420E-09 0.1420E-09 SO3,gas 0.5251E-36 1.0000 0.5384E-36 0.5384E-36 SO2,gas 0.2548E-17 1.0000 0.2612E-17 0.2612E-17 HF,gas 0.1824E-11 1.0000 0.1870E-11 0.1870E-11 HCl,gas 0.5893E-15 1.0000 0.6042E-15 0.6042E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 -0.75827E-12 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.73 -4.07 -1.356 0.69464E+04 -2.369 3 CH4,gas 4.54 -1.14 -5.69 -1.421 0.97075E+04 -3.986 4 H2,gas 8.00 2.40 -5.60 -3.202 0.95671E+04 -3.904 5 H2S,gas -6.23 -11.26 -5.03 -2.515 0.85878E+04 -3.331 6 S2,gas -7.34 -27.31 -19.98 -3.073 0.34111E+05 -18.279 7 CO,gas 3.21 -8.33 -11.55 -3.553 0.19716E+05 -9.848 8 SO3,gas 17.12 -20.85 -37.97 -9.492 0.64829E+05 -36.269 9 SO2,gas 0.83 -18.45 -19.28 -5.142 0.32923E+05 -17.583 10 HF,gas 0.47 -12.95 -13.43 -6.714 0.22926E+05 -11.728 11 HCl,gas 5.19 -11.73 -16.92 -8.459 0.28887E+05 -15.219 12 acmite 7.71 3.49 -4.22 -0.438 0.72004E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 0.18 -4.82 -0.482 0.82356E+04 34 apatite-F -34.30 -38.84 -4.53 -0.378 0.77425E+04 38 aragonite 0.97 -0.83 -1.79 -0.598 0.30608E+04 40 calcite 0.81 -0.83 -1.64 -0.546 0.27966E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.01 -4.57 -0.305 0.78015E+04 45 celadonite 5.34 1.30 -4.04 -0.238 0.69002E+04 55 chloritoid-Mn 11.40 8.40 -3.00 -0.200 0.51186E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.53 -4.22 -0.352 0.72052E+04 68 diaspore 2.87 1.58 -1.29 -0.215 0.22024E+04 69 diamond -3.10 -5.93 -2.83 -0.809 0.48366E+04 86 gibbsite 4.08 1.58 -2.50 -0.356 0.42609E+04 89 graphite -3.55 -5.93 -2.39 -0.683 0.40788E+04 94 heulandite -5.83 -7.86 -2.03 -0.092 0.34641E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.14 -0.591 0.70680E+04 101 kaolinite -1.33 -2.81 -1.48 -0.134 0.25243E+04 102 kyanite 4.88 0.18 -4.70 -0.470 0.80215E+04 104 laumontite 2.88 1.11 -1.77 -0.118 0.30242E+04 105 lawsonite 9.62 7.09 -2.52 -0.168 0.43113E+04 106 leucite 4.12 0.46 -3.66 -0.366 0.62559E+04 109 magnesite 0.69 -3.90 -4.59 -1.532 0.78454E+04 119 microcline -2.49 -2.53 -0.05 -0.004 0.81788E+02 123 muscovite 2.58 0.63 -1.95 -0.115 0.33281E+04 124 paragonite 4.24 2.78 -1.46 -0.086 0.24854E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.59 -3.33 -1.110 0.56861E+04 147 pyrrhotiteFe0.875 -6.02 -8.35 -2.33 -0.857 0.39773E+04 148 pyroxmangite 7.40 5.24 -2.16 -0.433 0.36934E+04 149 pyrophyllite -6.18 -8.79 -2.61 -0.163 0.44637E+04 154 rhodochrosite -0.98 -2.50 -1.53 -0.509 0.26073E+04 155 rhodonite 7.45 5.24 -2.21 -0.442 0.37736E+04 156 sanidine -1.28 -2.53 -1.26 -0.097 0.21495E+04 158 siderite -2.61 -7.06 -4.45 -1.484 0.75998E+04 166 stilbite -7.52 -7.86 -0.33 -0.016 0.57029E+03 172 sulfur -9.15 -13.66 -4.50 -1.386 0.76907E+04 177 tephroite 18.09 13.46 -4.63 -0.661 0.78973E+04 180 topaz-H 4.62 0.18 -4.44 -0.404 0.75815E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.59 -3.18 -1.060 0.54289E+04 190 wairakite 3.95 1.11 -2.84 -0.167 0.48462E+04 191 walstromite 11.51 6.91 -4.60 -0.919 0.78482E+04 192 wollastonite 10.46 6.91 -3.55 -0.710 0.60586E+04 193 pseudo-wollastonite 11.00 6.91 -4.09 -0.817 0.69784E+04 196 beidellite-Ca -1.65 -5.65 -4.00 -0.248 0.68322E+04 197 beidellite-H -2.33 -7.28 -4.95 -0.316 0.84599E+04 198 beidellite-K -1.52 -5.68 -4.16 -0.255 0.71032E+04 199 beidellite-Mg -1.79 -6.15 -4.37 -0.270 0.74532E+04 200 beidellite-Na -1.34 -4.97 -3.63 -0.222 0.61954E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.14 -3.83 -0.478 0.65323E+04 204 montmorillonite-Ca -2.29 -5.43 -3.14 -0.194 0.53548E+04 205 montmorillonite-K -2.24 -5.46 -3.22 -0.197 0.55040E+04 206 montmorillonite-Mg -2.48 -5.93 -3.45 -0.214 0.58990E+04 207 montmorillonite-Na -2.04 -4.75 -2.71 -0.166 0.46319E+04 228 tobermorite 9.82 5.26 -4.56 -1.245 0.77927E+04 234 alabandite -0.98 -3.03 -2.06 -0.686 0.35121E+04 237 boehmite 4.41 1.58 -2.82 -0.470 0.48193E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.11 -0.91 -0.070 0.15481E+04 248 an25ab75 2.65 1.48 -1.16 -0.089 0.19821E+04 249 an30ab70 3.28 1.86 -1.42 -0.109 0.24257E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1679900 MOLES New total amount of reactant added: 0.1719900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1719900 Water: Moles liquid = 0.5001E+02 kg liquid = 0.9009E+00 Moles total = 0.4999E+02 kg total = 0.9005E+00 Activity = 1.0000 Stoichiometric ionic strength = .2246395E-01 Osmotic coef. = 0.9153 True ionic strength = .2395984E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1153E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.28174E-08 -8.5502 0.23406E-08 -8.6307 0.83075E+00 -0.0805 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.12730E-02 -2.8952 0.10503E-02 -2.9787 0.82501E+00 -0.0835 4 SO4-- 0.89394E-03 -3.0487 0.44241E-03 -3.3542 0.49490E+00 -0.3055 5 HCO3- 0.12954E-01 -1.8876 0.10705E-01 -1.9704 0.82640E+00 -0.0828 6 HS- 0.37496E-02 -2.4260 0.30940E-02 -2.5095 0.82515E+00 -0.0835 7 Al+++ 0.30567E-23 -23.5148 0.63232E-24 -24.1991 0.20687E+00 -0.6843 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.62183E-07 -7.2063 0.30514E-07 -7.5155 0.49071E+00 -0.3092 10 Mg++ 0.49226E-10 -10.3078 0.24028E-10 -10.6193 0.48813E+00 -0.3115 11 Fe++ 0.28300E-13 -13.5482 0.13832E-13 -13.8591 0.48875E+00 -0.3109 12 K+ 0.15566E-03 -3.8078 0.12867E-03 -3.8905 0.82662E+00 -0.0827 13 Na+ 0.22101E-01 -1.6556 0.18229E-01 -1.7392 0.82483E+00 -0.0836 14 Mn++ 0.12990E-08 -8.8864 0.63550E-09 -9.1969 0.48921E+00 -0.3105 15 F- 0.76204E-04 -4.1180 0.62720E-04 -4.2026 0.82306E+00 -0.0846 16 HPO4-- 0.45071E-07 -7.3461 0.22309E-07 -7.6515 0.49498E+00 -0.3054 18 HSiO3- 0.49547E-03 -3.3050 0.40876E-03 -3.3885 0.82501E+00 -0.0835 19 Ca(HSiO3)+ 0.34355E-09 -9.4640 0.28406E-09 -9.5466 0.82682E+00 -0.0826 20 Mg(HSiO3)+ 0.33668E-12 -12.4728 0.27838E-12 -12.5554 0.82682E+00 -0.0826 21 NaHSiO3,aq 0.12052E-03 -3.9189 0.12052E-03 -3.9189 0.10000E+01 0.0000 22 AlO+ 0.18992E-13 -13.7214 0.15703E-13 -13.8040 0.82682E+00 -0.0826 23 AlOH+2 0.37367E-18 -18.4275 0.18301E-18 -18.7375 0.48976E+00 -0.3100 24 HAlO2,aq 0.13361E-08 -8.8742 0.13361E-08 -8.8742 0.10000E+01 0.0000 25 AlO2- 0.15348E-05 -5.8139 0.12636E-05 -5.8984 0.82330E+00 -0.0844 26 CH4,aq 0.73214E-07 -7.1354 0.72721E-07 -7.1383 0.99327E+00 -0.0029 27 C2H6,aq 0.10217E-16 -16.9907 0.10148E-16 -16.9936 0.99327E+00 -0.0029 31 CO,aq 0.11982E-12 -12.9215 0.11982E-12 -12.9215 0.10000E+01 0.0000 32 CO2,aq 0.53900E-04 -4.2684 0.53537E-04 -4.2713 0.99327E+00 -0.0029 33 CO3-2 0.80918E-03 -3.0920 0.39949E-03 -3.3985 0.49369E+00 -0.3065 34 CaCO3,aq 0.15285E-06 -6.8157 0.15285E-06 -6.8157 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.10084E-07 -7.9964 0.83379E-08 -8.0789 0.82682E+00 -0.0826 36 CaCl+ 0.62726E-10 -10.2026 0.51863E-10 -10.2851 0.82682E+00 -0.0826 37 CaCl2,aq 0.12941E-13 -13.8880 0.12941E-13 -13.8880 0.10000E+01 0.0000 38 CaF+ 0.33795E-10 -10.4711 0.27942E-10 -10.5537 0.82682E+00 -0.0826 39 CaOH+ 0.11238E-08 -8.9493 0.92915E-09 -9.0319 0.82682E+00 -0.0826 40 CaSO4,aq 0.42868E-08 -8.3679 0.42868E-08 -8.3679 0.10000E+01 0.0000 41 HCl,aq 0.45045E-12 -12.3464 0.45045E-12 -12.3464 0.10000E+01 0.0000 45 HF,aq 0.10049E-08 -8.9979 0.10049E-08 -8.9979 0.10000E+01 0.0000 46 HF2- 0.25795E-13 -13.5885 0.21281E-13 -13.6720 0.82501E+00 -0.0835 48 FeCl+ 0.27809E-16 -16.5558 0.22993E-16 -16.6384 0.82682E+00 -0.0826 51 FeF+ 0.53617E-16 -16.2707 0.44332E-16 -16.3533 0.82682E+00 -0.0826 53 FeO,aq 0.98129E-13 -13.0082 0.98129E-13 -13.0082 0.10000E+01 0.0000 54 FeOH+ 0.23265E-12 -12.6333 0.19236E-12 -12.7159 0.82682E+00 -0.0826 55 HFeO2- 0.53172E-12 -12.2743 0.43867E-12 -12.3579 0.82501E+00 -0.0835 56 FeO+ 0.18592E-17 -17.7307 0.15372E-17 -17.8133 0.82682E+00 -0.0826 58 FeO2- 0.69596E-13 -13.1574 0.57417E-13 -13.2410 0.82501E+00 -0.0835 59 HFeO2,aq 0.17092E-13 -13.7672 0.17092E-13 -13.7672 0.10000E+01 0.0000 60 H2,aq 0.89693E-07 -7.0472 0.89089E-07 -7.0502 0.99327E+00 -0.0029 61 KCl,aq 0.24493E-08 -8.6110 0.24493E-08 -8.6110 0.10000E+01 0.0000 62 KHSO4,aq 0.37672E-15 -15.4240 0.37672E-15 -15.4240 0.10000E+01 0.0000 63 KOH,aq 0.23478E-07 -7.6293 0.23478E-07 -7.6293 0.10000E+01 0.0000 64 KSO4- 0.10707E-05 -5.9703 0.88337E-06 -6.0539 0.82501E+00 -0.0835 65 MgCO3,aq 0.30169E-10 -10.5204 0.30169E-10 -10.5204 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.81142E-11 -11.0908 0.67090E-11 -11.1733 0.82682E+00 -0.0826 67 MgCl+ 0.44768E-13 -13.3490 0.37015E-13 -13.4316 0.82682E+00 -0.0826 68 MgF+ 0.98579E-13 -13.0062 0.81507E-13 -13.0888 0.82682E+00 -0.0826 69 MgOH+ 0.48966E-11 -11.3101 0.40487E-11 -11.3927 0.82682E+00 -0.0826 71 MnF+ 0.81198E-12 -12.0905 0.67137E-12 -12.1730 0.82682E+00 -0.0826 72 MnO,aq 0.12014E-09 -9.9203 0.12014E-09 -9.9203 0.10000E+01 0.0000 73 MnOH+ 0.99301E-09 -9.0030 0.82104E-09 -9.0856 0.82682E+00 -0.0826 74 MnO2-2 0.14742E-14 -14.8315 0.72779E-15 -15.1380 0.49369E+00 -0.3065 75 HMnO2- 0.45235E-12 -12.3445 0.37320E-12 -12.4281 0.82501E+00 -0.0835 78 MnCl+ 0.49709E-11 -11.3036 0.41101E-11 -11.3862 0.82682E+00 -0.0826 79 MnSO4,aq 0.81167E-10 -10.0906 0.81167E-10 -10.0906 0.10000E+01 0.0000 80 NaCl,aq 0.63449E-05 -5.1976 0.63449E-05 -5.1976 0.10000E+01 0.0000 81 NaF,aq 0.26768E-06 -6.5724 0.26768E-06 -6.5724 0.10000E+01 0.0000 82 NaOH,aq 0.33463E-05 -5.4754 0.33463E-05 -5.4754 0.10000E+01 0.0000 84 OH- 0.29983E-03 -3.5231 0.24685E-03 -3.6076 0.82330E+00 -0.0844 89 HPO3-2 0.12546E-16 -16.9015 0.61938E-17 -17.2080 0.49369E+00 -0.3065 91 H2PO3- 0.35237E-19 -19.4530 0.29071E-19 -19.5365 0.82501E+00 -0.0835 92 H3PO4,aq 0.85476E-15 -15.0682 0.85476E-15 -15.0682 0.10000E+01 0.0000 93 H2PO4- 0.11663E-08 -8.9332 0.96324E-09 -9.0163 0.82591E+00 -0.0831 94 PO4-3 0.35530E-10 -10.4494 0.77767E-11 -11.1092 0.21888E+00 -0.6598 97 H2P2O7-2 0.14736E-18 -18.8316 0.72751E-19 -19.1382 0.49369E+00 -0.3065 98 HP2O7-3 0.29966E-16 -16.5234 0.62065E-17 -17.2072 0.20712E+00 -0.6838 99 P2O7-4 0.99550E-17 -17.0020 0.63349E-18 -18.1983 0.63636E-01 -1.1963 100 H2S,aq 0.22533E-04 -4.6472 0.22381E-04 -4.6501 0.99327E+00 -0.0029 101 S2-2 0.48227E-08 -8.3167 0.23809E-08 -8.6233 0.49369E+00 -0.3065 102 S3-2 0.16323E-11 -11.7872 0.80585E-12 -12.0937 0.49369E+00 -0.3065 103 S3- 0.51343E-14 -14.2895 0.42358E-14 -14.3731 0.82501E+00 -0.0835 104 S4-2 0.36494E-15 -15.4378 0.18017E-15 -15.7443 0.49369E+00 -0.3065 105 S5-2 0.54407E-19 -19.2643 0.26860E-19 -19.5709 0.49369E+00 -0.3065 106 SO2,aq 0.96429E-18 -18.0158 0.96429E-18 -18.0158 0.10000E+01 0.0000 107 SO3-2 0.10205E-10 -10.9912 0.51219E-11 -11.2906 0.50191E+00 -0.2994 108 HSO3- 0.90980E-12 -12.0411 0.75060E-12 -12.1246 0.82501E+00 -0.0835 109 HSO4- 0.12056E-08 -8.9188 0.99792E-09 -9.0009 0.82775E+00 -0.0821 111 S2O3-2 0.23560E-09 -9.6278 0.11631E-09 -9.9344 0.49369E+00 -0.3065 112 HS2O3- 0.59002E-16 -16.2291 0.48677E-16 -16.3127 0.82501E+00 -0.0835 Charge balance for all species = -.6113E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2817405E-08 -.1658247E-02 -.1668468E+01 0.0000 2 H2O 0.1000000E+01 0.5550789E+02 0.9982292E+06 0.0000 3 Cl- 0.1273029E-02 0.1279377E-02 0.4527782E+02 5.6520 4 SO4-- 0.8939394E-03 0.8949215E-03 0.8581612E+02 13.9072 5 HCO3- 0.1295351E-01 0.1381682E-01 0.8415781E+03 6.6603 6 HS- 0.3749629E-02 0.3772267E-02 0.1245366E+03 6.1212 7 Al+++ 0.3056662E-23 0.1536150E-05 0.4137459E-01 1.6930 8 H4SiO4 0.1024622E-02 0.1640607E-02 0.1574098E+03 -2.9894 9 Ca++ 0.6218314E-07 0.2309660E-06 0.9240344E-02 9.7459 10 Mg++ 0.4922552E-10 0.9288574E-10 0.2254259E-05 6.6421 11 Fe++ 0.2830014E-13 0.9775727E-12 0.5449831E-07 3.4022 12 K+ 0.1556634E-03 0.1567601E-03 0.6118832E+01 4.7402 13 Na+ 0.2210080E-01 0.2223128E-01 0.5101920E+03 6.8915 14 Mn++ 0.1299035E-08 0.2499580E-08 0.1370799E-03 8.0645 15 F- 0.7620362E-04 0.7647234E-04 0.1450262E+01 4.4281 16 HPO4-- 0.4507073E-07 0.4627254E-07 0.4433367E-02 9.6098 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1507517E-02 -.1493959E-02 -.1355742E-04 0.0000000E+00 2 H2O 0.4998722E+02 0.5000856E+02 -.2134315E-01 0.0000000E+00 3 Cl- 0.1152625E-02 0.1152625E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8062672E-03 0.8062590E-03 0.8147847E-08 0.0000000E+00 5 HCO3- 0.1244795E-01 0.1244795E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3398594E-02 0.3398537E-02 0.5703493E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1383959E-05 0.3391393E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1478068E-02 0.1067495E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.8807218E-12 0.3259139E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002876E-01 0.3391393E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6889600E-04 0.6889600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.902517E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1719900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3391E-05 -5.470 0.8893E-03 -3.051 0.1386 0.3414E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.6094E-03 0.7802E-06 quartz 0.1066E-01 -1.972 0.6407 -0.193 99.86 0.2420 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.641633 g Volume = 0.242313 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1719900 moles log = -0.7645 Original solution: 1000.0103000 g Original solution / Rock added: 5814.35 (Water/Rock Ratio), log = 3.7645 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0269 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9936E+00 0.9859 0.1006E+01 0.1020E+01 CO2,gas 0.5539E-02 1.0070 0.5728E-02 0.5688E-02 CH4,gas 0.1029E-03 1.0125 0.1070E-03 0.1057E-03 H2,gas 0.1138E-03 1.0005 0.1170E-03 0.1169E-03 H2S,gas 0.6015E-03 0.9960 0.6152E-03 0.6177E-03 S2,gas 0.1011E-17 1.0000 0.1039E-17 0.1039E-17 CO,gas 0.1739E-09 1.0000 0.1785E-09 0.1785E-09 SO3,gas 0.8924E-36 1.0000 0.9164E-36 0.9164E-36 SO2,gas 0.4061E-17 1.0000 0.4170E-17 0.4170E-17 HF,gas 0.2403E-11 1.0000 0.2467E-11 0.2467E-11 HCl,gas 0.7740E-15 1.0000 0.7948E-15 0.7948E-15 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.60 -3.94 -1.314 0.67291E+04 -2.242 3 CH4,gas 4.54 -1.13 -5.67 -1.417 0.96804E+04 -3.970 4 H2,gas 8.00 2.37 -5.63 -3.218 0.96146E+04 -3.932 5 H2S,gas -6.23 -11.14 -4.91 -2.455 0.83836E+04 -3.211 6 S2,gas -7.34 -27.02 -19.68 -3.028 0.33607E+05 -17.984 7 CO,gas 3.21 -8.23 -11.45 -3.522 0.19546E+05 -9.748 8 SO3,gas 17.12 -20.62 -37.74 -9.434 0.64435E+05 -36.038 9 SO2,gas 0.83 -18.25 -19.08 -5.088 0.32577E+05 -17.380 10 HF,gas 0.47 -12.83 -13.31 -6.653 0.22721E+05 -11.608 11 HCl,gas 5.19 -11.61 -16.80 -8.399 0.28683E+05 -15.100 12 acmite 7.71 3.13 -4.58 -0.476 0.78191E+04 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 0.40 -4.60 -0.460 0.78629E+04 34 apatite-F -34.30 -38.84 -4.54 -0.378 0.77547E+04 38 aragonite 0.97 -0.86 -1.82 -0.607 0.31106E+04 40 calcite 0.81 -0.86 -1.67 -0.556 0.28464E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.05 -4.53 -0.302 0.77398E+04 45 celadonite 5.34 1.12 -4.22 -0.248 0.72125E+04 55 chloritoid-Mn 11.40 8.46 -2.94 -0.196 0.50201E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 3.39 -5.00 -0.454 0.85325E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.54 -4.22 -0.352 0.72065E+04 68 diaspore 2.87 1.69 -1.18 -0.197 0.20160E+04 69 diamond -3.10 -5.86 -2.76 -0.789 0.47144E+04 86 gibbsite 4.08 1.69 -2.39 -0.341 0.40746E+04 89 graphite -3.55 -5.86 -2.32 -0.662 0.39566E+04 94 heulandite -5.83 -7.79 -1.97 -0.089 0.33585E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.14 -0.591 0.70693E+04 101 kaolinite -1.33 -2.59 -1.26 -0.115 0.21516E+04 102 kyanite 4.88 0.40 -4.48 -0.448 0.76488E+04 104 laumontite 2.88 1.17 -1.71 -0.114 0.29186E+04 105 lawsonite 9.62 7.15 -2.46 -0.164 0.42057E+04 106 leucite 4.12 0.45 -3.66 -0.366 0.62572E+04 109 magnesite 0.69 -3.96 -4.65 -1.550 0.79391E+04 119 microcline -2.49 -2.54 -0.05 -0.004 0.83073E+02 123 muscovite 2.58 0.85 -1.73 -0.102 0.29567E+04 124 paragonite 4.24 3.00 -1.24 -0.073 0.21127E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.74 -3.48 -1.159 0.59379E+04 147 pyrrhotiteFe0.875 -6.02 -8.46 -2.44 -0.897 0.41662E+04 148 pyroxmangite 7.40 5.08 -2.32 -0.465 0.39675E+04 149 pyrophyllite -6.18 -8.57 -2.40 -0.150 0.40911E+04 154 rhodochrosite -0.98 -2.54 -1.56 -0.520 0.26642E+04 155 rhodonite 7.45 5.08 -2.37 -0.474 0.40478E+04 156 sanidine -1.28 -2.54 -1.26 -0.097 0.21508E+04 158 siderite -2.61 -7.20 -4.59 -1.530 0.78385E+04 159 sillimanite 5.26 0.40 -4.86 -0.486 0.83068E+04 166 stilbite -7.52 -7.79 -0.27 -0.013 0.46471E+03 172 sulfur -9.15 -13.51 -4.36 -1.341 0.74389E+04 177 tephroite 18.09 13.14 -4.95 -0.707 0.84456E+04 180 topaz-H 4.62 0.40 -4.22 -0.384 0.72089E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.74 -3.33 -1.109 0.56807E+04 190 wairakite 3.95 1.17 -2.78 -0.163 0.47406E+04 191 walstromite 11.51 6.76 -4.75 -0.951 0.81153E+04 192 wollastonite 10.46 6.76 -3.70 -0.741 0.63257E+04 193 pseudo-wollastonite 11.00 6.76 -4.24 -0.849 0.72455E+04 196 beidellite-Ca -1.65 -5.42 -3.77 -0.233 0.64421E+04 197 beidellite-H -2.33 -7.03 -4.70 -0.300 0.80257E+04 198 beidellite-K -1.52 -5.46 -3.94 -0.241 0.67310E+04 199 beidellite-Mg -1.79 -5.93 -4.14 -0.256 0.70704E+04 200 beidellite-Na -1.34 -4.75 -3.41 -0.209 0.58228E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.02 -3.70 -0.462 0.63151E+04 204 montmorillonite-Ca -2.29 -5.33 -3.04 -0.188 0.51903E+04 205 montmorillonite-K -2.24 -5.37 -3.14 -0.192 0.53574E+04 206 montmorillonite-Mg -2.48 -5.84 -3.36 -0.208 0.57418E+04 207 montmorillonite-Na -2.04 -4.66 -2.63 -0.161 0.44848E+04 228 tobermorite 9.82 5.13 -4.69 -1.281 0.80152E+04 234 alabandite -0.98 -3.08 -2.10 -0.699 0.35820E+04 237 boehmite 4.41 1.69 -2.71 -0.452 0.46330E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.12 -0.89 -0.069 0.15270E+04 248 an25ab75 2.65 1.50 -1.15 -0.088 0.19557E+04 249 an30ab70 3.28 1.88 -1.40 -0.108 0.23940E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1719900 MOLES New total amount of reactant added: 0.1759900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 9 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1759900 Water: Moles liquid = 0.5001E+02 kg liquid = 0.9010E+00 Moles total = 0.4999E+02 kg total = 0.9006E+00 Activity = 1.0000 Stoichiometric ionic strength = .2272254E-01 Osmotic coef. = 0.9150 True ionic strength = .2381529E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1176E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.38618E-08 -8.4132 0.32094E-08 -8.4936 0.83107E+00 -0.0804 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.12990E-02 -2.8864 0.10721E-02 -2.9698 0.82535E+00 -0.0834 4 SO4-- 0.91505E-03 -3.0386 0.45361E-03 -3.3433 0.49572E+00 -0.3048 5 HCO3- 0.13448E-01 -1.8713 0.11118E-01 -1.9540 0.82674E+00 -0.0826 6 HS- 0.38270E-02 -2.4171 0.31592E-02 -2.5004 0.82549E+00 -0.0833 7 Al+++ 0.10745E-22 -22.9688 0.22314E-23 -23.6514 0.20766E+00 -0.6827 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.73946E-07 -7.1311 0.36348E-07 -7.4395 0.49155E+00 -0.3084 10 Mg++ 0.54092E-10 -10.2669 0.26450E-10 -10.5776 0.48897E+00 -0.3107 11 Fe++ 0.25015E-13 -13.6018 0.12247E-13 -13.9120 0.48959E+00 -0.3102 12 K+ 0.15563E-03 -3.8079 0.12870E-03 -3.8904 0.82696E+00 -0.0825 13 Na+ 0.22132E-01 -1.6550 0.18263E-01 -1.7384 0.82518E+00 -0.0835 14 Mn++ 0.14910E-08 -8.8265 0.73067E-09 -9.1363 0.49005E+00 -0.3098 15 F- 0.77967E-04 -4.1081 0.64199E-04 -4.1925 0.82341E+00 -0.0844 16 HPO4-- 0.44657E-07 -7.3501 0.22141E-07 -7.6548 0.49580E+00 -0.3047 18 HSiO3- 0.36118E-03 -3.4423 0.29810E-03 -3.5256 0.82535E+00 -0.0834 19 Ca(HSiO3)+ 0.29833E-09 -9.5253 0.24676E-09 -9.6077 0.82716E+00 -0.0824 20 Mg(HSiO3)+ 0.27016E-12 -12.5684 0.22347E-12 -12.6508 0.82716E+00 -0.0824 21 NaHSiO3,aq 0.88053E-04 -4.0553 0.88053E-04 -4.0553 0.10000E+01 0.0000 22 AlO+ 0.35629E-13 -13.4482 0.29471E-13 -13.5306 0.82716E+00 -0.0824 23 AlOH+2 0.96000E-18 -18.0177 0.47098E-18 -18.3270 0.49060E+00 -0.3093 24 HAlO2,aq 0.18287E-08 -8.7379 0.18287E-08 -8.7379 0.10000E+01 0.0000 25 AlO2- 0.15313E-05 -5.8149 0.12613E-05 -5.8992 0.82365E+00 -0.0843 26 CH4,aq 0.75731E-07 -7.1207 0.75215E-07 -7.1237 0.99319E+00 -0.0030 27 C2H6,aq 0.11840E-16 -16.9266 0.11760E-16 -16.9296 0.99319E+00 -0.0030 31 CO,aq 0.15752E-12 -12.8027 0.15752E-12 -12.8027 0.10000E+01 0.0000 32 CO2,aq 0.76767E-04 -4.1148 0.76245E-04 -4.1178 0.99319E+00 -0.0030 33 CO3-2 0.61187E-03 -3.2133 0.30258E-03 -3.5192 0.49452E+00 -0.3058 34 CaCO3,aq 0.13791E-06 -6.8604 0.13791E-06 -6.8604 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.12471E-07 -7.9041 0.10315E-07 -7.9865 0.82716E+00 -0.0824 36 CaCl+ 0.76243E-10 -10.1178 0.63065E-10 -10.2002 0.82716E+00 -0.0824 37 CaCl2,aq 0.16064E-13 -13.7942 0.16064E-13 -13.7942 0.10000E+01 0.0000 38 CaF+ 0.41189E-10 -10.3852 0.34070E-10 -10.4676 0.82716E+00 -0.0824 39 CaOH+ 0.97581E-09 -9.0106 0.80715E-09 -9.0930 0.82716E+00 -0.0824 40 CaSO4,aq 0.52357E-08 -8.2810 0.52357E-08 -8.2810 0.10000E+01 0.0000 41 HCl,aq 0.63053E-12 -12.2003 0.63053E-12 -12.2003 0.10000E+01 0.0000 45 HF,aq 0.14105E-08 -8.8506 0.14105E-08 -8.8506 0.10000E+01 0.0000 46 HF2- 0.37042E-13 -13.4313 0.30573E-13 -13.5147 0.82535E+00 -0.0834 48 FeCl+ 0.25126E-16 -16.5999 0.20783E-16 -16.6823 0.82716E+00 -0.0824 51 FeF+ 0.48574E-16 -16.3136 0.40179E-16 -16.3960 0.82716E+00 -0.0824 53 FeO,aq 0.46211E-13 -13.3353 0.46211E-13 -13.3353 0.10000E+01 0.0000 54 FeOH+ 0.15017E-12 -12.8234 0.12421E-12 -12.9058 0.82716E+00 -0.0824 55 HFeO2- 0.18253E-12 -12.7387 0.15065E-12 -12.8220 0.82535E+00 -0.0834 56 FeO+ 0.12490E-17 -17.9034 0.10331E-17 -17.9859 0.82716E+00 -0.0824 58 FeO2- 0.24865E-13 -13.6044 0.20523E-13 -13.6878 0.82535E+00 -0.0834 59 HFeO2,aq 0.83772E-14 -14.0769 0.83772E-14 -14.0769 0.10000E+01 0.0000 60 H2,aq 0.82807E-07 -7.0819 0.82243E-07 -7.0849 0.99319E+00 -0.0030 61 KCl,aq 0.25008E-08 -8.6019 0.25008E-08 -8.6019 0.10000E+01 0.0000 62 KHSO4,aq 0.52976E-15 -15.2759 0.52976E-15 -15.2759 0.10000E+01 0.0000 63 KOH,aq 0.17125E-07 -7.7664 0.17125E-07 -7.7664 0.10000E+01 0.0000 64 KSO4- 0.10976E-05 -5.9596 0.90592E-06 -6.0429 0.82535E+00 -0.0834 65 MgCO3,aq 0.25153E-10 -10.5994 0.25153E-10 -10.5994 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.92728E-11 -11.0328 0.76701E-11 -11.1152 0.82716E+00 -0.0824 67 MgCl+ 0.50284E-13 -13.2986 0.41593E-13 -13.3810 0.82716E+00 -0.0824 68 MgF+ 0.11103E-12 -12.9546 0.91836E-13 -13.0370 0.82716E+00 -0.0824 69 MgOH+ 0.39292E-11 -11.4057 0.32501E-11 -11.4881 0.82716E+00 -0.0824 71 MnF+ 0.95520E-12 -12.0199 0.79010E-12 -12.1023 0.82716E+00 -0.0824 72 MnO,aq 0.73461E-10 -10.1339 0.73461E-10 -10.1339 0.10000E+01 0.0000 73 MnOH+ 0.83227E-09 -9.0797 0.68842E-09 -9.1621 0.82716E+00 -0.0824 74 MnO2-2 0.47861E-15 -15.3200 0.23668E-15 -15.6258 0.49452E+00 -0.3058 75 HMnO2- 0.20164E-12 -12.6954 0.16642E-12 -12.7788 0.82535E+00 -0.0834 78 MnCl+ 0.58319E-11 -11.2342 0.48239E-11 -11.3166 0.82716E+00 -0.0824 79 MnSO4,aq 0.95683E-10 -10.0192 0.95683E-10 -10.0192 0.10000E+01 0.0000 80 NaCl,aq 0.64890E-05 -5.1878 0.64890E-05 -5.1878 0.10000E+01 0.0000 81 NaF,aq 0.27450E-06 -6.5615 0.27450E-06 -6.5615 0.10000E+01 0.0000 82 NaOH,aq 0.24449E-05 -5.6117 0.24449E-05 -5.6117 0.10000E+01 0.0000 84 OH- 0.21857E-03 -3.6604 0.18002E-03 -3.7447 0.82365E+00 -0.0843 89 HPO3-2 0.11475E-16 -16.9402 0.56747E-17 -17.2461 0.49452E+00 -0.3058 91 H2PO3- 0.44250E-19 -19.3541 0.36522E-19 -19.4374 0.82535E+00 -0.0834 92 H3PO4,aq 0.15951E-14 -14.7972 0.15951E-14 -14.7972 0.10000E+01 0.0000 93 H2PO4- 0.15865E-08 -8.7996 0.13109E-08 -8.8824 0.82625E+00 -0.0829 94 PO4-3 0.25625E-10 -10.5913 0.56286E-11 -11.2496 0.21966E+00 -0.6583 97 H2P2O7-2 0.27247E-18 -18.5647 0.13474E-18 -18.8705 0.49452E+00 -0.3058 98 HP2O7-3 0.40319E-16 -16.3945 0.83829E-17 -17.0766 0.20791E+00 -0.6821 99 P2O7-4 0.97408E-17 -17.0114 0.62399E-18 -18.2048 0.64059E-01 -1.1934 100 H2S,aq 0.31551E-04 -4.5010 0.31336E-04 -4.5040 0.99319E+00 -0.0030 101 S2-2 0.54375E-08 -8.2646 0.26889E-08 -8.5704 0.49452E+00 -0.3058 102 S3-2 0.27913E-11 -11.5542 0.13803E-11 -11.8600 0.49452E+00 -0.3058 103 S3- 0.12546E-13 -13.9015 0.10355E-13 -13.9849 0.82535E+00 -0.0834 104 S4-2 0.94651E-15 -15.0239 0.46807E-15 -15.3297 0.49452E+00 -0.3058 105 S5-2 0.21402E-18 -18.6696 0.10584E-18 -18.9754 0.49452E+00 -0.3058 106 SO2,aq 0.17161E-17 -17.7654 0.17161E-17 -17.7654 0.10000E+01 0.0000 107 SO3-2 0.96436E-11 -11.0158 0.48479E-11 -11.3144 0.50271E+00 -0.2987 108 HSO3- 0.11803E-11 -11.9280 0.97419E-12 -12.0114 0.82535E+00 -0.0834 109 HSO4- 0.16943E-08 -8.7710 0.14030E-08 -8.8529 0.82809E+00 -0.0819 111 S2O3-2 0.33765E-09 -9.4715 0.16698E-09 -9.7773 0.49452E+00 -0.3058 112 HS2O3- 0.11609E-15 -15.9352 0.95819E-16 -16.0185 0.82535E+00 -0.0834 Charge balance for all species = -.6113E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3861812E-08 -.1180089E-02 -.1187350E+01 0.0000 2 H2O 0.1000000E+01 0.5550795E+02 0.9982195E+06 0.0000 3 Cl- 0.1298989E-02 0.1305480E-02 0.4620113E+02 5.5238 4 SO4-- 0.9150475E-03 0.9160574E-03 0.8784193E+02 13.6438 5 HCO3- 0.1344797E-01 0.1413683E-01 0.8610603E+03 6.5396 6 HS- 0.3827026E-02 0.3858684E-02 0.1273881E+03 5.9931 7 Al+++ 0.1074548E-22 0.1533146E-05 0.4129324E-01 1.8293 8 H4SiO4 0.1024621E-02 0.1473853E-02 0.1414089E+03 -2.9894 9 Ca++ 0.7394641E-07 0.2309497E-06 0.9239593E-02 9.5476 10 Mg++ 0.5409227E-10 0.9287920E-10 0.2254076E-05 6.4096 11 Fe++ 0.2501520E-13 0.4372413E-12 0.2437533E-07 3.0752 12 K+ 0.1556318E-03 0.1567490E-03 0.6118335E+01 4.6032 13 Na+ 0.2213245E-01 0.2222971E-01 0.5101505E+03 6.7551 14 Mn++ 0.1490999E-08 0.2499404E-08 0.1370688E-03 7.8509 15 F- 0.7796683E-04 0.7824278E-04 0.1483821E+01 4.3011 16 HPO4-- 0.4465713E-07 0.4626929E-07 0.4433007E-02 9.3323 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1076817E-02 -.1063249E-02 -.1356786E-04 0.0000000E+00 2 H2O 0.4999049E+02 0.5001214E+02 -.2164343E-01 0.0000000E+00 3 Cl- 0.1176225E-02 0.1176225E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8253672E-03 0.8253590E-03 0.8147969E-08 0.0000000E+00 5 HCO3- 0.1273715E-01 0.1273715E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3476694E-02 0.3476637E-02 0.5703578E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1381350E-05 0.3394002E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1327928E-02 0.1082509E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.3939503E-12 0.3259188E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002876E-01 0.3394002E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7049600E-04 0.7049600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.902591E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1759900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3394E-05 -5.469 0.8900E-03 -3.051 0.1368 0.3416E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.6010E-03 0.7802E-06 quartz 0.1081E-01 -1.966 0.6498 -0.187 99.86 0.2454 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.650654 g Volume = 0.245720 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1759900 moles log = -0.7545 Original solution: 1000.0103000 g Original solution / Rock added: 5682.20 (Water/Rock Ratio), log = 3.7545 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0296 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9911E+00 0.9858 0.1006E+01 0.1020E+01 CO2,gas 0.7868E-02 1.0070 0.8157E-02 0.8101E-02 CH4,gas 0.1062E-03 1.0125 0.1107E-03 0.1093E-03 H2,gas 0.1048E-03 1.0005 0.1080E-03 0.1079E-03 H2S,gas 0.8400E-03 0.9960 0.8614E-03 0.8649E-03 S2,gas 0.2320E-17 1.0000 0.2389E-17 0.2389E-17 CO,gas 0.2280E-09 1.0000 0.2347E-09 0.2347E-09 SO3,gas 0.1716E-35 1.0000 0.1767E-35 0.1767E-35 SO2,gas 0.7208E-17 1.0000 0.7421E-17 0.7421E-17 HF,gas 0.3364E-11 1.0000 0.3463E-11 0.3463E-11 HCl,gas 0.1081E-14 1.0000 0.1113E-14 0.1113E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.45 -3.79 -1.262 0.64669E+04 -2.088 3 CH4,gas 4.54 -1.11 -5.65 -1.414 0.96554E+04 -3.956 4 H2,gas 8.00 2.33 -5.67 -3.238 0.96739E+04 -3.967 5 H2S,gas -6.23 -10.99 -4.76 -2.382 0.81340E+04 -3.065 6 S2,gas -7.34 -26.66 -19.32 -2.972 0.32990E+05 -17.622 7 CO,gas 3.21 -8.11 -11.33 -3.486 0.19343E+05 -9.629 8 SO3,gas 17.12 -20.33 -37.45 -9.363 0.63948E+05 -35.753 9 SO2,gas 0.83 -18.00 -18.83 -5.021 0.32149E+05 -17.130 10 HF,gas 0.47 -12.69 -13.16 -6.580 0.22469E+05 -11.461 11 HCl,gas 5.19 -11.46 -16.65 -8.326 0.28434E+05 -14.954 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 0.67 -4.33 -0.433 0.73974E+04 34 apatite-F -34.30 -38.87 -4.57 -0.381 0.78079E+04 38 aragonite 0.97 -0.90 -1.87 -0.622 0.31869E+04 40 calcite 0.81 -0.90 -1.71 -0.571 0.29227E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.09 -4.49 -0.300 0.76714E+04 45 celadonite 5.34 0.88 -4.46 -0.262 0.76108E+04 55 chloritoid-Mn 11.40 8.52 -2.88 -0.192 0.49193E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 3.66 -4.72 -0.430 0.80670E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.54 -4.22 -0.352 0.72077E+04 68 diaspore 2.87 1.83 -1.04 -0.174 0.17833E+04 69 diamond -3.10 -5.78 -2.68 -0.765 0.45708E+04 86 gibbsite 4.08 1.83 -2.25 -0.321 0.38418E+04 89 graphite -3.55 -5.78 -2.23 -0.638 0.38130E+04 94 heulandite -5.83 -7.72 -1.89 -0.086 0.32316E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.14 -0.592 0.70705E+04 101 kaolinite -1.33 -2.32 -0.99 -0.090 0.16862E+04 102 kyanite 4.88 0.67 -4.21 -0.421 0.71833E+04 104 laumontite 2.88 1.25 -1.63 -0.109 0.27916E+04 105 lawsonite 9.62 7.23 -2.39 -0.159 0.40787E+04 106 leucite 4.12 0.45 -3.67 -0.367 0.62584E+04 109 magnesite 0.69 -4.04 -4.73 -1.576 0.80739E+04 119 microcline -2.49 -2.54 -0.05 -0.004 0.84293E+02 123 muscovite 2.58 1.12 -1.46 -0.086 0.24924E+04 124 paragonite 4.24 3.27 -0.96 -0.057 0.16472E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -7.92 -3.66 -1.219 0.62468E+04 147 pyrrhotiteFe0.875 -6.02 -8.59 -2.58 -0.947 0.43979E+04 148 pyroxmangite 7.40 4.86 -2.54 -0.507 0.43323E+04 149 pyrophyllite -6.18 -8.30 -2.12 -0.133 0.36256E+04 154 rhodochrosite -0.98 -2.60 -1.62 -0.540 0.27667E+04 155 rhodonite 7.45 4.86 -2.58 -0.517 0.44125E+04 156 sanidine -1.28 -2.54 -1.26 -0.097 0.21520E+04 158 siderite -2.61 -7.37 -4.76 -1.588 0.81348E+04 159 sillimanite 5.26 0.67 -4.59 -0.459 0.78414E+04 166 stilbite -7.52 -7.72 -0.20 -0.009 0.33773E+03 172 sulfur -9.15 -13.33 -4.18 -1.285 0.71300E+04 180 topaz-H 4.62 0.67 -3.95 -0.359 0.67434E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -7.92 -3.51 -1.169 0.59896E+04 190 wairakite 3.95 1.25 -2.70 -0.159 0.46136E+04 191 walstromite 11.51 6.56 -4.95 -0.990 0.84538E+04 192 wollastonite 10.46 6.56 -3.90 -0.781 0.66642E+04 193 pseudo-wollastonite 11.00 6.56 -4.44 -0.888 0.75840E+04 196 beidellite-Ca -1.65 -5.13 -3.49 -0.216 0.59557E+04 197 beidellite-H -2.33 -6.71 -4.38 -0.280 0.74834E+04 198 beidellite-K -1.52 -5.19 -3.67 -0.225 0.62659E+04 199 beidellite-Mg -1.79 -5.65 -3.86 -0.239 0.65936E+04 200 beidellite-Na -1.34 -4.48 -3.14 -0.192 0.53573E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.86 -3.54 -0.443 0.60529E+04 204 montmorillonite-Ca -2.29 -5.21 -2.92 -0.181 0.49885E+04 205 montmorillonite-K -2.24 -5.27 -3.03 -0.186 0.51769E+04 206 montmorillonite-Mg -2.48 -5.73 -3.25 -0.201 0.55497E+04 207 montmorillonite-Na -2.04 -4.56 -2.52 -0.154 0.43040E+04 228 tobermorite 9.82 4.96 -4.86 -1.326 0.82971E+04 234 alabandite -0.98 -3.14 -2.17 -0.722 0.36971E+04 237 boehmite 4.41 1.83 -2.58 -0.430 0.44002E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.14 -0.88 -0.068 0.15016E+04 248 an25ab75 2.65 1.52 -1.13 -0.087 0.19239E+04 249 an30ab70 3.28 1.90 -1.38 -0.106 0.23559E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1759900 MOLES New total amount of reactant added: 0.1799900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 9 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1799900 Water: Moles liquid = 0.5002E+02 kg liquid = 0.9011E+00 Moles total = 0.4999E+02 kg total = 0.9007E+00 Activity = 1.0000 Stoichiometric ionic strength = .2298112E-01 Osmotic coef. = 0.9146 True ionic strength = .2367270E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1200E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.58197E-08 -8.2351 0.48384E-08 -8.3153 0.83139E+00 -0.0802 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13249E-02 -2.8778 0.10940E-02 -2.9610 0.82570E+00 -0.0832 4 SO4-- 0.93615E-03 -3.0287 0.46483E-03 -3.3327 0.49654E+00 -0.3040 5 HCO3- 0.13917E-01 -1.8564 0.11511E-01 -1.9389 0.82707E+00 -0.0825 6 HS- 0.38965E-02 -2.4093 0.32179E-02 -2.4924 0.82583E+00 -0.0831 7 Al+++ 0.55201E-22 -22.2581 0.11506E-22 -22.9391 0.20845E+00 -0.6810 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.90795E-07 -7.0419 0.44705E-07 -7.3496 0.49238E+00 -0.3077 10 Mg++ 0.59832E-10 -10.2231 0.29306E-10 -10.5330 0.48981E+00 -0.3100 11 Fe++ 0.21689E-13 -13.6638 0.10637E-13 -13.9732 0.49042E+00 -0.3094 12 K+ 0.15560E-03 -3.8080 0.12873E-03 -3.8903 0.82729E+00 -0.0823 13 Na+ 0.22161E-01 -1.6544 0.18294E-01 -1.7377 0.82552E+00 -0.0833 14 Mn++ 0.17083E-08 -8.7674 0.83856E-09 -9.0765 0.49088E+00 -0.3090 15 F- 0.79729E-04 -4.0984 0.65678E-04 -4.1826 0.82377E+00 -0.0842 16 HPO4-- 0.43895E-07 -7.3576 0.21799E-07 -7.6616 0.49662E+00 -0.3040 18 HSiO3- 0.23948E-03 -3.6207 0.19774E-03 -3.7039 0.82570E+00 -0.0832 19 Ca(HSiO3)+ 0.24328E-09 -9.6139 0.20132E-09 -9.6961 0.82750E+00 -0.0822 20 Mg(HSiO3)+ 0.19848E-12 -12.7023 0.16424E-12 -12.7845 0.82750E+00 -0.0822 21 NaHSiO3,aq 0.58507E-04 -4.2328 0.58507E-04 -4.2328 0.10000E+01 0.0000 22 AlO+ 0.80805E-13 -13.0926 0.66866E-13 -13.1748 0.82750E+00 -0.0822 23 AlOH+2 0.32781E-17 -17.4844 0.16110E-17 -17.7929 0.49143E+00 -0.3085 24 HAlO2,aq 0.27522E-08 -8.5603 0.27522E-08 -8.5603 0.10000E+01 0.0000 25 AlO2- 0.15281E-05 -5.8159 0.12591E-05 -5.8999 0.82400E+00 -0.0841 26 CH4,aq 0.77939E-07 -7.1082 0.77403E-07 -7.1112 0.99312E+00 -0.0030 27 C2H6,aq 0.13916E-16 -16.8565 0.13821E-16 -16.8595 0.99312E+00 -0.0030 31 CO,aq 0.22155E-12 -12.6545 0.22155E-12 -12.6545 0.10000E+01 0.0000 32 CO2,aq 0.11983E-03 -3.9214 0.11900E-03 -3.9244 0.99312E+00 -0.0030 33 CO3-2 0.41950E-03 -3.3773 0.20780E-03 -3.6824 0.49534E+00 -0.3051 34 CaCO3,aq 0.11648E-06 -6.9337 0.11648E-06 -6.9337 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.15873E-07 -7.7993 0.13135E-07 -7.8816 0.82750E+00 -0.0822 36 CaCl+ 0.95647E-10 -10.0193 0.79148E-10 -10.1016 0.82750E+00 -0.0822 37 CaCl2,aq 0.20571E-13 -13.6867 0.20571E-13 -13.6867 0.10000E+01 0.0000 38 CaF+ 0.51805E-10 -10.2856 0.42868E-10 -10.3679 0.82750E+00 -0.0822 39 CaOH+ 0.79577E-09 -9.0992 0.65850E-09 -9.1814 0.82750E+00 -0.0822 40 CaSO4,aq 0.65988E-08 -8.1805 0.65988E-08 -8.1805 0.10000E+01 0.0000 41 HCl,aq 0.96997E-12 -12.0132 0.96997E-12 -12.0132 0.10000E+01 0.0000 45 HF,aq 0.21754E-08 -8.6625 0.21754E-08 -8.6625 0.10000E+01 0.0000 46 HF2- 0.58423E-13 -13.2334 0.48239E-13 -13.3166 0.82570E+00 -0.0832 48 FeCl+ 0.22259E-16 -16.6525 0.18419E-16 -16.7347 0.82750E+00 -0.0822 51 FeF+ 0.43143E-16 -16.3651 0.35700E-16 -16.4473 0.82750E+00 -0.0822 53 FeO,aq 0.17659E-13 -13.7530 0.17659E-13 -13.7530 0.10000E+01 0.0000 54 FeOH+ 0.86479E-13 -13.0631 0.71561E-13 -13.1453 0.82750E+00 -0.0822 55 HFeO2- 0.46249E-13 -13.3349 0.38188E-13 -13.4181 0.82570E+00 -0.0832 56 FeO+ 0.75770E-18 -18.1205 0.62699E-18 -18.2027 0.82750E+00 -0.0822 58 FeO2- 0.66371E-14 -14.1780 0.54803E-14 -14.2612 0.82570E+00 -0.0832 59 HFeO2,aq 0.33724E-14 -14.4721 0.33724E-14 -14.4721 0.10000E+01 0.0000 60 H2,aq 0.74623E-07 -7.1271 0.74109E-07 -7.1301 0.99312E+00 -0.0030 61 KCl,aq 0.25524E-08 -8.5931 0.25524E-08 -8.5931 0.10000E+01 0.0000 62 KHSO4,aq 0.81857E-15 -15.0869 0.81857E-15 -15.0869 0.10000E+01 0.0000 63 KOH,aq 0.11362E-07 -7.9446 0.11362E-07 -7.9446 0.10000E+01 0.0000 64 KSO4- 0.11245E-05 -5.9490 0.92852E-06 -6.0322 0.82570E+00 -0.0832 65 MgCO3,aq 0.19140E-10 -10.7181 0.19140E-10 -10.7181 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.10633E-10 -10.9734 0.87986E-11 -11.0556 0.82750E+00 -0.0822 67 MgCl+ 0.56829E-13 -13.2454 0.47026E-13 -13.3277 0.82750E+00 -0.0822 68 MgF+ 0.12580E-12 -12.9003 0.10410E-12 -12.9826 0.82750E+00 -0.0822 69 MgOH+ 0.28866E-11 -11.5396 0.23887E-11 -11.6218 0.82750E+00 -0.0822 71 MnF+ 0.11210E-11 -11.9504 0.92766E-12 -12.0326 0.82750E+00 -0.0822 72 MnO,aq 0.37095E-10 -10.4307 0.37095E-10 -10.4307 0.10000E+01 0.0000 73 MnOH+ 0.63332E-09 -9.1984 0.52407E-09 -9.2806 0.82750E+00 -0.0822 74 MnO2-2 0.10616E-15 -15.9740 0.52586E-16 -16.2791 0.49534E+00 -0.3051 75 HMnO2- 0.67510E-13 -13.1706 0.55743E-13 -13.2538 0.82570E+00 -0.0832 78 MnCl+ 0.68269E-11 -11.1658 0.56492E-11 -11.2480 0.82750E+00 -0.0822 79 MnSO4,aq 0.11253E-09 -9.9487 0.11253E-09 -9.9487 0.10000E+01 0.0000 80 NaCl,aq 0.66327E-05 -5.1783 0.66327E-05 -5.1783 0.10000E+01 0.0000 81 NaF,aq 0.28130E-06 -6.5508 0.28130E-06 -6.5508 0.10000E+01 0.0000 82 NaOH,aq 0.16245E-05 -5.7893 0.16245E-05 -5.7893 0.10000E+01 0.0000 84 OH- 0.14492E-03 -3.8389 0.11941E-03 -3.9229 0.82400E+00 -0.0841 89 HPO3-2 0.10164E-16 -16.9929 0.50346E-17 -17.2980 0.49534E+00 -0.3051 91 H2PO3- 0.59160E-19 -19.2280 0.48848E-19 -19.3112 0.82570E+00 -0.0832 92 H3PO4,aq 0.35692E-14 -14.4474 0.35692E-14 -14.4474 0.10000E+01 0.0000 93 H2PO4- 0.23539E-08 -8.6282 0.19457E-08 -8.7109 0.82659E+00 -0.0827 94 PO4-3 0.16676E-10 -10.7779 0.36759E-11 -11.4346 0.22043E+00 -0.6567 97 H2P2O7-2 0.59928E-18 -18.2224 0.29685E-18 -18.5275 0.49534E+00 -0.3051 98 HP2O7-3 0.58700E-16 -16.2314 0.12251E-16 -16.9118 0.20870E+00 -0.6805 99 P2O7-4 0.93804E-17 -17.0278 0.60487E-18 -18.2183 0.64482E-01 -1.1906 100 H2S,aq 0.48453E-04 -4.3147 0.48120E-04 -4.3177 0.99312E+00 -0.0030 101 S2-2 0.62503E-08 -8.2041 0.30960E-08 -8.5092 0.49534E+00 -0.3051 102 S3-2 0.54676E-11 -11.2622 0.27083E-11 -11.5673 0.49534E+00 -0.3051 103 S3- 0.39078E-13 -13.4081 0.32266E-13 -13.4912 0.82570E+00 -0.0832 104 S4-2 0.31595E-14 -14.5004 0.15650E-14 -14.8055 0.49534E+00 -0.3051 105 S5-2 0.12174E-17 -17.9146 0.60303E-18 -18.2197 0.49534E+00 -0.3051 106 SO2,aq 0.36016E-17 -17.4435 0.36016E-17 -17.4435 0.10000E+01 0.0000 107 SO3-2 0.88909E-11 -11.0511 0.44766E-11 -11.3491 0.50350E+00 -0.2980 108 HSO3- 0.16425E-11 -11.7845 0.13562E-11 -11.8677 0.82570E+00 -0.0832 109 HSO4- 0.26164E-08 -8.5823 0.21675E-08 -8.6640 0.82842E+00 -0.0817 111 S2O3-2 0.53045E-09 -9.2754 0.26275E-09 -9.5805 0.49534E+00 -0.3051 112 HS2O3- 0.27530E-15 -15.5602 0.22731E-15 -15.6434 0.82570E+00 -0.0832 Charge balance for all species = -.6112E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5819712E-08 -.7020011E-03 -.7063122E+00 0.0000 2 H2O 0.1000000E+01 0.5550798E+02 0.9982082E+06 0.0000 3 Cl- 0.1324944E-02 0.1331580E-02 0.4712425E+02 5.3543 4 SO4-- 0.9361510E-03 0.9371904E-03 0.8986733E+02 13.2979 5 HCO3- 0.1391725E-01 0.1445679E-01 0.8805385E+03 6.3764 6 HS- 0.3896527E-02 0.3945088E-02 0.1302391E+03 5.8229 7 Al+++ 0.5520131E-22 0.1530804E-05 0.4122968E-01 2.0068 8 H4SiO4 0.1024619E-02 0.1322604E-02 0.1268957E+03 -2.9894 9 Ca++ 0.9079466E-07 0.2309335E-06 0.9238834E-02 9.2809 10 Mg++ 0.5983228E-10 0.9287267E-10 0.2253891E-05 6.0976 11 Fe++ 0.2168940E-13 0.1821519E-12 0.1015448E-07 2.6574 12 K+ 0.1555996E-03 0.1567380E-03 0.6117832E+01 4.4250 13 Na+ 0.2216110E-01 0.2222814E-01 0.5101085E+03 6.5776 14 Mn++ 0.1708263E-08 0.2499228E-08 0.1370575E-03 7.5541 15 F- 0.7972944E-04 0.8001297E-04 0.1517374E+01 4.1327 16 HPO4-- 0.4389544E-07 0.4626603E-07 0.4432643E-02 8.9690 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.6461168E-03 -.6325408E-03 -.1357591E-04 0.0000000E+00 2 H2O 0.4999377E+02 0.5001568E+02 -.2191581E-01 0.0000000E+00 3 Cl- 0.1199825E-02 0.1199825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8444672E-03 0.8444590E-03 0.8148026E-08 0.0000000E+00 5 HCO3- 0.1302635E-01 0.1302635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3554794E-02 0.3554737E-02 0.5703619E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1379337E-05 0.3396015E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1191737E-02 0.1096128E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1641287E-12 0.3259211E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002875E-01 0.3396015E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7209600E-04 0.7209600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.902665E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3396E-05 -5.469 0.8905E-03 -3.050 0.1352 0.3418E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5935E-03 0.7802E-06 quartz 0.1095E-01 -1.961 0.6579 -0.182 99.86 0.2485 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.658836 g Volume = 0.248810 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1799900 moles log = -0.7448 Original solution: 1000.0103000 g Original solution / Rock added: 5555.92 (Water/Rock Ratio), log = 3.7448 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0347 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9863E+00 0.9858 0.1006E+01 0.1020E+01 CO2,gas 0.1222E-01 1.0069 0.1273E-01 0.1264E-01 CH4,gas 0.1088E-03 1.0124 0.1139E-03 0.1125E-03 H2,gas 0.9398E-04 1.0006 0.9730E-04 0.9724E-04 H2S,gas 0.1284E-02 0.9960 0.1323E-02 0.1328E-02 S2,gas 0.6705E-17 1.0000 0.6938E-17 0.6938E-17 CO,gas 0.3191E-09 1.0000 0.3302E-09 0.3302E-09 SO3,gas 0.3977E-35 1.0000 0.4115E-35 0.4115E-35 SO2,gas 0.1505E-16 1.0000 0.1557E-16 0.1557E-16 HF,gas 0.5162E-11 1.0000 0.5341E-11 0.5341E-11 HCl,gas 0.1654E-14 1.0000 0.1712E-14 0.1712E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 0.11184E-10 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.25 -3.59 -1.198 0.61368E+04 -1.895 3 CH4,gas 4.54 -1.10 -5.64 -1.411 0.96341E+04 -3.943 4 H2,gas 8.00 2.29 -5.71 -3.263 0.97512E+04 -4.012 5 H2S,gas -6.23 -10.81 -4.58 -2.289 0.78159E+04 -2.879 6 S2,gas -7.34 -26.19 -18.86 -2.901 0.32199E+05 -17.159 7 CO,gas 3.21 -7.97 -11.18 -3.440 0.19090E+05 -9.481 8 SO3,gas 17.12 -19.96 -37.08 -9.271 0.63321E+05 -35.386 9 SO2,gas 0.83 -17.67 -18.51 -4.935 0.31599E+05 -16.808 10 HF,gas 0.47 -12.50 -12.97 -6.486 0.22148E+05 -11.272 11 HCl,gas 5.19 -11.28 -16.47 -8.233 0.28115E+05 -14.767 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 1.02 -3.98 -0.398 0.67911E+04 34 apatite-F -34.30 -38.97 -4.67 -0.389 0.79715E+04 38 aragonite 0.97 -0.97 -1.94 -0.647 0.33121E+04 40 calcite 0.81 -0.97 -1.79 -0.595 0.30479E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.13 -4.45 -0.297 0.75978E+04 45 celadonite 5.34 0.57 -4.77 -0.281 0.81447E+04 55 chloritoid-Mn 11.40 8.58 -2.82 -0.188 0.48197E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.01 -4.37 -0.397 0.74607E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.54 -4.22 -0.352 0.72088E+04 68 diaspore 2.87 2.01 -0.87 -0.144 0.14802E+04 69 diamond -3.10 -5.68 -2.57 -0.735 0.43951E+04 86 gibbsite 4.08 2.01 -2.07 -0.296 0.35387E+04 89 graphite -3.55 -5.68 -2.13 -0.609 0.36373E+04 94 heulandite -5.83 -7.63 -1.80 -0.082 0.30806E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.14 -0.592 0.70716E+04 101 kaolinite -1.33 -1.97 -0.63 -0.057 0.10799E+04 102 kyanite 4.88 1.02 -3.85 -0.385 0.65770E+04 104 laumontite 2.88 1.34 -1.55 -0.103 0.26407E+04 105 lawsonite 9.62 7.32 -2.30 -0.153 0.39278E+04 106 leucite 4.12 0.45 -3.67 -0.367 0.62595E+04 109 magnesite 0.69 -4.16 -4.85 -1.616 0.82765E+04 119 microcline -2.49 -2.54 -0.05 -0.004 0.85413E+02 123 muscovite 2.58 1.48 -1.11 -0.065 0.18873E+04 124 paragonite 4.24 3.63 -0.61 -0.036 0.10410E+04 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -8.15 -3.89 -1.297 0.66421E+04 147 pyrrhotiteFe0.875 -6.02 -8.77 -2.75 -1.011 0.46945E+04 148 pyroxmangite 7.40 4.56 -2.83 -0.567 0.48390E+04 149 pyrophyllite -6.18 -7.94 -1.77 -0.111 0.30193E+04 154 rhodochrosite -0.98 -2.70 -1.72 -0.575 0.29433E+04 155 rhodonite 7.45 4.56 -2.88 -0.576 0.49192E+04 156 sanidine -1.28 -2.54 -1.26 -0.097 0.21532E+04 158 siderite -2.61 -7.60 -4.99 -1.663 0.85180E+04 159 sillimanite 5.26 1.02 -4.24 -0.424 0.72351E+04 166 stilbite -7.52 -7.63 -0.11 -0.005 0.18681E+03 172 sulfur -9.15 -13.10 -3.94 -1.214 0.67347E+04 180 topaz-H 4.62 1.02 -3.59 -0.327 0.61371E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -8.15 -3.74 -1.246 0.63849E+04 190 wairakite 3.95 1.34 -2.61 -0.154 0.44627E+04 192 wollastonite 10.46 6.29 -4.17 -0.834 0.71195E+04 193 pseudo-wollastonite 11.00 6.29 -4.71 -0.942 0.80394E+04 196 beidellite-Ca -1.65 -4.76 -3.12 -0.193 0.53245E+04 197 beidellite-H -2.33 -6.30 -3.97 -0.253 0.67771E+04 198 beidellite-K -1.52 -4.84 -3.31 -0.203 0.56600E+04 199 beidellite-Mg -1.79 -5.29 -3.50 -0.216 0.59752E+04 200 beidellite-Na -1.34 -4.12 -2.78 -0.170 0.47510E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.67 -3.35 -0.419 0.57227E+04 204 montmorillonite-Ca -2.29 -5.06 -2.77 -0.171 0.47332E+04 205 montmorillonite-K -2.24 -5.13 -2.90 -0.177 0.49469E+04 206 montmorillonite-Mg -2.48 -5.59 -3.11 -0.192 0.53071E+04 207 montmorillonite-Na -2.04 -4.42 -2.39 -0.146 0.40736E+04 234 alabandite -0.98 -3.25 -2.28 -0.759 0.38857E+04 237 boehmite 4.41 2.01 -2.40 -0.400 0.40971E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.16 -0.86 -0.066 0.14714E+04 248 an25ab75 2.65 1.54 -1.10 -0.085 0.18862E+04 249 an30ab70 3.28 1.93 -1.35 -0.104 0.23106E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1799900 MOLES New total amount of reactant added: 0.1839900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 10 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1839900 Water: Moles liquid = 0.5002E+02 kg liquid = 0.9011E+00 Moles total = 0.5000E+02 kg total = 0.9007E+00 Activity = 1.0000 Stoichiometric ionic strength = .2323968E-01 Osmotic coef. = 0.9142 True ionic strength = .2354975E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1223E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.99407E-08 -8.0026 0.82673E-08 -8.0826 0.83166E+00 -0.0801 2 H2O 0.99999E+00 0.0000 0.99999E+00 0.0000 3 Cl- 0.13509E-02 -2.8694 0.11158E-02 -2.9524 0.82599E+00 -0.0830 4 SO4-- 0.95725E-03 -3.0190 0.47599E-03 -3.3224 0.49724E+00 -0.3034 5 HCO3- 0.14314E-01 -1.8443 0.11843E-01 -1.9266 0.82736E+00 -0.0823 6 HS- 0.39475E-02 -2.4037 0.32611E-02 -2.4866 0.82613E+00 -0.0830 7 Al+++ 0.46833E-21 -21.3295 0.97941E-22 -22.0090 0.20913E+00 -0.6796 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.11339E-06 -6.9454 0.55910E-07 -7.2525 0.49309E+00 -0.3071 10 Mg++ 0.65896E-10 -10.1811 0.32324E-10 -10.4905 0.49053E+00 -0.3093 11 Fe++ 0.18396E-13 -13.7353 0.90351E-14 -14.0441 0.49114E+00 -0.3088 12 K+ 0.15557E-03 -3.8081 0.12874E-03 -3.8903 0.82758E+00 -0.0822 13 Na+ 0.22184E-01 -1.6540 0.18320E-01 -1.7371 0.82582E+00 -0.0831 14 Mn++ 0.19268E-08 -8.7152 0.94724E-09 -9.0235 0.49161E+00 -0.3084 15 F- 0.81491E-04 -4.0889 0.67154E-04 -4.1729 0.82407E+00 -0.0840 16 HPO4-- 0.42367E-07 -7.3730 0.21070E-07 -7.6763 0.49732E+00 -0.3034 18 HSiO3- 0.14010E-03 -3.8535 0.11572E-03 -3.9366 0.82599E+00 -0.0830 19 Ca(HSiO3)+ 0.17800E-09 -9.7496 0.14735E-09 -9.8317 0.82779E+00 -0.0821 20 Mg(HSiO3)+ 0.12808E-12 -12.8925 0.10602E-12 -12.9746 0.82779E+00 -0.0821 21 NaHSiO3,aq 0.34290E-04 -4.4648 0.34290E-04 -4.4648 0.10000E+01 0.0000 22 AlO+ 0.23550E-12 -12.6280 0.19495E-12 -12.7101 0.82779E+00 -0.0821 23 AlOH+2 0.16306E-16 -16.7876 0.80251E-17 -17.0955 0.49215E+00 -0.3079 24 HAlO2,aq 0.46959E-08 -8.3283 0.46959E-08 -8.3283 0.10000E+01 0.0000 25 AlO2- 0.15253E-05 -5.8166 0.12574E-05 -5.9005 0.82430E+00 -0.0839 26 CH4,aq 0.79366E-07 -7.1004 0.78814E-07 -7.1034 0.99304E+00 -0.0030 27 C2H6,aq 0.16540E-16 -16.7815 0.16425E-16 -16.7845 0.99304E+00 -0.0030 31 CO,aq 0.33977E-12 -12.4688 0.33977E-12 -12.4688 0.10000E+01 0.0000 32 CO2,aq 0.21067E-03 -3.6764 0.20920E-03 -3.6794 0.99304E+00 -0.0030 33 CO3-2 0.25223E-03 -3.5982 0.12512E-03 -3.9027 0.49605E+00 -0.3045 34 CaCO3,aq 0.87715E-07 -7.0569 0.87715E-07 -7.0569 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.20417E-07 -7.6900 0.16901E-07 -7.7721 0.82779E+00 -0.0821 36 CaCl+ 0.12196E-09 -9.9138 0.10096E-09 -9.9959 0.82779E+00 -0.0821 37 CaCl2,aq 0.26764E-13 -13.5724 0.26764E-13 -13.5724 0.10000E+01 0.0000 38 CaF+ 0.66221E-10 -10.1790 0.54817E-10 -10.2611 0.82779E+00 -0.0821 39 CaOH+ 0.58225E-09 -9.2349 0.48198E-09 -9.3170 0.82779E+00 -0.0821 40 CaSO4,aq 0.84506E-08 -8.0731 0.84506E-08 -8.0731 0.10000E+01 0.0000 41 HCl,aq 0.16904E-11 -11.7720 0.16904E-11 -11.7720 0.10000E+01 0.0000 45 HF,aq 0.38006E-08 -8.4201 0.38006E-08 -8.4201 0.10000E+01 0.0000 46 HF2- 0.10432E-12 -12.9816 0.86171E-13 -13.0646 0.82599E+00 -0.0830 48 FeCl+ 0.19277E-16 -16.7149 0.15958E-16 -16.7970 0.82779E+00 -0.0821 51 FeF+ 0.37456E-16 -16.4265 0.31006E-16 -16.5086 0.82779E+00 -0.0821 53 FeO,aq 0.51377E-14 -14.2892 0.51377E-14 -14.2892 0.10000E+01 0.0000 54 FeOH+ 0.42975E-13 -13.3668 0.35574E-13 -13.4489 0.82779E+00 -0.0821 55 HFeO2- 0.78721E-14 -14.1039 0.65023E-14 -14.1869 0.82599E+00 -0.0830 56 FeO+ 0.40314E-18 -18.3945 0.33371E-18 -18.4766 0.82779E+00 -0.0821 58 FeO2- 0.12095E-14 -14.9174 0.99906E-15 -15.0004 0.82599E+00 -0.0830 59 HFeO2,aq 0.10505E-14 -14.9786 0.10505E-14 -14.9786 0.10000E+01 0.0000 60 H2,aq 0.65105E-07 -7.1864 0.64652E-07 -7.1894 0.99304E+00 -0.0030 61 KCl,aq 0.26037E-08 -8.5844 0.26037E-08 -8.5844 0.10000E+01 0.0000 62 KHSO4,aq 0.14324E-14 -14.8439 0.14324E-14 -14.8439 0.10000E+01 0.0000 63 KOH,aq 0.66504E-08 -8.1772 0.66504E-08 -8.1772 0.10000E+01 0.0000 64 KSO4- 0.11513E-05 -5.9388 0.95093E-06 -6.0219 0.82599E+00 -0.0830 65 MgCO3,aq 0.12711E-10 -10.8958 0.12711E-10 -10.8958 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12062E-10 -10.9186 0.99846E-11 -11.0007 0.82779E+00 -0.0821 67 MgCl+ 0.63910E-13 -13.1944 0.52903E-13 -13.2765 0.82779E+00 -0.0821 68 MgF+ 0.14182E-12 -12.8483 0.11740E-12 -12.9303 0.82779E+00 -0.0821 69 MgOH+ 0.18627E-11 -11.7298 0.15419E-11 -11.8119 0.82779E+00 -0.0821 71 MnF+ 0.12943E-11 -11.8880 0.10714E-11 -11.9700 0.82779E+00 -0.0821 72 MnO,aq 0.14352E-10 -10.8431 0.14352E-10 -10.8431 0.10000E+01 0.0000 73 MnOH+ 0.41854E-09 -9.3783 0.34646E-09 -9.4603 0.82779E+00 -0.0821 74 MnO2-2 0.14049E-16 -16.8524 0.69689E-17 -17.1568 0.49605E+00 -0.3045 75 HMnO2- 0.15281E-13 -13.8158 0.12622E-13 -13.8989 0.82599E+00 -0.0830 78 MnCl+ 0.78627E-11 -11.1044 0.65087E-11 -11.1865 0.82779E+00 -0.0821 79 MnSO4,aq 0.13016E-09 -9.8855 0.13016E-09 -9.8855 0.10000E+01 0.0000 80 NaCl,aq 0.67746E-05 -5.1691 0.67746E-05 -5.1691 0.10000E+01 0.0000 81 NaF,aq 0.28803E-06 -6.5406 0.28803E-06 -6.5406 0.10000E+01 0.0000 82 NaOH,aq 0.95209E-06 -6.0213 0.95209E-06 -6.0213 0.10000E+01 0.0000 84 OH- 0.84782E-04 -4.0717 0.69886E-04 -4.1556 0.82430E+00 -0.0839 89 HPO3-2 0.85581E-17 -17.0676 0.42452E-17 -17.3721 0.49605E+00 -0.3045 91 H2PO3- 0.85205E-19 -19.0695 0.70379E-19 -19.1526 0.82599E+00 -0.0830 92 H3PO4,aq 0.10072E-13 -13.9969 0.10072E-13 -13.9969 0.10000E+01 0.0000 93 H2PO4- 0.38862E-08 -8.4105 0.32134E-08 -8.4930 0.82688E+00 -0.0826 94 PO4-3 0.94045E-11 -11.0267 0.20794E-11 -11.6821 0.22111E+00 -0.6554 97 H2P2O7-2 0.16322E-17 -17.7872 0.80966E-18 -18.0917 0.49605E+00 -0.3045 98 HP2O7-3 0.93397E-16 -16.0297 0.19555E-16 -16.7087 0.20938E+00 -0.6791 99 P2O7-4 0.87138E-17 -17.0598 0.56509E-18 -18.2479 0.64849E-01 -1.1881 100 H2S,aq 0.83909E-04 -4.0762 0.83325E-04 -4.0792 0.99304E+00 -0.0030 101 S2-2 0.73478E-08 -8.1338 0.36449E-08 -8.4383 0.49605E+00 -0.3045 102 S3-2 0.12759E-10 -10.8942 0.63288E-11 -11.1987 0.49605E+00 -0.3045 103 S3- 0.16699E-12 -12.7773 0.13794E-12 -12.8603 0.82599E+00 -0.0830 104 S4-2 0.14634E-13 -13.8346 0.72592E-14 -14.1391 0.49605E+00 -0.3045 105 S5-2 0.11193E-16 -16.9511 0.55520E-17 -17.2555 0.49605E+00 -0.3045 106 SO2,aq 0.93934E-17 -17.0272 0.93934E-17 -17.0272 0.10000E+01 0.0000 107 SO3-2 0.79316E-11 -11.1006 0.39990E-11 -11.3980 0.50419E+00 -0.2974 108 HSO3- 0.25061E-11 -11.6010 0.20700E-11 -11.6840 0.82599E+00 -0.0830 109 HSO4- 0.45762E-08 -8.3395 0.37923E-08 -8.4211 0.82870E+00 -0.0816 111 S2O3-2 0.93922E-09 -9.0272 0.46590E-09 -9.3317 0.49605E+00 -0.3045 112 HS2O3- 0.83378E-15 -15.0789 0.68870E-15 -15.1620 0.82599E+00 -0.0830 Charge balance for all species = -.6112E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9940659E-08 -.2239869E-03 -.2253594E+00 0.0000 2 H2O 0.1000000E+01 0.5550795E+02 0.9981944E+06 0.0000 3 Cl- 0.1350898E-02 0.1357676E-02 0.4804713E+02 5.1302 4 SO4-- 0.9572488E-03 0.9583203E-03 0.9189225E+02 12.8429 5 HCO3- 0.1431362E-01 0.1477671E-01 0.9000121E+03 6.1561 6 HS- 0.3947463E-02 0.4031481E-02 0.1330894E+03 5.5960 7 Al+++ 0.4683277E-21 0.1530045E-05 0.4120867E-01 2.2389 8 H4SiO4 0.1024614E-02 0.1199008E-02 0.1150359E+03 -2.9894 9 Ca++ 0.1133858E-06 0.2309172E-06 0.9238059E-02 8.9128 10 Mg++ 0.6589630E-10 0.9286613E-10 0.2253702E-05 5.6748 11 Fe++ 0.1839613E-13 0.7669822E-13 0.4275664E-08 2.1212 12 K+ 0.1555665E-03 0.1567270E-03 0.6117319E+01 4.1924 13 Na+ 0.2218427E-01 0.2222658E-01 0.5100657E+03 6.3456 14 Mn++ 0.1926821E-08 0.2499052E-08 0.1370460E-03 7.1417 15 F- 0.8149101E-04 0.8178291E-04 0.1550918E+01 3.9097 16 HPO4-- 0.4236719E-07 0.4626278E-07 0.4432271E-02 8.4889 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.2154168E-03 -.2018385E-03 -.1357826E-04 0.0000000E+00 2 H2O 0.4999704E+02 0.5001918E+02 -.2213839E-01 0.0000000E+00 3 Cl- 0.1223425E-02 0.1223425E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8635672E-03 0.8635590E-03 0.8148050E-08 0.0000000E+00 5 HCO3- 0.1331555E-01 0.1331555E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3632894E-02 0.3632837E-02 0.5703635E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1378750E-05 0.3396602E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1080447E-02 0.1107257E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.6911410E-13 0.3259220E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002875E-01 0.3396602E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7369600E-04 0.7369600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1271E-20 Mass of aqueous solution: 0.902741E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1839900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3397E-05 -5.469 0.8907E-03 -3.050 0.1338 0.3419E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5876E-03 0.7802E-06 quartz 0.1106E-01 -1.956 0.6646 -0.177 99.87 0.2510 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.665523 g Volume = 0.251335 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1839900 moles log = -0.7352 Original solution: 1000.0103000 g Original solution / Rock added: 5435.13 (Water/Rock Ratio), log = 3.7352 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0454 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9763E+00 0.9856 0.1006E+01 0.1021E+01 CO2,gas 0.2127E-01 1.0068 0.2238E-01 0.2223E-01 CH4,gas 0.1096E-03 1.0124 0.1160E-03 0.1146E-03 H2,gas 0.8115E-04 1.0006 0.8488E-04 0.8483E-04 H2S,gas 0.2200E-02 0.9959 0.2291E-02 0.2300E-02 S2,gas 0.2615E-16 1.0000 0.2733E-16 0.2733E-16 CO,gas 0.4844E-09 1.0000 0.5063E-09 0.5063E-09 SO3,gas 0.1177E-34 1.0000 0.1230E-34 0.1230E-34 SO2,gas 0.3886E-16 1.0000 0.4062E-16 0.4062E-16 HF,gas 0.8927E-11 1.0000 0.9332E-11 0.9332E-11 HCl,gas 0.2853E-14 1.0000 0.2983E-14 0.2983E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -10.01 -3.35 -1.116 0.57184E+04 -1.650 3 CH4,gas 4.54 -1.09 -5.63 -1.409 0.96207E+04 -3.936 4 H2,gas 8.00 2.23 -5.77 -3.297 0.98524E+04 -4.071 5 H2S,gas -6.23 -10.57 -4.34 -2.170 0.74088E+04 -2.640 6 S2,gas -7.34 -25.60 -18.26 -2.810 0.31182E+05 -16.563 7 CO,gas 3.21 -7.78 -10.99 -3.383 0.18773E+05 -9.296 8 SO3,gas 17.12 -19.49 -36.61 -9.152 0.62509E+05 -34.910 9 SO2,gas 0.83 -17.26 -18.09 -4.824 0.30889E+05 -16.391 10 HF,gas 0.47 -12.26 -12.73 -6.365 0.21734E+05 -11.030 11 HCl,gas 5.19 -11.04 -16.22 -8.112 0.27703E+05 -14.525 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 1.49 -3.51 -0.351 0.59987E+04 34 apatite-F -34.30 -39.22 -4.92 -0.410 0.83932E+04 38 aragonite 0.97 -1.10 -2.06 -0.688 0.35224E+04 40 calcite 0.81 -1.10 -1.91 -0.636 0.32582E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.17 -4.41 -0.294 0.75272E+04 55 chloritoid-Mn 11.40 8.63 -2.77 -0.185 0.47315E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.48 -3.91 -0.355 0.66683E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.54 -4.22 -0.352 0.72097E+04 68 diaspore 2.87 2.24 -0.63 -0.106 0.10839E+04 69 diamond -3.10 -5.55 -2.45 -0.699 0.41792E+04 86 gibbsite 4.08 2.24 -1.84 -0.263 0.31425E+04 89 graphite -3.55 -5.55 -2.00 -0.573 0.34214E+04 94 heulandite -5.83 -7.54 -1.71 -0.078 0.29169E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.14 -0.592 0.70725E+04 101 kaolinite -1.33 -1.50 -0.17 -0.015 0.28747E+03 102 kyanite 4.88 1.49 -3.39 -0.339 0.57846E+04 104 laumontite 2.88 1.43 -1.45 -0.097 0.24770E+04 105 lawsonite 9.62 7.41 -2.20 -0.147 0.37640E+04 106 leucite 4.12 0.45 -3.67 -0.367 0.62604E+04 119 microcline -2.49 -2.54 -0.05 -0.004 0.86352E+02 123 muscovite 2.58 1.94 -0.64 -0.038 0.10958E+04 124 paragonite 4.24 4.09 -0.15 -0.009 0.24853E+03 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -8.45 -4.19 -1.396 0.71505E+04 147 pyrrhotiteFe0.875 -6.02 -8.99 -2.97 -1.093 0.50759E+04 148 pyroxmangite 7.40 4.15 -3.25 -0.649 0.55431E+04 149 pyrophyllite -6.18 -7.48 -1.30 -0.082 0.22269E+04 154 rhodochrosite -0.98 -2.87 -1.89 -0.630 0.32291E+04 155 rhodonite 7.45 4.15 -3.29 -0.659 0.56234E+04 156 sanidine -1.28 -2.54 -1.26 -0.097 0.21541E+04 159 sillimanite 5.26 1.49 -3.77 -0.377 0.64427E+04 166 stilbite -7.52 -7.54 -0.01 -0.001 0.23055E+02 172 sulfur -9.15 -12.80 -3.65 -1.122 0.62264E+04 180 topaz-H 4.62 1.49 -3.13 -0.285 0.53447E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -8.45 -4.04 -1.346 0.68933E+04 190 wairakite 3.95 1.43 -2.52 -0.148 0.42989E+04 192 wollastonite 10.46 5.92 -4.54 -0.908 0.77482E+04 196 beidellite-Ca -1.65 -4.28 -2.64 -0.163 0.45051E+04 197 beidellite-H -2.33 -5.75 -3.43 -0.219 0.58539E+04 198 beidellite-K -1.52 -4.37 -2.85 -0.175 0.48679E+04 199 beidellite-Mg -1.79 -4.82 -3.03 -0.187 0.51711E+04 200 beidellite-Na -1.34 -3.66 -2.32 -0.142 0.39586E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.42 -3.11 -0.388 0.53044E+04 204 montmorillonite-Ca -2.29 -4.88 -2.58 -0.160 0.44135E+04 205 montmorillonite-K -2.24 -4.96 -2.73 -0.167 0.46545E+04 206 montmorillonite-Mg -2.48 -5.41 -2.93 -0.181 0.50028E+04 207 montmorillonite-Na -2.04 -4.25 -2.21 -0.136 0.37809E+04 234 alabandite -0.98 -3.43 -2.45 -0.817 0.41827E+04 237 boehmite 4.41 2.24 -2.17 -0.361 0.37009E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.18 -0.84 -0.065 0.14386E+04 248 an25ab75 2.65 1.57 -1.08 -0.083 0.18452E+04 249 an30ab70 3.28 1.95 -1.32 -0.102 0.22615E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1839900 MOLES New total amount of reactant added: 0.1879900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 10 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1879900 Water: Moles liquid = 0.5002E+02 kg liquid = 0.9012E+00 Moles total = 0.5000E+02 kg total = 0.9008E+00 Activity = 1.0000 Stoichiometric ionic strength = .2349827E-01 Osmotic coef. = 0.9138 True ionic strength = .2347369E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1247E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18094E-07 -7.7425 0.15051E-07 -7.8224 0.83183E+00 -0.0800 2 H2O 0.99999E+00 0.0000 0.99999E+00 0.0000 3 Cl- 0.13769E-02 -2.8611 0.11375E-02 -2.9440 0.82617E+00 -0.0829 4 SO4-- 0.97834E-03 -3.0095 0.48690E-03 -3.3126 0.49768E+00 -0.3030 5 HCO3- 0.14565E-01 -1.8367 0.12053E-01 -1.9189 0.82754E+00 -0.0822 6 HS- 0.39643E-02 -2.4018 0.32757E-02 -2.4847 0.82631E+00 -0.0829 7 Al+++ 0.51304E-20 -20.2898 0.10751E-20 -20.9686 0.20955E+00 -0.6787 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.13599E-06 -6.8665 0.67115E-07 -7.1732 0.49354E+00 -0.3067 10 Mg++ 0.70661E-10 -10.1508 0.34693E-10 -10.4598 0.49098E+00 -0.3089 11 Fe++ 0.15610E-13 -13.8066 0.76739E-14 -14.1150 0.49159E+00 -0.3084 12 K+ 0.15553E-03 -3.8082 0.12874E-03 -3.8903 0.82776E+00 -0.0821 13 Na+ 0.22198E-01 -1.6537 0.18336E-01 -1.7367 0.82600E+00 -0.0830 14 Mn++ 0.20900E-08 -8.6799 0.10284E-08 -8.9879 0.49205E+00 -0.3080 15 F- 0.83251E-04 -4.0796 0.68620E-04 -4.1636 0.82425E+00 -0.0839 16 HPO4-- 0.39632E-07 -7.4020 0.19727E-07 -7.7049 0.49776E+00 -0.3030 18 HSiO3- 0.76938E-04 -4.1139 0.63564E-04 -4.1968 0.82617E+00 -0.0829 19 Ca(HSiO3)+ 0.11734E-09 -9.9305 0.97155E-10 -10.0125 0.82796E+00 -0.0820 20 Mg(HSiO3)+ 0.75488E-13 -13.1221 0.62501E-13 -13.2041 0.82796E+00 -0.0820 21 NaHSiO3,aq 0.18850E-04 -4.7247 0.18850E-04 -4.7247 0.10000E+01 0.0000 22 AlO+ 0.77975E-12 -12.1080 0.64561E-12 -12.1900 0.82796E+00 -0.0820 23 AlOH+2 0.98226E-16 -16.0078 0.48386E-16 -16.3153 0.49260E+00 -0.3075 24 HAlO2,aq 0.85421E-08 -8.0684 0.85421E-08 -8.0684 0.10000E+01 0.0000 25 AlO2- 0.15237E-05 -5.8171 0.12563E-05 -5.9009 0.82449E+00 -0.0838 26 CH4,aq 0.79327E-07 -7.1006 0.78769E-07 -7.1036 0.99297E+00 -0.0031 27 C2H6,aq 0.19280E-16 -16.7149 0.19145E-16 -16.7180 0.99297E+00 -0.0031 31 CO,aq 0.53955E-12 -12.2680 0.53955E-12 -12.2680 0.10000E+01 0.0000 32 CO2,aq 0.39040E-03 -3.4085 0.38765E-03 -3.4116 0.99297E+00 -0.0031 33 CO3-2 0.14088E-03 -3.8511 0.69948E-04 -4.1552 0.49649E+00 -0.3041 34 CaCO3,aq 0.58864E-07 -7.2301 0.58864E-07 -7.2301 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.24940E-07 -7.6031 0.20649E-07 -7.6851 0.82796E+00 -0.0820 36 CaCl+ 0.14922E-09 -9.8262 0.12355E-09 -9.9082 0.82796E+00 -0.0820 37 CaCl2,aq 0.33389E-13 -13.4764 0.33389E-13 -13.4764 0.10000E+01 0.0000 38 CaF+ 0.81211E-10 -10.0904 0.67240E-10 -10.1724 0.82796E+00 -0.0820 39 CaOH+ 0.38383E-09 -9.4159 0.31779E-09 -9.4979 0.82796E+00 -0.0820 40 CaSO4,aq 0.10377E-07 -7.9839 0.10377E-07 -7.9839 0.10000E+01 0.0000 41 HCl,aq 0.31374E-11 -11.5034 0.31374E-11 -11.5034 0.10000E+01 0.0000 45 HF,aq 0.70704E-08 -8.1506 0.70704E-08 -8.1506 0.10000E+01 0.0000 46 HF2- 0.19827E-12 -12.7027 0.16380E-12 -12.7857 0.82617E+00 -0.0829 48 FeCl+ 0.16688E-16 -16.7776 0.13817E-16 -16.8596 0.82796E+00 -0.0820 51 FeF+ 0.32501E-16 -16.4881 0.26909E-16 -16.5701 0.82796E+00 -0.0820 53 FeO,aq 0.13165E-14 -14.8806 0.13165E-14 -14.8806 0.10000E+01 0.0000 54 FeOH+ 0.20044E-13 -13.6980 0.16596E-13 -13.7800 0.82796E+00 -0.0820 55 HFeO2- 0.11077E-14 -14.9556 0.91519E-15 -15.0385 0.82617E+00 -0.0829 56 FeO+ 0.20312E-18 -18.6923 0.16817E-18 -18.7742 0.82796E+00 -0.0820 58 FeO2- 0.18386E-15 -15.7355 0.15190E-15 -15.8185 0.82617E+00 -0.0829 59 HFeO2,aq 0.29078E-15 -15.5364 0.29078E-15 -15.5364 0.10000E+01 0.0000 60 H2,aq 0.55798E-07 -7.2534 0.55405E-07 -7.2564 0.99297E+00 -0.0031 61 KCl,aq 0.26543E-08 -8.5761 0.26543E-08 -8.5761 0.10000E+01 0.0000 62 KHSO4,aq 0.26676E-14 -14.5739 0.26676E-14 -14.5739 0.10000E+01 0.0000 63 KOH,aq 0.36528E-08 -8.4374 0.36528E-08 -8.4374 0.10000E+01 0.0000 64 KSO4- 0.11774E-05 -5.9291 0.97273E-06 -6.0120 0.82617E+00 -0.0829 65 MgCO3,aq 0.76270E-11 -11.1176 0.76270E-11 -11.1176 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13173E-10 -10.8803 0.10907E-10 -10.9623 0.82796E+00 -0.0820 67 MgCl+ 0.69911E-13 -13.1555 0.57884E-13 -13.2374 0.82796E+00 -0.0820 68 MgF+ 0.15550E-12 -12.8083 0.12875E-12 -12.8902 0.82796E+00 -0.0820 69 MgOH+ 0.10979E-11 -11.9594 0.90900E-12 -12.0414 0.82796E+00 -0.0820 71 MnF+ 0.14356E-11 -11.8430 0.11886E-11 -11.9250 0.82796E+00 -0.0820 72 MnO,aq 0.47009E-11 -11.3278 0.47009E-11 -11.3278 0.10000E+01 0.0000 73 MnOH+ 0.24953E-09 -9.6029 0.20660E-09 -9.6849 0.82796E+00 -0.0820 74 MnO2-2 0.13871E-17 -17.8579 0.68865E-18 -18.1620 0.49649E+00 -0.3041 75 HMnO2- 0.27486E-14 -14.5609 0.22708E-14 -14.6438 0.82617E+00 -0.0829 78 MnCl+ 0.87002E-11 -11.0605 0.72035E-11 -11.1425 0.82796E+00 -0.0820 79 MnSO4,aq 0.14455E-09 -9.8400 0.14455E-09 -9.8400 0.10000E+01 0.0000 80 NaCl,aq 0.69122E-05 -5.1604 0.69122E-05 -5.1604 0.10000E+01 0.0000 81 NaF,aq 0.29457E-06 -6.5308 0.29457E-06 -6.5308 0.10000E+01 0.0000 82 NaOH,aq 0.52340E-06 -6.2812 0.52340E-06 -6.2812 0.10000E+01 0.0000 84 OH- 0.46558E-04 -4.3320 0.38386E-04 -4.4158 0.82449E+00 -0.0838 89 HPO3-2 0.68606E-17 -17.1636 0.34062E-17 -17.4677 0.49649E+00 -0.3041 91 H2PO3- 0.12444E-18 -18.9050 0.10281E-18 -18.9880 0.82617E+00 -0.0829 92 H3PO4,aq 0.31257E-13 -13.5051 0.31257E-13 -13.5051 0.10000E+01 0.0000 93 H2PO4- 0.66227E-08 -8.1790 0.54774E-08 -8.2614 0.82706E+00 -0.0825 94 PO4-3 0.48273E-11 -11.3163 0.10694E-11 -11.9709 0.22152E+00 -0.6546 97 H2P2O7-2 0.47383E-17 -17.3244 0.23525E-17 -17.6285 0.49649E+00 -0.3041 98 HP2O7-3 0.14875E-15 -15.8275 0.31209E-16 -16.5057 0.20980E+00 -0.6782 99 P2O7-4 0.76116E-17 -17.1185 0.49535E-18 -18.3051 0.65078E-01 -1.1866 100 H2S,aq 0.15346E-03 -3.8140 0.15238E-03 -3.8171 0.99297E+00 -0.0031 101 S2-2 0.86435E-08 -8.0633 0.42914E-08 -8.3674 0.49649E+00 -0.3041 102 S3-2 0.32027E-10 -10.4945 0.15901E-10 -10.7986 0.49649E+00 -0.3041 103 S3- 0.82497E-12 -12.0836 0.68157E-12 -12.1665 0.82617E+00 -0.0829 104 S4-2 0.78392E-13 -13.1057 0.38920E-13 -13.4098 0.49649E+00 -0.3041 105 S5-2 0.12794E-15 -15.8930 0.63523E-16 -16.1971 0.49649E+00 -0.3041 106 SO2,aq 0.27294E-16 -16.5639 0.27294E-16 -16.5639 0.10000E+01 0.0000 107 SO3-2 0.69472E-11 -11.1582 0.35057E-11 -11.4552 0.50462E+00 -0.2970 108 HSO3- 0.39989E-11 -11.3981 0.33038E-11 -11.4810 0.82617E+00 -0.0829 109 HSO4- 0.85207E-08 -8.0695 0.70626E-08 -8.1510 0.82888E+00 -0.0815 111 S2O3-2 0.17555E-08 -8.7556 0.87156E-09 -9.0597 0.49649E+00 -0.3041 112 HS2O3- 0.28390E-14 -14.5468 0.23455E-14 -14.6298 0.82617E+00 -0.0829 Charge balance for all species = -.6112E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1809423E-07 0.2539481E-03 0.2555001E+00 0.0000 2 H2O 0.1000000E+01 0.5550781E+02 0.9981762E+06 0.0000 3 Cl- 0.1376853E-02 0.1383768E-02 0.4896973E+02 4.8784 4 SO4-- 0.9783398E-03 0.9794469E-03 0.9391658E+02 12.3323 5 HCO3- 0.1456513E-01 0.1509657E-01 0.9194799E+03 5.9035 6 HS- 0.3964289E-02 0.4117859E-02 0.1359388E+03 5.3377 7 Al+++ 0.5130412E-20 0.1532242E-05 0.4126720E-01 2.4987 8 H4SiO4 0.1024605E-02 0.1120394E-02 0.1074918E+03 -2.9894 9 Ca++ 0.1359879E-06 0.2309009E-06 0.9237260E-02 8.4717 10 Mg++ 0.7066056E-10 0.9285955E-10 0.2253507E-05 5.1851 11 Fe++ 0.1561044E-13 0.3860313E-13 0.2151959E-08 1.5299 12 K+ 0.1555322E-03 0.1567159E-03 0.6116790E+01 3.9321 13 Na+ 0.2219842E-01 0.2222500E-01 0.5100217E+03 6.0857 14 Mn++ 0.2089954E-08 0.2498875E-08 0.1370342E-03 6.6570 15 F- 0.8325085E-04 0.8355257E-04 0.1584453E+01 3.6589 16 HPO4-- 0.3963190E-07 0.4625950E-07 0.4431888E-02 7.9399 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2152832E-03 0.2288532E-03 -.1356995E-04 0.0000000E+00 2 H2O 0.5000032E+02 0.5002260E+02 -.2227993E-01 0.0000000E+00 3 Cl- 0.1247025E-02 0.1247025E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8826672E-03 0.8826590E-03 0.8148059E-08 0.0000000E+00 5 HCO3- 0.1360475E-01 0.1360475E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3710994E-02 0.3710937E-02 0.5703641E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1380828E-05 0.3394524E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1009678E-02 0.1114334E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.3478841E-13 0.3259224E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2002876E-01 0.3394524E-05 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7529600E-04 0.7529600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.902819E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1879900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite 0.3395E-05 -5.469 0.8901E-03 -3.051 0.1329 0.3417E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5838E-03 0.7802E-06 quartz 0.1113E-01 -1.953 0.6689 -0.175 99.87 0.2526 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.669774 g Volume = 0.252941 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1879900 moles log = -0.7259 Original solution: 1000.0103000 g Original solution / Rock added: 5319.49 (Water/Rock Ratio), log = 3.7259 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0665 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9572E+00 0.9853 0.1006E+01 0.1021E+01 CO2,gas 0.3863E-01 1.0066 0.4147E-01 0.4120E-01 CH4,gas 0.1074E-03 1.0122 0.1159E-03 0.1145E-03 H2,gas 0.6817E-04 1.0006 0.7274E-04 0.7270E-04 H2S,gas 0.3944E-02 0.9959 0.4189E-02 0.4206E-02 S2,gas 0.1167E-15 1.0000 0.1245E-15 0.1245E-15 CO,gas 0.7539E-09 1.0000 0.8040E-09 0.8040E-09 SO3,gas 0.3911E-34 1.0000 0.4171E-34 0.4171E-34 SO2,gas 0.1107E-15 1.0000 0.1180E-15 0.1180E-15 HF,gas 0.1628E-10 1.0000 0.1736E-10 0.1736E-10 HCl,gas 0.5191E-14 1.0000 0.5536E-14 0.5536E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 101 kaolinite -1.33 -0.98 0.35 0.032 -0.59987E+03 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -9.74 -3.08 -1.027 0.52610E+04 -1.382 3 CH4,gas 4.54 -1.09 -5.63 -1.409 0.96211E+04 -3.936 4 H2,gas 8.00 2.16 -5.84 -3.336 0.99668E+04 -4.138 5 H2S,gas -6.23 -10.31 -4.08 -2.038 0.69612E+04 -2.378 6 S2,gas -7.34 -24.94 -17.60 -2.708 0.30058E+05 -15.905 7 CO,gas 3.21 -7.58 -10.79 -3.321 0.18430E+05 -9.095 8 SO3,gas 17.12 -18.96 -36.08 -9.020 0.61604E+05 -34.380 9 SO2,gas 0.83 -16.79 -17.63 -4.701 0.30098E+05 -15.928 10 HF,gas 0.47 -11.99 -12.46 -6.230 0.21274E+05 -10.760 11 HCl,gas 5.19 -10.77 -15.96 -7.978 0.27244E+05 -14.257 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 2.01 -2.99 -0.299 0.51114E+04 38 aragonite 0.97 -1.27 -2.24 -0.745 0.38182E+04 40 calcite 0.81 -1.27 -2.08 -0.694 0.35540E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.20 -4.38 -0.292 0.74761E+04 55 chloritoid-Mn 11.40 8.66 -2.74 -0.182 0.46718E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 5.00 -3.39 -0.308 0.57810E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.54 -4.22 -0.352 0.72104E+04 68 diaspore 2.87 2.50 -0.37 -0.062 0.64028E+03 69 diamond -3.10 -5.42 -2.31 -0.661 0.39507E+04 86 gibbsite 4.08 2.50 -1.58 -0.226 0.26988E+04 89 graphite -3.55 -5.42 -1.87 -0.534 0.31930E+04 94 heulandite -5.83 -7.46 -1.63 -0.074 0.27827E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.14 -0.592 0.70732E+04 102 kyanite 4.88 2.01 -2.87 -0.287 0.48973E+04 104 laumontite 2.88 1.51 -1.37 -0.091 0.23428E+04 105 lawsonite 9.62 7.49 -2.13 -0.142 0.36298E+04 106 leucite 4.12 0.45 -3.67 -0.367 0.62611E+04 116 margarite 17.32 12.49 -4.84 -0.193 0.82573E+04 119 microcline -2.49 -2.54 -0.05 -0.004 0.86993E+02 123 muscovite 2.58 2.46 -0.12 -0.007 0.20908E+03 124 paragonite 4.24 4.61 0.37 0.022 -0.63881E+03 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -8.78 -4.52 -1.506 0.77125E+04 147 pyrrhotiteFe0.875 -6.02 -9.24 -3.22 -1.184 0.54975E+04 148 pyroxmangite 7.40 3.67 -3.73 -0.746 0.63708E+04 149 pyrophyllite -6.18 -6.96 -0.78 -0.049 0.13395E+04 154 rhodochrosite -0.98 -3.08 -2.11 -0.703 0.35994E+04 155 rhodonite 7.45 3.67 -3.78 -0.756 0.64510E+04 156 sanidine -1.28 -2.54 -1.26 -0.097 0.21547E+04 159 sillimanite 5.26 2.01 -3.25 -0.325 0.55553E+04 166 stilbite -7.52 -7.46 0.07 0.003 -0.11111E+03 172 sulfur -9.15 -12.47 -3.32 -1.021 0.56643E+04 180 topaz-H 4.62 2.01 -2.61 -0.237 0.44574E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -8.78 -4.37 -1.455 0.74553E+04 190 wairakite 3.95 1.51 -2.44 -0.143 0.41647E+04 192 wollastonite 10.46 5.48 -4.98 -0.996 0.85014E+04 196 beidellite-Ca -1.65 -3.75 -2.11 -0.130 0.35956E+04 197 beidellite-H -2.33 -5.15 -2.82 -0.180 0.48202E+04 198 beidellite-K -1.52 -3.85 -2.33 -0.143 0.39808E+04 199 beidellite-Mg -1.79 -4.29 -2.50 -0.155 0.42754E+04 200 beidellite-Na -1.34 -3.14 -1.80 -0.110 0.30712E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.16 -2.84 -0.355 0.48470E+04 204 montmorillonite-Ca -2.29 -4.68 -2.39 -0.148 0.40728E+04 205 montmorillonite-K -2.24 -4.78 -2.54 -0.156 0.43361E+04 206 montmorillonite-Mg -2.48 -5.22 -2.74 -0.169 0.46757E+04 207 montmorillonite-Na -2.04 -4.07 -2.03 -0.124 0.34623E+04 234 alabandite -0.98 -3.65 -2.67 -0.891 0.45628E+04 237 boehmite 4.41 2.50 -1.91 -0.318 0.32572E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.19 -0.83 -0.064 0.14118E+04 248 an25ab75 2.65 1.58 -1.06 -0.082 0.18117E+04 249 an30ab70 3.28 1.98 -1.30 -0.100 0.22212E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 10 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1879900 Water: Moles liquid = 0.5002E+02 kg liquid = 0.9012E+00 Moles total = 0.5000E+02 kg total = 0.9008E+00 Activity = 1.0000 Stoichiometric ionic strength = .2365465E-01 Osmotic coef. = 0.9136 True ionic strength = .2384592E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1247E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.12239E-07 -7.9123 0.10170E-07 -7.9927 0.83098E+00 -0.0804 2 H2O 0.99999E+00 0.0000 0.99999E+00 0.0000 3 Cl- 0.13768E-02 -2.8611 0.11362E-02 -2.9445 0.82526E+00 -0.0834 4 SO4-- 0.97836E-03 -3.0095 0.48481E-03 -3.3144 0.49554E+00 -0.3049 5 HCO3- 0.14622E-01 -1.8350 0.12087E-01 -1.9177 0.82665E+00 -0.0827 6 HS- 0.40129E-02 -2.3965 0.33123E-02 -2.4799 0.82540E+00 -0.0833 7 Al+++ 0.10667E-20 -20.9720 0.22132E-21 -21.6550 0.20749E+00 -0.6830 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.12117E-06 -6.9166 0.59536E-07 -7.2252 0.49136E+00 -0.3086 10 Mg++ 0.67610E-10 -10.1700 0.33047E-10 -10.4809 0.48878E+00 -0.3109 11 Fe++ 0.16981E-13 -13.7700 0.83104E-14 -14.0804 0.48940E+00 -0.3103 12 K+ 0.15554E-03 -3.8082 0.12861E-03 -3.8907 0.82687E+00 -0.0826 13 Na+ 0.22502E-01 -1.6478 0.18566E-01 -1.7313 0.82508E+00 -0.0835 14 Mn++ 0.19921E-08 -8.7007 0.97585E-09 -9.0106 0.48986E+00 -0.3099 15 F- 0.83250E-04 -4.0796 0.68542E-04 -4.1640 0.82332E+00 -0.0844 16 HPO4-- 0.41573E-07 -7.3812 0.20604E-07 -7.6860 0.49562E+00 -0.3049 18 HSiO3- 0.11399E-03 -3.9431 0.94073E-04 -4.0265 0.82526E+00 -0.0834 19 Ca(HSiO3)+ 0.15422E-09 -9.8119 0.12755E-09 -9.8943 0.82707E+00 -0.0825 20 Mg(HSiO3)+ 0.10653E-12 -12.9725 0.88111E-13 -13.0550 0.82707E+00 -0.0825 21 NaHSiO3,aq 0.28248E-04 -4.5490 0.28248E-04 -4.5490 0.10000E+01 0.0000 22 AlO+ 0.35198E-12 -12.4535 0.29111E-12 -12.5359 0.82707E+00 -0.0825 23 AlOH+2 0.30061E-16 -16.5220 0.14742E-16 -16.8314 0.49041E+00 -0.3094 24 HAlO2,aq 0.57004E-08 -8.2441 0.57004E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.15065E-05 -5.8220 0.12407E-05 -5.9063 0.82356E+00 -0.0843 26 CH4,aq 0.80788E-07 -7.0927 0.80216E-07 -7.0957 0.99292E+00 -0.0031 27 C2H6,aq 0.18059E-16 -16.7433 0.17932E-16 -16.7464 0.99292E+00 -0.0031 31 CO,aq 0.40479E-12 -12.3928 0.40479E-12 -12.3928 0.10000E+01 0.0000 32 CO2,aq 0.26454E-03 -3.5775 0.26267E-03 -3.5806 0.99292E+00 -0.0031 33 CO3-2 0.21000E-03 -3.6778 0.10381E-03 -3.9838 0.49433E+00 -0.3060 34 CaCO3,aq 0.77497E-07 -7.1107 0.77497E-07 -7.1107 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.22210E-07 -7.6535 0.18369E-07 -7.7359 0.82707E+00 -0.0825 36 CaCl+ 0.13236E-09 -9.8782 0.10947E-09 -9.9607 0.82707E+00 -0.0825 37 CaCl2,aq 0.29551E-13 -13.5294 0.29551E-13 -13.5294 0.10000E+01 0.0000 38 CaF+ 0.72036E-10 -10.1425 0.59579E-10 -10.2249 0.82707E+00 -0.0825 39 CaOH+ 0.50445E-09 -9.2972 0.41721E-09 -9.3796 0.82707E+00 -0.0825 40 CaSO4,aq 0.91656E-08 -8.0378 0.91656E-08 -8.0378 0.10000E+01 0.0000 41 HCl,aq 0.21175E-11 -11.6742 0.21175E-11 -11.6742 0.10000E+01 0.0000 45 HF,aq 0.47720E-08 -8.3213 0.47720E-08 -8.3213 0.10000E+01 0.0000 46 HF2- 0.13381E-12 -12.8735 0.11043E-12 -12.9569 0.82526E+00 -0.0834 48 FeCl+ 0.18071E-16 -16.7430 0.14946E-16 -16.8255 0.82707E+00 -0.0825 51 FeF+ 0.35194E-16 -16.4535 0.29108E-16 -16.5360 0.82707E+00 -0.0825 53 FeO,aq 0.31227E-14 -14.5055 0.31227E-14 -14.5055 0.10000E+01 0.0000 54 FeOH+ 0.32160E-13 -13.4927 0.26599E-13 -13.5751 0.82707E+00 -0.0825 55 HFeO2- 0.38929E-14 -14.4097 0.32127E-14 -14.4931 0.82526E+00 -0.0834 56 FeO+ 0.30971E-18 -18.5091 0.25615E-18 -18.5915 0.82707E+00 -0.0825 58 FeO2- 0.61404E-15 -15.2118 0.50674E-15 -15.2952 0.82526E+00 -0.0834 59 HFeO2,aq 0.65546E-15 -15.1835 0.65546E-15 -15.1835 0.10000E+01 0.0000 60 H2,aq 0.61783E-07 -7.2091 0.61346E-07 -7.2122 0.99292E+00 -0.0031 61 KCl,aq 0.26484E-08 -8.5770 0.26484E-08 -8.5770 0.10000E+01 0.0000 62 KHSO4,aq 0.17929E-14 -14.7465 0.17929E-14 -14.7465 0.10000E+01 0.0000 63 KOH,aq 0.54004E-08 -8.2676 0.54004E-08 -8.2676 0.10000E+01 0.0000 64 KSO4- 0.11724E-05 -5.9309 0.96753E-06 -6.0143 0.82526E+00 -0.0834 65 MgCO3,aq 0.10782E-10 -10.9673 0.10782E-10 -10.9673 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12597E-10 -10.8997 0.10419E-10 -10.9822 0.82707E+00 -0.0825 67 MgCl+ 0.66588E-13 -13.1766 0.55073E-13 -13.2591 0.82707E+00 -0.0825 68 MgF+ 0.14812E-12 -12.8294 0.12250E-12 -12.9119 0.82707E+00 -0.0825 69 MgOH+ 0.15494E-11 -11.8098 0.12815E-11 -11.8923 0.82707E+00 -0.0825 71 MnF+ 0.13622E-11 -11.8658 0.11266E-11 -11.9482 0.82707E+00 -0.0825 72 MnO,aq 0.97707E-11 -11.0101 0.97707E-11 -11.0101 0.10000E+01 0.0000 73 MnOH+ 0.35082E-09 -9.4549 0.29015E-09 -9.5374 0.82707E+00 -0.0825 74 MnO2-2 0.63420E-17 -17.1978 0.31350E-17 -17.5038 0.49433E+00 -0.3060 75 HMnO2- 0.84642E-14 -14.0724 0.69852E-14 -14.1558 0.82526E+00 -0.0834 78 MnCl+ 0.82553E-11 -11.0833 0.68277E-11 -11.1657 0.82707E+00 -0.0825 79 MnSO4,aq 0.13658E-09 -9.8646 0.13658E-09 -9.8646 0.10000E+01 0.0000 80 NaCl,aq 0.69907E-05 -5.1555 0.69907E-05 -5.1555 0.10000E+01 0.0000 81 NaF,aq 0.29792E-06 -6.5259 0.29792E-06 -6.5259 0.10000E+01 0.0000 82 NaOH,aq 0.78433E-06 -6.1055 0.78433E-06 -6.1055 0.10000E+01 0.0000 84 OH- 0.68982E-04 -4.1613 0.56811E-04 -4.2456 0.82356E+00 -0.0843 89 HPO3-2 0.79685E-17 -17.0986 0.39391E-17 -17.4046 0.49433E+00 -0.3060 91 H2PO3- 0.97343E-19 -19.0117 0.80334E-19 -19.0951 0.82526E+00 -0.0834 92 H3PO4,aq 0.14905E-13 -13.8267 0.14905E-13 -13.8267 0.10000E+01 0.0000 93 H2PO4- 0.46790E-08 -8.3298 0.38656E-08 -8.4128 0.82616E+00 -0.0829 94 PO4-3 0.75311E-11 -11.1231 0.16530E-11 -11.7817 0.21949E+00 -0.6586 97 H2P2O7-2 0.23702E-17 -17.6252 0.11717E-17 -17.9312 0.49433E+00 -0.3060 98 HP2O7-3 0.11074E-15 -15.9557 0.23004E-16 -16.6382 0.20774E+00 -0.6825 99 P2O7-4 0.84477E-17 -17.0733 0.54038E-18 -18.2673 0.63968E-01 -1.1940 100 H2S,aq 0.10485E-03 -3.9794 0.10411E-03 -3.9825 0.99292E+00 -0.0031 101 S2-2 0.80163E-08 -8.0960 0.39627E-08 -8.4020 0.49433E+00 -0.3060 102 S3-2 0.18329E-10 -10.7369 0.90605E-11 -11.0428 0.49433E+00 -0.3060 103 S3- 0.30219E-12 -12.5197 0.24938E-12 -12.6031 0.82526E+00 -0.0834 104 S4-2 0.27683E-13 -13.5578 0.13685E-13 -13.8638 0.49433E+00 -0.3060 105 S5-2 0.27880E-16 -16.5547 0.13782E-16 -16.8607 0.49433E+00 -0.3060 106 SO2,aq 0.13738E-16 -16.8621 0.13738E-16 -16.8621 0.10000E+01 0.0000 107 SO3-2 0.76910E-11 -11.1140 0.38649E-11 -11.4129 0.50253E+00 -0.2988 108 HSO3- 0.29822E-11 -11.5255 0.24611E-11 -11.6089 0.82526E+00 -0.0834 109 HSO4- 0.57388E-08 -8.2412 0.47517E-08 -8.3232 0.82800E+00 -0.0820 111 S2O3-2 0.11994E-08 -8.9210 0.59291E-09 -9.2270 0.49433E+00 -0.3060 112 HS2O3- 0.13065E-14 -14.8839 0.10782E-14 -14.9673 0.82526E+00 -0.0834 Charge balance for all species = -.6112E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1223863E-07 -.5872689E-04 -.5908505E-01 0.0000 2 H2O 0.1000000E+01 0.5550792E+02 0.9981649E+06 0.0000 3 Cl- 0.1376783E-02 0.1383776E-02 0.4896939E+02 5.0481 4 SO4-- 0.9783586E-03 0.9794531E-03 0.9391594E+02 12.6709 5 HCO3- 0.1462194E-01 0.1509667E-01 0.9194736E+03 6.0750 6 HS- 0.4012921E-02 0.4117885E-02 0.1359379E+03 5.5128 7 Al+++ 0.1066698E-20 0.1512241E-05 0.4072798E-01 2.3231 8 H4SiO4 0.1024612E-02 0.1166851E-02 0.1119475E+03 -2.9894 9 Ca++ 0.1211668E-06 0.2309023E-06 0.9237197E-02 8.7601 10 Mg++ 0.6761025E-10 0.9286014E-10 0.2253491E-05 5.5045 11 Fe++ 0.1698090E-13 0.5747973E-13 0.3204206E-08 1.9050 12 K+ 0.1555364E-03 0.1567169E-03 0.6116748E+01 4.1019 13 Na+ 0.2250156E-01 0.2253788E-01 0.5171948E+03 6.2614 14 Mn++ 0.1992096E-08 0.2498891E-08 0.1370333E-03 6.9747 15 F- 0.8325033E-04 0.8355310E-04 0.1584442E+01 3.8286 16 HPO4-- 0.4157324E-07 0.4625979E-07 0.4431857E-02 8.2993 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2152832E-03 -.5292324E-04 0.2682065E-03 0.0000000E+00 2 H2O 0.5000032E+02 0.5002237E+02 -.2205525E-01 0.0000000E+00 3 Cl- 0.1247025E-02 0.1247025E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8826672E-03 0.8826590E-03 0.8148055E-08 0.0000000E+00 5 HCO3- 0.1360475E-01 0.1360475E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3710994E-02 0.3710937E-02 0.5703638E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1362794E-05 0.3412558E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1051537E-02 0.1110148E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.5179932E-13 0.3259222E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2031059E-01 -.2784360E-03 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7529600E-04 0.7529600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.5421E-19 Mass of aqueous solution: 0.902825E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1879900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) albite -.2784E-03 1.000 -.7301E-01 1.000 -11.00 -.2803E-01 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5893E-03 0.7802E-06 quartz 0.1165E-01 -1.933 0.7002 -0.155 105.5 0.2644 kaolinite 0.1409E-03 -3.851 0.3638E-01 -1.439 5.482 0.1400E-01 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity albite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 kaolinite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.663602 g Volume = 0.250408 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1879900 moles log = -0.7259 Original solution: 1000.0103000 g Original solution / Rock added: 5319.49 (Water/Rock Ratio), log = 3.7259 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0517 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9705E+00 0.9855 0.1006E+01 0.1021E+01 CO2,gas 0.2654E-01 1.0068 0.2810E-01 0.2791E-01 CH4,gas 0.1109E-03 1.0123 0.1181E-03 0.1166E-03 H2,gas 0.7654E-04 1.0006 0.8054E-04 0.8050E-04 H2S,gas 0.2732E-02 0.9959 0.2862E-02 0.2874E-02 S2,gas 0.4507E-16 1.0000 0.4740E-16 0.4740E-16 CO,gas 0.5736E-09 1.0000 0.6032E-09 0.6032E-09 SO3,gas 0.1803E-34 1.0000 0.1896E-34 0.1896E-34 SO2,gas 0.5649E-16 1.0000 0.5941E-16 0.5941E-16 HF,gas 0.1114E-10 1.0000 0.1172E-10 0.1172E-10 HCl,gas 0.3553E-14 1.0000 0.3736E-14 0.3736E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 101 kaolinite -1.33 -1.33 0.00 0.000 -0.64453E-11 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -9.91 -3.25 -1.083 0.55497E+04 -1.551 3 CH4,gas 4.54 -1.08 -5.63 -1.407 0.96076E+04 -3.928 4 H2,gas 8.00 2.21 -5.79 -3.310 0.98913E+04 -4.094 5 H2S,gas -6.23 -10.47 -4.24 -2.121 0.72436E+04 -2.543 6 S2,gas -7.34 -25.36 -18.02 -2.773 0.30774E+05 -16.324 7 CO,gas 3.21 -7.70 -10.92 -3.360 0.18643E+05 -9.220 8 SO3,gas 17.12 -19.30 -36.42 -9.105 0.62188E+05 -34.722 9 SO2,gas 0.83 -17.09 -17.93 -4.780 0.30607E+05 -16.226 10 HF,gas 0.47 -12.16 -12.63 -6.315 0.21566E+05 -10.931 11 HCl,gas 5.19 -10.94 -16.13 -8.063 0.27536E+05 -14.428 16 albite-high 0.69 -0.38 -1.08 -0.083 0.18388E+04 17 albite -0.38 -0.38 0.00 0.000 -0.94784E-12 21 analcite 3.32 2.61 -0.72 -0.080 0.12231E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57112E+04 38 aragonite 0.97 -1.15 -2.12 -0.706 0.36143E+04 40 calcite 0.81 -1.15 -1.96 -0.654 0.33500E+04 41 carnegieite-low 9.02 5.60 -3.43 -0.490 0.58537E+04 42 carnegieite-high 10.09 5.60 -4.50 -0.643 0.76807E+04 43 carpholite-Mg 8.58 4.17 -4.41 -0.294 0.75306E+04 55 chloritoid-Mn 11.40 8.63 -2.77 -0.185 0.47291E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63808E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.54 -4.23 -0.352 0.72204E+04 68 diaspore 2.87 2.32 -0.55 -0.092 0.94021E+03 69 diamond -3.10 -5.50 -2.39 -0.684 0.40883E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.50 -1.95 -0.557 0.33305E+04 94 heulandite -5.83 -7.52 -1.69 -0.077 0.28900E+04 98 jadeite 4.22 2.61 -1.61 -0.161 0.27485E+04 100 kalsilite 7.58 3.44 -4.15 -0.593 0.70832E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54971E+04 104 laumontite 2.88 1.45 -1.43 -0.096 0.24501E+04 105 lawsonite 9.62 7.43 -2.19 -0.146 0.37372E+04 106 leucite 4.12 0.45 -3.67 -0.367 0.62711E+04 119 microcline -2.49 -2.54 -0.06 -0.004 0.97011E+02 123 muscovite 2.58 2.10 -0.48 -0.028 0.81897E+03 124 paragonite 4.24 4.26 0.02 0.001 -0.38941E+02 125 nepheline 8.34 5.60 -2.74 -0.392 0.46861E+04 146 pyrrhotite -4.26 -8.57 -4.31 -1.436 0.73545E+04 147 pyrrhotiteFe0.875 -6.02 -9.08 -3.06 -1.126 0.52290E+04 148 pyroxmangite 7.40 3.99 -3.41 -0.683 0.58283E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -2.94 -1.96 -0.653 0.33454E+04 155 rhodonite 7.45 3.99 -3.46 -0.692 0.59085E+04 156 sanidine -1.28 -2.54 -1.27 -0.098 0.21648E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61552E+04 166 stilbite -7.52 -7.52 0.00 0.000 -0.37979E+01 172 sulfur -9.15 -12.68 -3.53 -1.085 0.60223E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50572E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -8.57 -4.16 -1.386 0.70973E+04 190 wairakite 3.95 1.45 -2.50 -0.147 0.42720E+04 192 wollastonite 10.46 5.77 -4.69 -0.938 0.80088E+04 196 beidellite-Ca -1.65 -4.11 -2.47 -0.153 0.42132E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.20 -2.68 -0.164 0.45840E+04 199 beidellite-Mg -1.79 -4.65 -2.86 -0.177 0.48842E+04 200 beidellite-Na -1.34 -3.49 -2.15 -0.132 0.36711E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.376 0.51356E+04 204 montmorillonite-Ca -2.29 -4.82 -2.53 -0.156 0.43124E+04 205 montmorillonite-K -2.24 -4.91 -2.67 -0.164 0.45614E+04 206 montmorillonite-Mg -2.48 -5.35 -2.87 -0.178 0.49067E+04 207 montmorillonite-Na -2.04 -4.20 -2.16 -0.132 0.36842E+04 234 alabandite -0.98 -3.50 -2.52 -0.840 0.43027E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35571E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 1.18 -0.84 -0.065 0.14332E+04 248 an25ab75 2.65 1.57 -1.08 -0.083 0.18385E+04 249 an30ab70 3.28 1.96 -1.32 -0.102 0.22534E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 9 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1879900 Water: Moles liquid = 0.5002E+02 kg liquid = 0.9012E+00 Moles total = 0.5000E+02 kg total = 0.9008E+00 Activity = 1.0000 Stoichiometric ionic strength = .2349788E-01 Osmotic coef. = 0.9138 True ionic strength = .2347811E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1247E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18001E-07 -7.7447 0.14973E-07 -7.8247 0.83182E+00 -0.0800 2 H2O 0.99999E+00 0.0000 0.99999E+00 0.0000 3 Cl- 0.13769E-02 -2.8611 0.11375E-02 -2.9440 0.82616E+00 -0.0829 4 SO4-- 0.97834E-03 -3.0095 0.48688E-03 -3.3126 0.49766E+00 -0.3031 5 HCO3- 0.14566E-01 -1.8366 0.12054E-01 -1.9189 0.82753E+00 -0.0822 6 HS- 0.39651E-02 -2.4018 0.32763E-02 -2.4846 0.82630E+00 -0.0829 7 Al+++ 0.33711E-20 -20.4722 0.70633E-21 -21.1510 0.20953E+00 -0.6788 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.13581E-06 -6.8671 0.67021E-07 -7.1738 0.49351E+00 -0.3067 10 Mg++ 0.70625E-10 -10.1510 0.34674E-10 -10.4600 0.49096E+00 -0.3090 11 Fe++ 0.15627E-13 -13.8061 0.76816E-14 -14.1145 0.49156E+00 -0.3084 12 K+ 0.15553E-03 -3.8082 0.12874E-03 -3.8903 0.82775E+00 -0.0821 13 Na+ 0.22202E-01 -1.6536 0.18339E-01 -1.7366 0.82599E+00 -0.0830 14 Mn++ 0.20888E-08 -8.6801 0.10278E-08 -8.9881 0.49203E+00 -0.3080 15 F- 0.83251E-04 -4.0796 0.68619E-04 -4.1636 0.82424E+00 -0.0839 16 HPO4-- 0.39662E-07 -7.4016 0.19741E-07 -7.7046 0.49774E+00 -0.3030 18 HSiO3- 0.77340E-04 -4.1116 0.63896E-04 -4.1945 0.82616E+00 -0.0829 19 Ca(HSiO3)+ 0.11779E-09 -9.9289 0.97526E-10 -10.0109 0.82795E+00 -0.0820 20 Mg(HSiO3)+ 0.75841E-13 -13.1201 0.62793E-13 -13.2021 0.82795E+00 -0.0820 21 NaHSiO3,aq 0.18952E-04 -4.7224 0.18952E-04 -4.7224 0.10000E+01 0.0000 22 AlO+ 0.51766E-12 -12.2860 0.42860E-12 -12.3680 0.82795E+00 -0.0820 23 AlOH+2 0.64875E-16 -16.1879 0.31955E-16 -16.4955 0.49257E+00 -0.3075 24 HAlO2,aq 0.57004E-08 -8.2441 0.57004E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.10221E-05 -5.9905 0.84272E-06 -6.0743 0.82448E+00 -0.0838 26 CH4,aq 0.79351E-07 -7.1004 0.78793E-07 -7.1035 0.99297E+00 -0.0031 27 C2H6,aq 0.19266E-16 -16.7152 0.19130E-16 -16.7183 0.99297E+00 -0.0031 31 CO,aq 0.53752E-12 -12.2696 0.53752E-12 -12.2696 0.10000E+01 0.0000 32 CO2,aq 0.38840E-03 -3.4107 0.38567E-03 -3.4138 0.99297E+00 -0.0031 33 CO3-2 0.14164E-03 -3.8488 0.70317E-04 -4.1529 0.49646E+00 -0.3041 34 CaCO3,aq 0.59093E-07 -7.2285 0.59093E-07 -7.2285 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.24907E-07 -7.6037 0.20622E-07 -7.6857 0.82795E+00 -0.0820 36 CaCl+ 0.14901E-09 -9.8268 0.12338E-09 -9.9088 0.82795E+00 -0.0820 37 CaCl2,aq 0.33342E-13 -13.4770 0.33342E-13 -13.4770 0.10000E+01 0.0000 38 CaF+ 0.81098E-10 -10.0910 0.67145E-10 -10.1730 0.82795E+00 -0.0820 39 CaOH+ 0.38529E-09 -9.4142 0.31900E-09 -9.4962 0.82795E+00 -0.0820 40 CaSO4,aq 0.10362E-07 -7.9846 0.10362E-07 -7.9846 0.10000E+01 0.0000 41 HCl,aq 0.31211E-11 -11.5057 0.31211E-11 -11.5057 0.10000E+01 0.0000 45 HF,aq 0.70336E-08 -8.1528 0.70336E-08 -8.1528 0.10000E+01 0.0000 46 HF2- 0.19724E-12 -12.7050 0.16295E-12 -12.7879 0.82616E+00 -0.0829 48 FeCl+ 0.16705E-16 -16.7772 0.13831E-16 -16.8592 0.82795E+00 -0.0820 51 FeF+ 0.32533E-16 -16.4877 0.26936E-16 -16.5697 0.82795E+00 -0.0820 53 FeO,aq 0.13316E-14 -14.8756 0.13316E-14 -14.8756 0.10000E+01 0.0000 54 FeOH+ 0.20169E-13 -13.6953 0.16699E-13 -13.7773 0.82795E+00 -0.0820 55 HFeO2- 0.11263E-14 -14.9483 0.93051E-15 -15.0313 0.82616E+00 -0.0829 56 FeO+ 0.20424E-18 -18.6899 0.16910E-18 -18.7718 0.82795E+00 -0.0820 58 FeO2- 0.18681E-15 -15.7286 0.15433E-15 -15.8115 0.82616E+00 -0.0829 59 HFeO2,aq 0.29391E-15 -15.5318 0.29391E-15 -15.5318 0.10000E+01 0.0000 60 H2,aq 0.55874E-07 -7.2528 0.55481E-07 -7.2559 0.99297E+00 -0.0031 61 KCl,aq 0.26542E-08 -8.5761 0.26542E-08 -8.5761 0.10000E+01 0.0000 62 KHSO4,aq 0.26536E-14 -14.5762 0.26536E-14 -14.5762 0.10000E+01 0.0000 63 KOH,aq 0.36718E-08 -8.4351 0.36718E-08 -8.4351 0.10000E+01 0.0000 64 KSO4- 0.11773E-05 -5.9291 0.97266E-06 -6.0120 0.82616E+00 -0.0829 65 MgCO3,aq 0.76631E-11 -11.1156 0.76631E-11 -11.1156 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13167E-10 -10.8805 0.10902E-10 -10.9625 0.82795E+00 -0.0820 67 MgCl+ 0.69872E-13 -13.1557 0.57851E-13 -13.2377 0.82795E+00 -0.0820 68 MgF+ 0.15542E-12 -12.8085 0.12868E-12 -12.8905 0.82795E+00 -0.0820 69 MgOH+ 0.11030E-11 -11.9574 0.91324E-12 -12.0394 0.82795E+00 -0.0820 71 MnF+ 0.14347E-11 -11.8432 0.11879E-11 -11.9252 0.82795E+00 -0.0820 72 MnO,aq 0.47473E-11 -11.3236 0.47473E-11 -11.3236 0.10000E+01 0.0000 73 MnOH+ 0.25069E-09 -9.6009 0.20756E-09 -9.6829 0.82795E+00 -0.0820 74 MnO2-2 0.14155E-17 -17.8491 0.70272E-18 -18.1532 0.49646E+00 -0.3041 75 HMnO2- 0.27903E-14 -14.5544 0.23052E-14 -14.6373 0.82616E+00 -0.0829 78 MnCl+ 0.86952E-11 -11.0607 0.71992E-11 -11.1427 0.82795E+00 -0.0820 79 MnSO4,aq 0.14446E-09 -9.8403 0.14446E-09 -9.8403 0.10000E+01 0.0000 80 NaCl,aq 0.69131E-05 -5.1603 0.69131E-05 -5.1603 0.10000E+01 0.0000 81 NaF,aq 0.29461E-06 -6.5308 0.29461E-06 -6.5308 0.10000E+01 0.0000 82 NaOH,aq 0.52621E-06 -6.2788 0.52621E-06 -6.2788 0.10000E+01 0.0000 84 OH- 0.46801E-04 -4.3297 0.38587E-04 -4.4136 0.82448E+00 -0.0838 89 HPO3-2 0.68750E-17 -17.1627 0.34132E-17 -17.4668 0.49646E+00 -0.3041 91 H2PO3- 0.12405E-18 -18.9064 0.10248E-18 -18.9893 0.82616E+00 -0.0829 92 H3PO4,aq 0.30955E-13 -13.5093 0.30955E-13 -13.5093 0.10000E+01 0.0000 93 H2PO4- 0.65931E-08 -8.1809 0.54528E-08 -8.2634 0.82705E+00 -0.0825 94 PO4-3 0.48564E-11 -11.3137 0.10757E-11 -11.9683 0.22150E+00 -0.6546 97 H2P2O7-2 0.46960E-17 -17.3283 0.23314E-17 -17.6324 0.49646E+00 -0.3041 98 HP2O7-3 0.14820E-15 -15.8291 0.31090E-16 -16.5074 0.20978E+00 -0.6782 99 P2O7-4 0.76237E-17 -17.1178 0.49604E-18 -18.3045 0.65065E-01 -1.1867 100 H2S,aq 0.15269E-03 -3.8162 0.15162E-03 -3.8193 0.99297E+00 -0.0031 101 S2-2 0.86353E-08 -8.0637 0.42871E-08 -8.3678 0.49646E+00 -0.3041 102 S3-2 0.31794E-10 -10.4977 0.15784E-10 -10.8018 0.49646E+00 -0.3041 103 S3- 0.81411E-12 -12.0893 0.67259E-12 -12.1722 0.82616E+00 -0.0829 104 S4-2 0.77325E-13 -13.1117 0.38389E-13 -13.4158 0.49646E+00 -0.3041 105 S5-2 0.12540E-15 -15.9017 0.62256E-16 -16.2058 0.49646E+00 -0.3041 106 SO2,aq 0.27047E-16 -16.5679 0.27047E-16 -16.5679 0.10000E+01 0.0000 107 SO3-2 0.69566E-11 -11.1576 0.35103E-11 -11.4547 0.50459E+00 -0.2971 108 HSO3- 0.39834E-11 -11.3997 0.32909E-11 -11.4827 0.82616E+00 -0.0829 109 HSO4- 0.84762E-08 -8.0718 0.70256E-08 -8.1533 0.82887E+00 -0.0815 111 S2O3-2 0.17467E-08 -8.7578 0.86715E-09 -9.0619 0.49646E+00 -0.3041 112 HS2O3- 0.28101E-14 -14.5513 0.23216E-14 -14.6342 0.82616E+00 -0.0829 Charge balance for all species = -.6112E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1800058E-07 0.2516946E-03 0.2532329E+00 0.0000 2 H2O 0.1000000E+01 0.5550782E+02 0.9981761E+06 0.0000 3 Cl- 0.1376852E-02 0.1383768E-02 0.4896973E+02 4.8806 4 SO4-- 0.9783400E-03 0.9794469E-03 0.9391657E+02 12.3368 5 HCO3- 0.1456637E-01 0.1509657E-01 0.9194798E+03 5.9058 6 HS- 0.3965058E-02 0.4117860E-02 0.1359388E+03 5.3401 7 Al+++ 0.3371064E-20 0.1027827E-05 0.2768200E-01 2.3231 8 H4SiO4 0.1024605E-02 0.1120897E-02 0.1075401E+03 -2.9894 9 Ca++ 0.1358053E-06 0.2309009E-06 0.9237259E-02 8.4756 10 Mg++ 0.7062527E-10 0.9285956E-10 0.2253507E-05 5.1894 11 Fe++ 0.1562684E-13 0.3878421E-13 0.2162053E-08 1.5348 12 K+ 0.1555322E-03 0.1567159E-03 0.6116790E+01 3.9344 13 Na+ 0.2220209E-01 0.2222877E-01 0.5101081E+03 6.0881 14 Mn++ 0.2088847E-08 0.2498875E-08 0.1370342E-03 6.6613 15 F- 0.8325085E-04 0.8355258E-04 0.1584453E+01 3.6611 16 HPO4-- 0.3966156E-07 0.4625950E-07 0.4431887E-02 7.9447 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2152832E-03 0.2268224E-03 -.1153913E-04 0.0000000E+00 2 H2O 0.5000032E+02 0.5002259E+02 -.2227619E-01 0.0000000E+00 3 Cl- 0.1247025E-02 0.1247025E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8826672E-03 0.8826590E-03 0.8148059E-08 0.0000000E+00 5 HCO3- 0.1360475E-01 0.1360475E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3710994E-02 0.3710937E-02 0.5703641E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.9262580E-06 0.3849094E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1010131E-02 0.1114289E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.3495160E-13 0.3259224E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7529600E-04 0.7529600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1694E-20 Mass of aqueous solution: 0.902819E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1879900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.1925E-05 -5.716 0.4968E-03 -3.304 0.7418E-01 0.1912E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5839E-03 0.7802E-06 quartz 0.1114E-01 -1.953 0.6692 -0.174 99.93 0.2527 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity kaolinite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.669734 g Volume = 0.252924 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1879900 moles log = -0.7259 Original solution: 1000.0103000 g Original solution / Rock added: 5319.49 (Water/Rock Ratio), log = 3.7259 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0663 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9575E+00 0.9853 0.1006E+01 0.1021E+01 CO2,gas 0.3844E-01 1.0066 0.4126E-01 0.4099E-01 CH4,gas 0.1075E-03 1.0122 0.1160E-03 0.1146E-03 H2,gas 0.6827E-04 1.0006 0.7284E-04 0.7280E-04 H2S,gas 0.3925E-02 0.9959 0.4168E-02 0.4185E-02 S2,gas 0.1153E-15 1.0000 0.1229E-15 0.1229E-15 CO,gas 0.7512E-09 1.0000 0.8010E-09 0.8010E-09 SO3,gas 0.3871E-34 1.0000 0.4127E-34 0.4127E-34 SO2,gas 0.1097E-15 1.0000 0.1170E-15 0.1170E-15 HF,gas 0.1620E-10 1.0000 0.1727E-10 0.1727E-10 HCl,gas 0.5165E-14 1.0000 0.5507E-14 0.5507E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 101 kaolinite -1.33 -1.33 0.00 0.000 0.56870E-11 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -9.74 -3.08 -1.028 0.52649E+04 -1.384 3 CH4,gas 4.54 -1.09 -5.63 -1.409 0.96209E+04 -3.936 4 H2,gas 8.00 2.16 -5.84 -3.335 0.99658E+04 -4.138 5 H2S,gas -6.23 -10.31 -4.08 -2.040 0.69649E+04 -2.380 6 S2,gas -7.34 -24.94 -17.61 -2.709 0.30068E+05 -15.910 7 CO,gas 3.21 -7.58 -10.80 -3.322 0.18433E+05 -9.096 8 SO3,gas 17.12 -18.96 -36.08 -9.021 0.61611E+05 -34.384 9 SO2,gas 0.83 -16.80 -17.63 -4.702 0.30104E+05 -15.932 10 HF,gas 0.47 -11.99 -12.46 -6.231 0.21278E+05 -10.763 11 HCl,gas 5.19 -10.77 -15.96 -7.979 0.27248E+05 -14.259 16 albite-high 0.69 -0.56 -1.25 -0.096 0.21348E+04 17 albite -0.38 -0.56 -0.17 -0.013 0.29596E+03 21 analcite 3.32 2.43 -0.89 -0.099 0.15190E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57112E+04 38 aragonite 0.97 -1.27 -2.23 -0.745 0.38153E+04 40 calcite 0.81 -1.27 -2.08 -0.693 0.35511E+04 41 carnegieite-low 9.02 5.42 -3.60 -0.515 0.61497E+04 42 carnegieite-high 10.09 5.42 -4.67 -0.667 0.79767E+04 43 carpholite-Mg 8.58 3.86 -4.73 -0.315 0.80687E+04 55 chloritoid-Mn 11.40 8.32 -3.08 -0.206 0.52644E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63808E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.71 -4.40 -0.366 0.75065E+04 68 diaspore 2.87 2.32 -0.55 -0.092 0.94021E+03 69 diamond -3.10 -5.42 -2.31 -0.661 0.39525E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.42 -1.87 -0.535 0.31948E+04 94 heulandite -5.83 -7.80 -1.98 -0.090 0.33759E+04 98 jadeite 4.22 2.43 -1.78 -0.178 0.30445E+04 100 kalsilite 7.58 3.27 -4.32 -0.617 0.73693E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54971E+04 104 laumontite 2.88 1.16 -1.72 -0.115 0.29360E+04 105 lawsonite 9.62 7.14 -2.47 -0.165 0.42230E+04 106 leucite 4.12 0.28 -3.84 -0.384 0.65572E+04 119 microcline -2.49 -2.71 -0.22 -0.017 0.38308E+03 123 muscovite 2.58 1.94 -0.65 -0.038 0.11050E+04 124 paragonite 4.24 4.09 -0.15 -0.009 0.25702E+03 125 nepheline 8.34 5.42 -2.92 -0.417 0.49820E+04 146 pyrrhotite -4.26 -8.77 -4.51 -1.505 0.77078E+04 147 pyrrhotiteFe0.875 -6.02 -9.23 -3.22 -1.183 0.54940E+04 148 pyroxmangite 7.40 3.67 -3.73 -0.745 0.63635E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -3.08 -2.11 -0.702 0.35959E+04 155 rhodonite 7.45 3.67 -3.77 -0.755 0.64438E+04 156 sanidine -1.28 -2.71 -1.44 -0.110 0.24508E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61552E+04 166 stilbite -7.52 -7.80 -0.28 -0.013 0.48208E+03 172 sulfur -9.15 -12.47 -3.32 -1.022 0.56690E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50572E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -8.77 -4.36 -1.455 0.74506E+04 190 wairakite 3.95 1.16 -2.79 -0.164 0.47579E+04 192 wollastonite 10.46 5.49 -4.98 -0.995 0.84947E+04 196 beidellite-Ca -1.65 -4.16 -2.51 -0.156 0.42933E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.26 -2.74 -0.168 0.46784E+04 199 beidellite-Mg -1.79 -4.70 -2.91 -0.180 0.49730E+04 200 beidellite-Na -1.34 -3.55 -2.21 -0.135 0.37688E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.377 0.51468E+04 204 montmorillonite-Ca -2.29 -4.97 -2.68 -0.166 0.45702E+04 205 montmorillonite-K -2.24 -5.07 -2.83 -0.173 0.48333E+04 206 montmorillonite-Mg -2.48 -5.51 -3.03 -0.187 0.51730E+04 207 montmorillonite-Na -2.04 -4.36 -2.32 -0.142 0.39595E+04 234 alabandite -0.98 -3.65 -2.67 -0.890 0.45592E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35571E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 0.98 -1.03 -0.080 0.17672E+04 248 an25ab75 2.65 1.37 -1.28 -0.098 0.21820E+04 249 an30ab70 3.28 1.75 -1.53 -0.117 0.26064E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1879900 MOLES New total amount of reactant added: 0.1919900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 9 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1919900 Water: Moles liquid = 0.5003E+02 kg liquid = 0.9012E+00 Moles total = 0.5000E+02 kg total = 0.9008E+00 Activity = 1.0000 Stoichiometric ionic strength = .2375462E-01 Osmotic coef. = 0.9135 True ionic strength = .2344933E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1271E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.29971E-07 -7.5233 0.24932E-07 -7.6032 0.83188E+00 -0.0799 2 H2O 0.99998E+00 0.0000 0.99998E+00 0.0000 3 Cl- 0.14028E-02 -2.8530 0.11590E-02 -2.9359 0.82623E+00 -0.0829 4 SO4-- 0.99943E-03 -3.0002 0.49753E-03 -3.3032 0.49782E+00 -0.3029 5 HCO3- 0.14679E-01 -1.8333 0.12148E-01 -1.9155 0.82760E+00 -0.0822 6 HS- 0.39507E-02 -2.4033 0.32648E-02 -2.4861 0.82636E+00 -0.0828 7 Al+++ 0.15552E-19 -19.8082 0.32611E-20 -20.4866 0.20969E+00 -0.6784 8 H4SiO4 0.10246E-02 -2.9894 0.10246E-02 -2.9894 0.10000E+01 0.0000 9 Ca++ 0.15088E-06 -6.8214 0.74485E-07 -7.1279 0.49368E+00 -0.3066 10 Mg++ 0.73291E-10 -10.1350 0.35995E-10 -10.4438 0.49112E+00 -0.3088 11 Fe++ 0.13763E-13 -13.8613 0.67675E-14 -14.1696 0.49173E+00 -0.3083 12 K+ 0.15550E-03 -3.8083 0.12872E-03 -3.8903 0.82781E+00 -0.0821 13 Na+ 0.22208E-01 -1.6535 0.18345E-01 -1.7365 0.82605E+00 -0.0830 14 Mn++ 0.21755E-08 -8.6624 0.10708E-08 -8.9703 0.49219E+00 -0.3079 15 F- 0.85009E-04 -4.0705 0.70074E-04 -4.1544 0.82431E+00 -0.0839 16 HPO4-- 0.36224E-07 -7.4410 0.18036E-07 -7.7439 0.49790E+00 -0.3029 18 HSiO3- 0.46443E-04 -4.3331 0.38373E-04 -4.4160 0.82623E+00 -0.0829 19 Ca(HSiO3)+ 0.78611E-10 -10.1045 0.65091E-10 -10.1865 0.82802E+00 -0.0820 20 Mg(HSiO3)+ 0.47278E-13 -13.3253 0.39147E-13 -13.4073 0.82802E+00 -0.0820 21 NaHSiO3,aq 0.11385E-04 -4.9437 0.11385E-04 -4.9437 0.10000E+01 0.0000 22 AlO+ 0.86191E-12 -12.0645 0.71367E-12 -12.1465 0.82802E+00 -0.0820 23 AlOH+2 0.17981E-15 -15.7452 0.88601E-16 -16.0526 0.49274E+00 -0.3074 24 HAlO2,aq 0.57004E-08 -8.2441 0.57004E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.61380E-06 -6.2120 0.50610E-06 -6.2958 0.82454E+00 -0.0838 26 CH4,aq 0.77985E-07 -7.1080 0.77431E-07 -7.1111 0.99289E+00 -0.0031 27 C2H6,aq 0.21270E-16 -16.6722 0.21119E-16 -16.6753 0.99289E+00 -0.0031 31 CO,aq 0.78907E-12 -12.1029 0.78907E-12 -12.1029 0.10000E+01 0.0000 32 CO2,aq 0.65182E-03 -3.1859 0.64719E-03 -3.1890 0.99289E+00 -0.0031 33 CO3-2 0.85695E-04 -4.0670 0.42558E-04 -4.3710 0.49663E+00 -0.3040 34 CaCO3,aq 0.39748E-07 -7.4007 0.39748E-07 -7.4007 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.27895E-07 -7.5545 0.23097E-07 -7.6364 0.82802E+00 -0.0820 36 CaCl+ 0.16873E-09 -9.7728 0.13971E-09 -9.8548 0.82802E+00 -0.0820 37 CaCl2,aq 0.38471E-13 -13.4149 0.38471E-13 -13.4149 0.10000E+01 0.0000 38 CaF+ 0.92032E-10 -10.0361 0.76204E-10 -10.1180 0.82802E+00 -0.0820 39 CaOH+ 0.25714E-09 -9.5898 0.21291E-09 -9.6718 0.82802E+00 -0.0820 40 CaSO4,aq 0.11768E-07 -7.9293 0.11768E-07 -7.9293 0.10000E+01 0.0000 41 HCl,aq 0.52954E-11 -11.2761 0.52954E-11 -11.2761 0.10000E+01 0.0000 45 HF,aq 0.11960E-07 -7.9223 0.11960E-07 -7.9223 0.10000E+01 0.0000 46 HF2- 0.34247E-12 -12.4654 0.28296E-12 -12.5483 0.82623E+00 -0.0829 48 FeCl+ 0.14994E-16 -16.8241 0.12415E-16 -16.9060 0.82802E+00 -0.0820 51 FeF+ 0.29267E-16 -16.5336 0.24233E-16 -16.6156 0.82802E+00 -0.0820 53 FeO,aq 0.42311E-15 -15.3735 0.42311E-15 -15.3735 0.10000E+01 0.0000 54 FeOH+ 0.10670E-13 -13.9718 0.88353E-14 -14.0538 0.82802E+00 -0.0820 55 HFeO2- 0.21491E-15 -15.6678 0.17756E-15 -15.7507 0.82623E+00 -0.0829 56 FeO+ 0.11553E-18 -18.9373 0.95659E-19 -19.0193 0.82802E+00 -0.0820 58 FeO2- 0.38110E-16 -16.4190 0.31488E-16 -16.5019 0.82623E+00 -0.0829 59 HFeO2,aq 0.99848E-16 -16.0007 0.99848E-16 -16.0007 0.10000E+01 0.0000 60 H2,aq 0.48881E-07 -7.3109 0.48534E-07 -7.3140 0.99289E+00 -0.0031 61 KCl,aq 0.27040E-08 -8.5680 0.27040E-08 -8.5680 0.10000E+01 0.0000 62 KHSO4,aq 0.45147E-14 -14.3454 0.45147E-14 -14.3454 0.10000E+01 0.0000 63 KOH,aq 0.22048E-08 -8.6566 0.22048E-08 -8.6566 0.10000E+01 0.0000 64 KSO4- 0.12028E-05 -5.9198 0.99381E-06 -6.0027 0.82623E+00 -0.0829 65 MgCO3,aq 0.48146E-11 -11.3174 0.48146E-11 -11.3174 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13774E-10 -10.8609 0.11405E-10 -10.9429 0.82802E+00 -0.0820 67 MgCl+ 0.73902E-13 -13.1313 0.61192E-13 -13.2133 0.82802E+00 -0.0820 68 MgF+ 0.16475E-12 -12.7832 0.13641E-12 -12.8651 0.82802E+00 -0.0820 69 MgOH+ 0.68760E-12 -12.1627 0.56934E-12 -12.2446 0.82802E+00 -0.0820 71 MnF+ 0.15263E-11 -11.8164 0.12638E-11 -11.8983 0.82802E+00 -0.0820 72 MnO,aq 0.17838E-11 -11.7486 0.17838E-11 -11.7486 0.10000E+01 0.0000 73 MnOH+ 0.15684E-09 -9.8045 0.12987E-09 -9.8865 0.82802E+00 -0.0820 74 MnO2-2 0.19176E-18 -18.7172 0.95234E-19 -19.0212 0.49663E+00 -0.3040 75 HMnO2- 0.62960E-15 -15.2009 0.52020E-15 -15.2838 0.82623E+00 -0.0829 78 MnCl+ 0.92298E-11 -11.0348 0.76424E-11 -11.1168 0.82802E+00 -0.0820 79 MnSO4,aq 0.15380E-09 -9.8130 0.15380E-09 -9.8130 0.10000E+01 0.0000 80 NaCl,aq 0.70465E-05 -5.1520 0.70465E-05 -5.1520 0.10000E+01 0.0000 81 NaF,aq 0.30096E-06 -6.5215 0.30096E-06 -6.5215 0.10000E+01 0.0000 82 NaOH,aq 0.31613E-06 -6.5001 0.31613E-06 -6.5001 0.10000E+01 0.0000 84 OH- 0.28104E-04 -4.5512 0.23173E-04 -4.6350 0.82454E+00 -0.0838 89 HPO3-2 0.54929E-17 -17.2602 0.27279E-17 -17.5642 0.49663E+00 -0.3040 91 H2PO3- 0.16507E-18 -18.7823 0.13639E-18 -18.8652 0.82623E+00 -0.0829 92 H3PO4,aq 0.78413E-13 -13.1056 0.78413E-13 -13.1056 0.10000E+01 0.0000 93 H2PO4- 0.10029E-07 -7.9987 0.82954E-08 -8.0812 0.82711E+00 -0.0824 94 PO4-3 0.26627E-11 -11.5747 0.59021E-12 -12.2290 0.22166E+00 -0.6543 97 H2P2O7-2 0.10865E-16 -16.9640 0.53958E-17 -17.2679 0.49663E+00 -0.3040 98 HP2O7-3 0.20584E-15 -15.6865 0.43213E-16 -16.3644 0.20994E+00 -0.6779 99 P2O7-4 0.63553E-17 -17.1969 0.41406E-18 -18.3829 0.65152E-01 -1.1861 100 H2S,aq 0.25337E-03 -3.5962 0.25157E-03 -3.5993 0.99289E+00 -0.0031 101 S2-2 0.97985E-08 -8.0088 0.48662E-08 -8.3128 0.49663E+00 -0.3040 102 S3-2 0.68428E-10 -10.1648 0.33983E-10 -10.4687 0.49663E+00 -0.3040 103 S3- 0.31202E-11 -11.5058 0.25780E-11 -11.5887 0.82623E+00 -0.0829 104 S4-2 0.31566E-12 -12.5008 0.15677E-12 -12.8048 0.49663E+00 -0.3040 105 S5-2 0.97098E-15 -15.0128 0.48221E-15 -15.3168 0.49663E+00 -0.3040 106 SO2,aq 0.67038E-16 -16.1737 0.67038E-16 -16.1737 0.10000E+01 0.0000 107 SO3-2 0.62168E-11 -11.2064 0.31380E-11 -11.5034 0.50475E+00 -0.2969 108 HSO3- 0.59289E-11 -11.2270 0.48986E-11 -11.3099 0.82623E+00 -0.0829 109 HSO4- 0.14422E-07 -7.8410 0.11955E-07 -7.9225 0.82893E+00 -0.0815 111 S2O3-2 0.29606E-08 -8.5286 0.14703E-08 -8.8326 0.49663E+00 -0.3040 112 HS2O3- 0.79332E-14 -14.1006 0.65546E-14 -14.1835 0.82623E+00 -0.0829 Charge balance for all species = -.6111E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2997108E-07 0.7307957E-03 0.7352492E+00 0.0000 2 H2O 0.1000000E+01 0.5550757E+02 0.9981540E+06 0.0000 3 Cl- 0.1402806E-02 0.1409855E-02 0.4989204E+02 4.6673 4 SO4-- 0.9994256E-03 0.1000570E-02 0.9594032E+02 11.9033 5 HCO3- 0.1467872E-01 0.1541639E-01 0.9389420E+03 5.6877 6 HS- 0.3950743E-02 0.4204224E-02 0.1387874E+03 5.1171 7 Al+++ 0.1555192E-19 0.6194970E-06 0.1668434E-01 2.3231 8 H4SiO4 0.1024592E-02 0.1082420E-02 0.1038467E+03 -2.9894 9 Ca++ 0.1508777E-06 0.2308844E-06 0.9236438E-02 8.0785 10 Mg++ 0.7329070E-10 0.9285295E-10 0.2253306E-05 4.7627 11 Fe++ 0.1376251E-13 0.2525328E-13 0.1407737E-08 1.0369 12 K+ 0.1554970E-03 0.1567047E-03 0.6116246E+01 3.7129 13 Na+ 0.2220814E-01 0.2222719E-01 0.5100627E+03 5.8668 14 Mn++ 0.2175518E-08 0.2498697E-08 0.1370220E-03 6.2362 15 F- 0.8500893E-04 0.8532195E-04 0.1617978E+01 3.4488 16 HPO4-- 0.3622415E-07 0.4625621E-07 0.4431493E-02 7.4626 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6459832E-03 0.6586262E-03 -.1264295E-04 0.0000000E+00 2 H2O 0.5000359E+02 0.5002594E+02 -.2234448E-01 0.0000000E+00 3 Cl- 0.1270625E-02 0.1270625E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9017672E-03 0.9017590E-03 0.8148062E-08 0.0000000E+00 5 HCO3- 0.1389395E-01 0.1389395E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3789094E-02 0.3789037E-02 0.5703643E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5583187E-06 0.4217033E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9755263E-03 0.1117749E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.2275940E-13 0.3259225E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7689600E-04 0.7689600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.6353E-21 Mass of aqueous solution: 0.902899E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1919900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2109E-05 -5.676 0.5443E-03 -3.264 0.8102E-01 0.2094E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5820E-03 0.7802E-06 quartz 0.1117E-01 -1.952 0.6713 -0.173 99.92 0.2535 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity kaolinite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.671839 g Volume = 0.253719 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1919900 moles log = -0.7167 Original solution: 1000.0103000 g Original solution / Rock added: 5208.66 (Water/Rock Ratio), log = 3.7167 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0973 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9308E+00 0.9849 0.1006E+01 0.1021E+01 CO2,gas 0.6271E-01 1.0063 0.6924E-01 0.6881E-01 CH4,gas 0.1026E-03 1.0120 0.1140E-03 0.1126E-03 H2,gas 0.5804E-04 1.0006 0.6372E-04 0.6368E-04 H2S,gas 0.6330E-02 0.9957 0.6916E-02 0.6945E-02 S2,gas 0.4030E-15 1.0000 0.4421E-15 0.4421E-15 CO,gas 0.1072E-08 1.0000 0.1176E-08 0.1176E-08 SO3,gas 0.1066E-33 1.0000 0.1169E-33 0.1169E-33 SO2,gas 0.2642E-15 1.0000 0.2899E-15 0.2899E-15 HF,gas 0.2676E-10 1.0000 0.2937E-10 0.2937E-10 HCl,gas 0.8516E-14 1.0000 0.9344E-14 0.9344E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 101 kaolinite -1.33 -1.33 0.00 0.000 -0.64453E-11 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -9.52 -2.86 -0.953 0.48810E+04 -1.160 3 CH4,gas 4.54 -1.10 -5.64 -1.411 0.96338E+04 -3.943 4 H2,gas 8.00 2.11 -5.89 -3.368 0.10065E+05 -4.196 5 H2S,gas -6.23 -10.09 -3.86 -1.930 0.65894E+04 -2.160 6 S2,gas -7.34 -24.39 -17.05 -2.624 0.29118E+05 -15.354 7 CO,gas 3.21 -7.41 -10.63 -3.270 0.18148E+05 -8.930 8 SO3,gas 17.12 -18.51 -35.63 -8.908 0.60839E+05 -33.932 9 SO2,gas 0.83 -16.40 -17.24 -4.596 0.29431E+05 -15.538 10 HF,gas 0.47 -11.76 -12.23 -6.116 0.20884E+05 -10.532 11 HCl,gas 5.19 -10.54 -15.73 -7.864 0.26856E+05 -14.029 16 albite-high 0.69 -0.78 -1.47 -0.113 0.25126E+04 17 albite -0.38 -0.78 -0.39 -0.030 0.67382E+03 21 analcite 3.32 2.21 -1.11 -0.123 0.18969E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57112E+04 38 aragonite 0.97 -1.44 -2.41 -0.802 0.41094E+04 40 calcite 0.81 -1.44 -2.25 -0.751 0.38452E+04 41 carnegieite-low 9.02 5.20 -3.82 -0.546 0.65275E+04 42 carnegieite-high 10.09 5.20 -4.89 -0.699 0.83545E+04 55 chloritoid-Mn 11.40 7.89 -3.51 -0.234 0.59902E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63808E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -2.93 -4.62 -0.385 0.78847E+04 68 diaspore 2.87 2.32 -0.55 -0.092 0.94021E+03 69 diamond -3.10 -5.31 -2.21 -0.630 0.37670E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.31 -1.76 -0.504 0.30093E+04 94 heulandite -5.83 -8.20 -2.37 -0.108 0.40539E+04 98 jadeite 4.22 2.21 -2.00 -0.200 0.34224E+04 100 kalsilite 7.58 3.05 -4.54 -0.648 0.77475E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54971E+04 104 laumontite 2.88 0.77 -2.12 -0.141 0.36139E+04 105 lawsonite 9.62 6.75 -2.87 -0.191 0.49010E+04 106 leucite 4.12 0.06 -4.06 -0.406 0.69354E+04 119 microcline -2.49 -2.93 -0.45 -0.034 0.76130E+03 123 muscovite 2.58 1.71 -0.87 -0.051 0.14833E+04 124 paragonite 4.24 3.87 -0.37 -0.022 0.63487E+03 125 nepheline 8.34 5.20 -3.14 -0.448 0.53599E+04 146 pyrrhotite -4.26 -9.05 -4.79 -1.597 0.81825E+04 147 pyrrhotiteFe0.875 -6.02 -9.44 -3.43 -1.260 0.58501E+04 148 pyroxmangite 7.40 3.25 -4.15 -0.830 0.70893E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -3.28 -2.31 -0.769 0.39378E+04 155 rhodonite 7.45 3.25 -4.20 -0.840 0.71696E+04 156 sanidine -1.28 -2.93 -1.66 -0.127 0.28291E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61552E+04 166 stilbite -7.52 -8.20 -0.68 -0.032 0.11600E+04 172 sulfur -9.15 -12.19 -3.04 -0.936 0.51943E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50572E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -9.05 -4.64 -1.547 0.79253E+04 190 wairakite 3.95 0.77 -3.18 -0.187 0.54359E+04 196 beidellite-Ca -1.65 -4.23 -2.58 -0.160 0.44052E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.33 -2.81 -0.172 0.48032E+04 199 beidellite-Mg -1.79 -4.77 -2.98 -0.185 0.50932E+04 200 beidellite-Na -1.34 -3.62 -2.28 -0.140 0.38935E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.376 0.51407E+04 204 montmorillonite-Ca -2.29 -5.17 -2.88 -0.178 0.49224E+04 205 montmorillonite-K -2.24 -5.28 -3.04 -0.186 0.51985E+04 206 montmorillonite-Mg -2.48 -5.72 -3.24 -0.200 0.55336E+04 207 montmorillonite-Na -2.04 -4.57 -2.53 -0.155 0.43246E+04 234 alabandite -0.98 -3.85 -2.88 -0.958 0.49096E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35571E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 0.73 -1.29 -0.099 0.22051E+04 248 an25ab75 2.65 1.10 -1.54 -0.119 0.26348E+04 249 an30ab70 3.28 1.48 -1.80 -0.138 0.30742E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1919900 MOLES New total amount of reactant added: 0.1959900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1959900 Water: Moles liquid = 0.5003E+02 kg liquid = 0.9013E+00 Moles total = 0.5001E+02 kg total = 0.9009E+00 Activity = 1.0000 Stoichiometric ionic strength = .2401230E-01 Osmotic coef. = 0.9131 True ionic strength = .2344528E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1294E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.43977E-07 -7.3568 0.36584E-07 -7.4367 0.83188E+00 -0.0799 2 H2O 0.99998E+00 0.0000 0.99998E+00 0.0000 3 Cl- 0.14288E-02 -2.8450 0.11805E-02 -2.9279 0.82623E+00 -0.0829 4 SO4-- 0.10205E-02 -2.9912 0.50805E-03 -3.2941 0.49784E+00 -0.3029 5 HCO3- 0.14718E-01 -1.8321 0.12181E-01 -1.9143 0.82760E+00 -0.0822 6 HS- 0.39214E-02 -2.4066 0.32405E-02 -2.4894 0.82637E+00 -0.0828 7 Al+++ 0.49128E-19 -19.3087 0.10303E-19 -19.9871 0.20971E+00 -0.6784 8 H4SiO4 0.10246E-02 -2.9895 0.10246E-02 -2.9895 0.10000E+01 0.0000 9 Ca++ 0.15940E-06 -6.7975 0.78696E-07 -7.1040 0.49370E+00 -0.3065 10 Mg++ 0.74665E-10 -10.1269 0.36671E-10 -10.4357 0.49114E+00 -0.3088 11 Fe++ 0.12602E-13 -13.8996 0.61970E-14 -14.2078 0.49175E+00 -0.3083 12 K+ 0.15546E-03 -3.8084 0.12869E-03 -3.8904 0.82782E+00 -0.0821 13 Na+ 0.22210E-01 -1.6534 0.18347E-01 -1.7364 0.82606E+00 -0.0830 14 Mn++ 0.22175E-08 -8.6541 0.10915E-08 -8.9620 0.49221E+00 -0.3078 15 F- 0.86766E-04 -4.0617 0.71522E-04 -4.1456 0.82431E+00 -0.0839 16 HPO4-- 0.32889E-07 -7.4829 0.16376E-07 -7.7858 0.49792E+00 -0.3028 18 HSiO3- 0.31651E-04 -4.4996 0.26151E-04 -4.5825 0.82623E+00 -0.0829 19 Ca(HSiO3)+ 0.56603E-10 -10.2472 0.46868E-10 -10.3291 0.82802E+00 -0.0820 20 Mg(HSiO3)+ 0.32826E-13 -13.4838 0.27180E-13 -13.5657 0.82802E+00 -0.0820 21 NaHSiO3,aq 0.77599E-05 -5.1101 0.77599E-05 -5.1101 0.10000E+01 0.0000 22 AlO+ 0.12647E-11 -11.8980 0.10472E-11 -11.9800 0.82802E+00 -0.0820 23 AlOH+2 0.38714E-15 -15.4121 0.19077E-15 -15.7195 0.49276E+00 -0.3074 24 HAlO2,aq 0.57004E-08 -8.2441 0.57004E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.41831E-06 -6.3785 0.34491E-06 -6.4623 0.82455E+00 -0.0838 26 CH4,aq 0.76015E-07 -7.1191 0.75469E-07 -7.1222 0.99282E+00 -0.0031 27 C2H6,aq 0.22399E-16 -16.6498 0.22238E-16 -16.6529 0.99282E+00 -0.0031 31 CO,aq 0.10474E-11 -11.9799 0.10474E-11 -11.9799 0.10000E+01 0.0000 32 CO2,aq 0.95911E-03 -3.0181 0.95222E-03 -3.0213 0.99282E+00 -0.0031 33 CO3-2 0.58558E-04 -4.2324 0.29082E-04 -4.5364 0.49665E+00 -0.3040 34 CaCO3,aq 0.28697E-07 -7.5422 0.28697E-07 -7.5422 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.29551E-07 -7.5294 0.24469E-07 -7.6114 0.82802E+00 -0.0820 36 CaCl+ 0.18157E-09 -9.7410 0.15034E-09 -9.8229 0.82802E+00 -0.0820 37 CaCl2,aq 0.42164E-13 -13.3751 0.42164E-13 -13.3751 0.10000E+01 0.0000 38 CaF+ 0.99245E-10 -10.0033 0.82177E-10 -10.0853 0.82802E+00 -0.0820 39 CaOH+ 0.18515E-09 -9.7325 0.15330E-09 -9.8144 0.82802E+00 -0.0820 40 CaSO4,aq 0.12696E-07 -7.8963 0.12696E-07 -7.8963 0.10000E+01 0.0000 41 HCl,aq 0.79138E-11 -11.1016 0.79138E-11 -11.1016 0.10000E+01 0.0000 45 HF,aq 0.17912E-07 -7.7468 0.17912E-07 -7.7468 0.10000E+01 0.0000 46 HF2- 0.52351E-12 -12.2811 0.43254E-12 -12.3640 0.82623E+00 -0.0829 48 FeCl+ 0.13984E-16 -16.8544 0.11579E-16 -16.9363 0.82802E+00 -0.0820 51 FeF+ 0.27354E-16 -16.5630 0.22649E-16 -16.6449 0.82802E+00 -0.0820 53 FeO,aq 0.17995E-15 -15.7448 0.17995E-15 -15.7448 0.10000E+01 0.0000 54 FeOH+ 0.66589E-14 -14.1766 0.55137E-14 -14.2586 0.82802E+00 -0.0820 55 HFeO2- 0.62289E-16 -16.2056 0.51465E-16 -16.2885 0.82623E+00 -0.0829 56 FeO+ 0.75904E-19 -19.1197 0.62850E-19 -19.2017 0.82802E+00 -0.0820 58 FeO2- 0.11629E-16 -16.9344 0.96086E-17 -17.0173 0.82623E+00 -0.0829 59 HFeO2,aq 0.44708E-16 -16.3496 0.44708E-16 -16.3496 0.10000E+01 0.0000 60 H2,aq 0.44102E-07 -7.3555 0.43785E-07 -7.3587 0.99282E+00 -0.0031 61 KCl,aq 0.27534E-08 -8.5601 0.27534E-08 -8.5601 0.10000E+01 0.0000 62 KHSO4,aq 0.67630E-14 -14.1699 0.67630E-14 -14.1699 0.10000E+01 0.0000 63 KOH,aq 0.15022E-08 -8.8233 0.15022E-08 -8.8233 0.10000E+01 0.0000 64 KSO4- 0.12280E-05 -5.9108 0.10146E-05 -5.9937 0.82623E+00 -0.0829 65 MgCO3,aq 0.33519E-11 -11.4747 0.33519E-11 -11.4747 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14071E-10 -10.8517 0.11651E-10 -10.9336 0.82802E+00 -0.0820 67 MgCl+ 0.76684E-13 -13.1153 0.63495E-13 -13.1973 0.82802E+00 -0.0820 68 MgF+ 0.17131E-12 -12.7662 0.14185E-12 -12.8482 0.82802E+00 -0.0820 69 MgOH+ 0.47741E-12 -12.3211 0.39530E-12 -12.4031 0.82802E+00 -0.0820 71 MnF+ 0.15880E-11 -11.7992 0.13149E-11 -11.8811 0.82802E+00 -0.0820 72 MnO,aq 0.84452E-12 -12.0734 0.84452E-12 -12.0734 0.10000E+01 0.0000 73 MnOH+ 0.10895E-09 -9.9628 0.90214E-10 -10.0447 0.82802E+00 -0.0820 74 MnO2-2 0.42164E-19 -19.3751 0.20940E-19 -19.6790 0.49665E+00 -0.3040 75 HMnO2- 0.20314E-15 -15.6922 0.16784E-15 -15.7751 0.82623E+00 -0.0829 78 MnCl+ 0.95822E-11 -11.0185 0.79342E-11 -11.1005 0.82802E+00 -0.0820 79 MnSO4,aq 0.16009E-09 -9.7956 0.16009E-09 -9.7956 0.10000E+01 0.0000 80 NaCl,aq 0.71776E-05 -5.1440 0.71776E-05 -5.1440 0.10000E+01 0.0000 81 NaF,aq 0.30721E-06 -6.5126 0.30721E-06 -6.5126 0.10000E+01 0.0000 82 NaOH,aq 0.21546E-06 -6.6666 0.21546E-06 -6.6666 0.10000E+01 0.0000 84 OH- 0.19153E-04 -4.7178 0.15793E-04 -4.8015 0.82455E+00 -0.0838 89 HPO3-2 0.44993E-17 -17.3469 0.22346E-17 -17.6508 0.49665E+00 -0.3040 91 H2PO3- 0.19841E-18 -18.7024 0.16393E-18 -18.7853 0.82623E+00 -0.0829 92 H3PO4,aq 0.15329E-12 -12.8145 0.15329E-12 -12.8145 0.10000E+01 0.0000 93 H2PO4- 0.13362E-07 -7.8741 0.11052E-07 -7.9566 0.82712E+00 -0.0824 94 PO4-3 0.16475E-11 -11.7832 0.36522E-12 -12.4374 0.22168E+00 -0.6543 97 H2P2O7-2 0.19285E-16 -16.7148 0.95776E-17 -17.0187 0.49665E+00 -0.3040 98 HP2O7-3 0.24897E-15 -15.6038 0.52275E-16 -16.2817 0.20996E+00 -0.6779 99 P2O7-4 0.52385E-17 -17.2808 0.34136E-18 -18.4668 0.65164E-01 -1.1860 100 H2S,aq 0.36905E-03 -3.4329 0.36640E-03 -3.4360 0.99282E+00 -0.0031 101 S2-2 0.10700E-07 -7.9706 0.53142E-08 -8.2746 0.49665E+00 -0.3040 102 S3-2 0.12063E-09 -9.9185 0.59912E-10 -10.2225 0.49665E+00 -0.3040 103 S3- 0.84981E-11 -11.0707 0.70214E-11 -11.1536 0.82623E+00 -0.0829 104 S4-2 0.89840E-12 -12.0465 0.44618E-12 -12.3505 0.49665E+00 -0.3040 105 S5-2 0.44613E-14 -14.3505 0.22157E-14 -14.6545 0.49665E+00 -0.3040 106 SO2,aq 0.13297E-15 -15.8762 0.13297E-15 -15.8762 0.10000E+01 0.0000 107 SO3-2 0.57270E-11 -11.2421 0.28908E-11 -11.5390 0.50477E+00 -0.2969 108 HSO3- 0.80144E-11 -11.0961 0.66217E-11 -11.1790 0.82623E+00 -0.0829 109 HSO4- 0.21609E-07 -7.6654 0.17912E-07 -7.7469 0.82893E+00 -0.0815 111 S2O3-2 0.44030E-08 -8.3563 0.21867E-08 -8.6602 0.49665E+00 -0.3040 112 HS2O3- 0.17312E-13 -13.7616 0.14304E-13 -13.8445 0.82623E+00 -0.0829 Charge balance for all species = -.6111E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4397733E-07 0.1209190E-02 0.1216536E+01 0.0000 2 H2O 0.1000000E+01 0.5550727E+02 0.9981301E+06 0.0000 3 Cl- 0.1428758E-02 0.1435938E-02 0.5081414E+02 4.5088 4 SO4-- 0.1020507E-02 0.1021690E-02 0.9796359E+02 11.5793 5 HCO3- 0.1471835E-01 0.1573615E-01 0.9583995E+03 5.5224 6 HS- 0.3921417E-02 0.4290575E-02 0.1416354E+03 4.9473 7 Al+++ 0.4912836E-19 0.4240091E-06 0.1141923E-01 2.3231 8 H4SiO4 0.1024576E-02 0.1063987E-02 0.1020764E+03 -2.9895 9 Ca++ 0.1594009E-06 0.2308679E-06 0.9235606E-02 7.7694 10 Mg++ 0.7466526E-10 0.9284631E-10 0.2253103E-05 4.4377 11 Fe++ 0.1260181E-13 0.1960069E-13 0.1092614E-08 0.6656 12 K+ 0.1554613E-03 0.1566935E-03 0.6115695E+01 3.5463 13 Na+ 0.2221014E-01 0.2222560E-01 0.5100168E+03 5.7003 14 Mn++ 0.2217467E-08 0.2498519E-08 0.1370097E-03 5.9114 15 F- 0.8676582E-04 0.8709104E-04 0.1651494E+01 3.2911 16 HPO4-- 0.3288917E-07 0.4625290E-07 0.4431094E-02 7.0876 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1076683E-02 0.1089855E-02 -.1317142E-04 0.0000000E+00 2 H2O 0.5000687E+02 0.5002924E+02 -.2237713E-01 0.0000000E+00 3 Cl- 0.1294225E-02 0.1294225E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9208672E-03 0.9208590E-03 0.8148063E-08 0.0000000E+00 5 HCO3- 0.1418315E-01 0.1418315E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3867194E-02 0.3867137E-02 0.5703644E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3821635E-06 0.4393189E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9589820E-03 0.1119404E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1766629E-13 0.3259225E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.7849600E-04 0.7849600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8867E-21 Mass of aqueous solution: 0.902980E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1959900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2197E-05 -5.658 0.5671E-03 -3.246 0.8428E-01 0.2182E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5812E-03 0.7802E-06 quartz 0.1119E-01 -1.951 0.6723 -0.172 99.92 0.2539 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity kaolinite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.672845 g Volume = 0.254099 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1959900 moles log = -0.7078 Original solution: 1000.0103000 g Original solution / Rock added: 5102.35 (Water/Rock Ratio), log = 3.7078 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.1333 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9016E+00 0.9845 0.1006E+01 0.1022E+01 CO2,gas 0.8936E-01 1.0059 0.1019E+00 0.1013E+00 CH4,gas 0.9687E-04 1.0118 0.1111E-03 0.1098E-03 H2,gas 0.5069E-04 1.0006 0.5748E-04 0.5745E-04 H2S,gas 0.8926E-02 0.9956 0.1007E-01 0.1012E-01 S2,gas 0.1017E-14 1.0000 0.1152E-14 0.1152E-14 CO,gas 0.1377E-08 1.0000 0.1561E-08 0.1561E-08 SO3,gas 0.2269E-33 1.0000 0.2571E-33 0.2571E-33 SO2,gas 0.5074E-15 1.0000 0.5750E-15 0.5750E-15 HF,gas 0.3881E-10 1.0000 0.4398E-10 0.4398E-10 HCl,gas 0.1232E-13 1.0000 0.1396E-13 0.1396E-13 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 101 kaolinite -1.33 -1.33 0.00 0.000 0.56870E-11 145 pyrite -21.25 -21.25 0.00 0.000 -0.12132E-10 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28966E+04 0.003 2 CO2,gas -6.66 -9.35 -2.69 -0.897 0.45946E+04 -0.992 3 CH4,gas 4.54 -1.11 -5.65 -1.413 0.96529E+04 -3.954 4 H2,gas 8.00 2.06 -5.94 -3.394 0.10141E+05 -4.240 5 H2S,gas -6.23 -9.93 -3.70 -1.848 0.63106E+04 -1.997 6 S2,gas -7.34 -23.97 -16.64 -2.560 0.28408E+05 -14.938 7 CO,gas 3.21 -7.29 -10.51 -3.232 0.17938E+05 -8.807 8 SO3,gas 17.12 -18.17 -35.29 -8.822 0.60255E+05 -33.590 9 SO2,gas 0.83 -16.11 -16.94 -4.517 0.28923E+05 -15.240 10 HF,gas 0.47 -11.58 -12.06 -6.028 0.20585E+05 -10.357 11 HCl,gas 5.19 -10.36 -15.55 -7.777 0.26558E+05 -13.855 16 albite-high 0.69 -0.94 -1.64 -0.126 0.27969E+04 17 albite -0.38 -0.94 -0.56 -0.043 0.95809E+03 21 analcite 3.32 2.04 -1.28 -0.142 0.21812E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57112E+04 38 aragonite 0.97 -1.58 -2.55 -0.849 0.43509E+04 40 calcite 0.81 -1.58 -2.39 -0.798 0.40867E+04 41 carnegieite-low 9.02 5.03 -3.99 -0.570 0.68118E+04 55 chloritoid-Mn 11.40 7.57 -3.83 -0.256 0.65447E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63808E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -3.10 -4.78 -0.399 0.81692E+04 68 diaspore 2.87 2.32 -0.55 -0.092 0.94020E+03 69 diamond -3.10 -5.23 -2.13 -0.608 0.36334E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.23 -1.68 -0.481 0.28756E+04 94 heulandite -5.83 -8.51 -2.68 -0.122 0.45818E+04 98 jadeite 4.22 2.04 -2.17 -0.217 0.37066E+04 100 kalsilite 7.58 2.88 -4.70 -0.672 0.80320E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54971E+04 104 laumontite 2.88 0.46 -2.43 -0.162 0.41418E+04 105 lawsonite 9.62 6.44 -3.18 -0.212 0.54289E+04 106 leucite 4.12 -0.11 -4.23 -0.423 0.72199E+04 119 microcline -2.49 -3.10 -0.61 -0.047 0.10458E+04 123 muscovite 2.58 1.55 -1.04 -0.061 0.17678E+04 124 paragonite 4.24 3.70 -0.54 -0.032 0.91913E+03 125 nepheline 8.34 5.03 -3.31 -0.472 0.56442E+04 147 pyrrhotiteFe0.875 -6.02 -9.60 -3.58 -1.317 0.61166E+04 148 pyroxmangite 7.40 2.92 -4.48 -0.895 0.76438E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -3.44 -2.46 -0.821 0.42060E+04 155 rhodonite 7.45 2.92 -4.52 -0.905 0.77241E+04 156 sanidine -1.28 -3.10 -1.82 -0.140 0.31136E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61552E+04 166 stilbite -7.52 -8.51 -0.99 -0.047 0.16880E+04 172 sulfur -9.15 -11.99 -2.83 -0.872 0.48391E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50572E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 184 troilite-low -4.41 -9.26 -4.85 -1.617 0.82805E+04 190 wairakite 3.95 0.46 -3.49 -0.205 0.59638E+04 196 beidellite-Ca -1.65 -4.28 -2.63 -0.163 0.44923E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.39 -2.87 -0.176 0.48970E+04 199 beidellite-Mg -1.79 -4.83 -3.04 -0.188 0.51847E+04 200 beidellite-Na -1.34 -3.68 -2.34 -0.143 0.39873E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.376 0.51387E+04 204 montmorillonite-Ca -2.29 -5.33 -3.04 -0.188 0.51926E+04 205 montmorillonite-K -2.24 -5.44 -3.21 -0.196 0.54755E+04 206 montmorillonite-Mg -2.48 -5.88 -3.40 -0.210 0.58083E+04 207 montmorillonite-Na -2.04 -4.73 -2.69 -0.165 0.46015E+04 214 topaz -16.55 -21.51 -4.96 -0.551 0.84718E+04 234 alabandite -0.98 -4.01 -3.04 -1.012 0.51852E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35571E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 0.53 -1.49 -0.114 0.25381E+04 248 an25ab75 2.65 0.90 -1.75 -0.134 0.29800E+04 249 an30ab70 3.28 1.27 -2.01 -0.155 0.34316E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1959900 MOLES New total amount of reactant added: 0.1999900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.1999900 Water: Moles liquid = 0.5003E+02 kg liquid = 0.9014E+00 Moles total = 0.5001E+02 kg total = 0.9009E+00 Activity = 1.0000 Stoichiometric ionic strength = .2427035E-01 Osmotic coef. = 0.9128 True ionic strength = .2345182E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1318E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.58927E-07 -7.2297 0.49019E-07 -7.3096 0.83186E+00 -0.0799 2 H2O 0.99997E+00 0.0000 0.99997E+00 0.0000 3 Cl- 0.14547E-02 -2.8372 0.12019E-02 -2.9201 0.82621E+00 -0.0829 4 SO4-- 0.10416E-02 -2.9823 0.51850E-03 -3.2853 0.49780E+00 -0.3029 5 HCO3- 0.14726E-01 -1.8319 0.12187E-01 -1.9141 0.82758E+00 -0.0822 6 HS- 0.38867E-02 -2.4104 0.32117E-02 -2.4933 0.82635E+00 -0.0828 7 Al+++ 0.11821E-18 -18.9273 0.24785E-19 -19.6058 0.20967E+00 -0.6785 8 H4SiO4 0.10246E-02 -2.9895 0.10246E-02 -2.9895 0.10000E+01 0.0000 9 Ca++ 0.16441E-06 -6.7841 0.81163E-07 -7.0906 0.49366E+00 -0.3066 10 Mg++ 0.75446E-10 -10.1224 0.37052E-10 -10.4312 0.49110E+00 -0.3088 11 Fe++ 0.11838E-13 -13.9267 0.58208E-14 -14.2350 0.49171E+00 -0.3083 12 K+ 0.15543E-03 -3.8085 0.12866E-03 -3.8906 0.82780E+00 -0.0821 13 Na+ 0.22210E-01 -1.6534 0.18347E-01 -1.7364 0.82603E+00 -0.0830 14 Mn++ 0.22393E-08 -8.6499 0.11021E-08 -8.9578 0.49217E+00 -0.3079 15 F- 0.88522E-04 -4.0529 0.72968E-04 -4.1369 0.82429E+00 -0.0839 16 HPO4-- 0.29947E-07 -7.5236 0.14910E-07 -7.8265 0.49788E+00 -0.3029 18 HSiO3- 0.23622E-04 -4.6267 0.19517E-04 -4.7096 0.82621E+00 -0.0829 19 Ca(HSiO3)+ 0.43569E-10 -10.3608 0.36075E-10 -10.4428 0.82800E+00 -0.0820 20 Mg(HSiO3)+ 0.24753E-13 -13.6064 0.20495E-13 -13.6883 0.82800E+00 -0.0820 21 NaHSiO3,aq 0.57912E-05 -5.2372 0.57912E-05 -5.2372 0.10000E+01 0.0000 22 AlO+ 0.16947E-11 -11.7709 0.14032E-11 -11.8529 0.82800E+00 -0.0820 23 AlOH+2 0.69513E-15 -15.1579 0.34250E-15 -15.4653 0.49271E+00 -0.3074 24 HAlO2,aq 0.57004E-08 -8.2441 0.57004E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.31220E-06 -6.5056 0.25742E-06 -6.5894 0.82453E+00 -0.0838 26 CH4,aq 0.73863E-07 -7.1316 0.73327E-07 -7.1347 0.99275E+00 -0.0032 27 C2H6,aq 0.22919E-16 -16.6398 0.22753E-16 -16.6430 0.99275E+00 -0.0032 31 CO,aq 0.12956E-11 -11.8875 0.12956E-11 -11.8875 0.10000E+01 0.0000 32 CO2,aq 0.12859E-02 -2.8908 0.12765E-02 -2.8940 0.99275E+00 -0.0032 33 CO3-2 0.43728E-04 -4.3592 0.21716E-04 -4.6632 0.49660E+00 -0.3040 34 CaCO3,aq 0.22100E-07 -7.6556 0.22100E-07 -7.6556 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.30494E-07 -7.5158 0.25249E-07 -7.5978 0.82800E+00 -0.0820 36 CaCl+ 0.19066E-09 -9.7197 0.15787E-09 -9.8017 0.82800E+00 -0.0820 37 CaCl2,aq 0.45078E-13 -13.3460 0.45078E-13 -13.3460 0.10000E+01 0.0000 38 CaF+ 0.10443E-09 -9.9812 0.86466E-10 -10.0632 0.82800E+00 -0.0820 39 CaOH+ 0.14251E-09 -9.8461 0.11800E-09 -9.9281 0.82800E+00 -0.0820 40 CaSO4,aq 0.13363E-07 -7.8741 0.13363E-07 -7.8741 0.10000E+01 0.0000 41 HCl,aq 0.10796E-10 -10.9667 0.10796E-10 -10.9667 0.10000E+01 0.0000 45 HF,aq 0.24486E-07 -7.6111 0.24486E-07 -7.6111 0.10000E+01 0.0000 46 HF2- 0.73012E-12 -12.1366 0.60323E-12 -12.2195 0.82621E+00 -0.0829 48 FeCl+ 0.13374E-16 -16.8737 0.11073E-16 -16.9557 0.82800E+00 -0.0820 51 FeF+ 0.26213E-16 -16.5815 0.21704E-16 -16.6635 0.82800E+00 -0.0820 53 FeO,aq 0.94145E-16 -16.0262 0.94145E-16 -16.0262 0.10000E+01 0.0000 54 FeOH+ 0.46680E-14 -14.3309 0.38651E-14 -14.4128 0.82800E+00 -0.0820 55 HFeO2- 0.24321E-16 -16.6140 0.20094E-16 -16.6969 0.82621E+00 -0.0829 56 FeO+ 0.55395E-19 -19.2565 0.45867E-19 -19.3385 0.82800E+00 -0.0820 58 FeO2- 0.47273E-17 -17.3254 0.39057E-17 -17.4083 0.82621E+00 -0.0829 59 HFeO2,aq 0.24350E-16 -16.6135 0.24350E-16 -16.6135 0.10000E+01 0.0000 60 H2,aq 0.40695E-07 -7.3905 0.40399E-07 -7.3936 0.99275E+00 -0.0032 61 KCl,aq 0.28027E-08 -8.5524 0.28027E-08 -8.5524 0.10000E+01 0.0000 62 KHSO4,aq 0.92458E-14 -14.0341 0.92458E-14 -14.0341 0.10000E+01 0.0000 63 KOH,aq 0.11209E-08 -8.9505 0.11209E-08 -8.9505 0.10000E+01 0.0000 64 KSO4- 0.12529E-05 -5.9021 0.10352E-05 -5.9850 0.82621E+00 -0.0829 65 MgCO3,aq 0.25288E-11 -11.5971 0.25288E-11 -11.5971 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14224E-10 -10.8470 0.11778E-10 -10.9289 0.82800E+00 -0.0820 67 MgCl+ 0.78886E-13 -13.1030 0.65317E-13 -13.1850 0.82800E+00 -0.0820 68 MgF+ 0.17659E-12 -12.7530 0.14622E-12 -12.8350 0.82800E+00 -0.0820 69 MgOH+ 0.36000E-12 -12.4437 0.29808E-12 -12.5257 0.82800E+00 -0.0820 71 MnF+ 0.16359E-11 -11.7862 0.13545E-11 -11.8682 0.82800E+00 -0.0820 72 MnO,aq 0.47497E-12 -12.3233 0.47497E-12 -12.3233 0.10000E+01 0.0000 73 MnOH+ 0.82107E-10 -10.0856 0.67985E-10 -10.1676 0.82800E+00 -0.0820 74 MnO2-2 0.13209E-19 -19.8791 0.65598E-20 -20.1831 0.49660E+00 -0.3040 75 HMnO2- 0.85267E-16 -16.0692 0.70448E-16 -16.1521 0.82621E+00 -0.0829 78 MnCl+ 0.98514E-11 -11.0065 0.81570E-11 -11.0885 0.82800E+00 -0.0820 79 MnSO4,aq 0.16497E-09 -9.7826 0.16497E-09 -9.7826 0.10000E+01 0.0000 80 NaCl,aq 0.73076E-05 -5.1362 0.73076E-05 -5.1362 0.10000E+01 0.0000 81 NaF,aq 0.31341E-06 -6.5039 0.31341E-06 -6.5039 0.10000E+01 0.0000 82 NaOH,aq 0.16080E-06 -6.7937 0.16080E-06 -6.7937 0.10000E+01 0.0000 84 OH- 0.14295E-04 -4.8448 0.11786E-04 -4.9286 0.82453E+00 -0.0838 89 HPO3-2 0.37801E-17 -17.4225 0.18772E-17 -17.7265 0.49660E+00 -0.3040 91 H2PO3- 0.22334E-18 -18.6510 0.18453E-18 -18.7339 0.82621E+00 -0.0829 92 H3PO4,aq 0.25057E-12 -12.6011 0.25057E-12 -12.6011 0.10000E+01 0.0000 93 H2PO4- 0.16301E-07 -7.7878 0.13483E-07 -7.8702 0.82709E+00 -0.0824 94 PO4-3 0.11197E-11 -11.9509 0.24816E-12 -12.6053 0.22164E+00 -0.6544 97 H2P2O7-2 0.28703E-16 -16.5421 0.14254E-16 -16.8461 0.49660E+00 -0.3040 98 HP2O7-3 0.27659E-15 -15.5582 0.58063E-16 -16.2361 0.20992E+00 -0.6779 99 P2O7-4 0.43438E-17 -17.3621 0.28297E-18 -18.5483 0.65143E-01 -1.1861 100 H2S,aq 0.49013E-03 -3.3097 0.48658E-03 -3.3128 0.99275E+00 -0.0032 101 S2-2 0.11393E-07 -7.9434 0.56576E-08 -8.2474 0.49660E+00 -0.3040 102 S3-2 0.18487E-09 -9.7331 0.91805E-10 -10.0371 0.49660E+00 -0.3040 103 S3- 0.18165E-10 -10.7408 0.15008E-10 -10.8237 0.82621E+00 -0.0829 104 S4-2 0.19816E-11 -11.7030 0.98405E-12 -12.0070 0.49660E+00 -0.3040 105 S5-2 0.14163E-13 -13.8488 0.70334E-14 -14.1528 0.49660E+00 -0.3040 106 SO2,aq 0.22480E-15 -15.6482 0.22480E-15 -15.6482 0.10000E+01 0.0000 107 SO3-2 0.53933E-11 -11.2681 0.27221E-11 -11.5651 0.50473E+00 -0.2969 108 HSO3- 0.10112E-10 -10.9951 0.83549E-11 -11.0781 0.82621E+00 -0.0829 109 HSO4- 0.29550E-07 -7.5294 0.24494E-07 -7.6109 0.82891E+00 -0.0815 111 S2O3-2 0.59680E-08 -8.2242 0.29637E-08 -8.5282 0.49660E+00 -0.3040 112 HS2O3- 0.31440E-13 -13.5025 0.25976E-13 -13.5854 0.82621E+00 -0.0829 113 H2S2O3,aq 0.20413E-19 -19.6901 0.20413E-19 -19.6901 0.10000E+01 0.0000 Charge balance for all species = -.6110E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5892731E-07 0.1687248E-02 0.1697466E+01 0.0000 2 H2O 0.1000000E+01 0.5550695E+02 0.9981053E+06 0.0000 3 Cl- 0.1454707E-02 0.1462018E-02 0.5173604E+02 4.3895 4 SO4-- 0.1041586E-02 0.1042807E-02 0.9998644E+02 11.3340 5 HCO3- 0.1472614E-01 0.1605587E-01 0.9778531E+03 5.3955 6 HS- 0.3886669E-02 0.4376914E-02 0.1444827E+03 4.8164 7 Al+++ 0.1182089E-18 0.3179020E-06 0.8561441E-02 2.3231 8 H4SiO4 0.1024560E-02 0.1053973E-02 0.1011137E+03 -2.9895 9 Ca++ 0.1644131E-06 0.2308514E-06 0.9234769E-02 7.5286 10 Mg++ 0.7544625E-10 0.9283966E-10 0.2252899E-05 4.1881 11 Fe++ 0.1183784E-13 0.1669307E-13 0.9305155E-09 0.3842 12 K+ 0.1554255E-03 0.1566823E-03 0.6115141E+01 3.4191 13 Na+ 0.2221044E-01 0.2222401E-01 0.5099706E+03 5.5732 14 Mn++ 0.2239298E-08 0.2498340E-08 0.1369972E-03 5.6615 15 F- 0.8852186E-04 0.8885987E-04 0.1685005E+01 3.1728 16 HPO4-- 0.2994697E-07 0.4624959E-07 0.4430693E-02 6.7927 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1507383E-02 0.1520842E-02 -.1345826E-04 0.0000000E+00 2 H2O 0.5001014E+02 0.5003254E+02 -.2239480E-01 0.0000000E+00 3 Cl- 0.1317825E-02 0.1317825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9399672E-03 0.9399590E-03 0.8148064E-08 0.0000000E+00 5 HCO3- 0.1447235E-01 0.1447235E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.3945294E-02 0.3945237E-02 0.5703645E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2865487E-06 0.4488803E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9500243E-03 0.1120300E-01 0.0000000E+00 9 Ca++ 0.2080835E-06 0.2080835E-06 0.0000000E+00 0.0000000E+00 10 Mg++ 0.8368328E-10 0.8368328E-10 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3259227E-07 0.1504671E-13 0.3259225E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.8009600E-04 0.8009600E-04 0.0000000E+00 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.9264E-21 Mass of aqueous solution: 0.903062E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2244E-05 -5.649 0.5794E-03 -3.237 0.8604E-01 0.2229E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5807E-03 0.7802E-06 quartz 0.1120E-01 -1.951 0.6728 -0.172 99.91 0.2541 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity kaolinite 0.1000E+01 0.1000E+01 1.0000 0.000 pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.673390 g Volume = 0.254305 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.1999900 moles log = -0.6990 Original solution: 1000.0103000 g Original solution / Rock added: 5000.30 (Water/Rock Ratio), log = 3.6990 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.1717 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8725E+00 0.9840 0.1006E+01 0.1022E+01 CO2,gas 0.1159E+00 1.0056 0.1366E+00 0.1358E+00 CH4,gas 0.9107E-04 1.0116 0.1079E-03 0.1067E-03 H2,gas 0.4524E-04 1.0006 0.5304E-04 0.5301E-04 H2S,gas 0.1147E-01 0.9955 0.1338E-01 0.1344E-01 S2,gas 0.2037E-14 1.0000 0.2387E-14 0.2387E-14 CO,gas 0.1648E-08 1.0000 0.1931E-08 0.1931E-08 SO3,gas 0.4021E-33 1.0000 0.4711E-33 0.4711E-33 SO2,gas 0.8297E-15 1.0000 0.9721E-15 0.9721E-15 HF,gas 0.5131E-10 1.0000 0.6012E-10 0.6012E-10 HCl,gas 0.1626E-13 1.0000 0.1905E-13 0.1905E-13 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 101 kaolinite -1.33 -1.33 0.00 0.000 0.56870E-11 145 pyrite -21.25 -21.25 0.00 0.000 0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28966E+04 0.003 2 CO2,gas -6.66 -9.22 -2.56 -0.855 0.43773E+04 -0.865 3 CH4,gas 4.54 -1.12 -5.67 -1.416 0.96742E+04 -3.967 4 H2,gas 8.00 2.03 -5.97 -3.414 0.10201E+05 -4.275 5 H2S,gas -6.23 -9.80 -3.57 -1.786 0.61002E+04 -1.874 6 S2,gas -7.34 -23.66 -16.32 -2.511 0.27868E+05 -14.622 7 CO,gas 3.21 -7.20 -10.41 -3.204 0.17780E+05 -8.714 8 SO3,gas 17.12 -17.90 -35.03 -8.756 0.59806E+05 -33.327 9 SO2,gas 0.83 -15.88 -16.71 -4.456 0.28534E+05 -15.012 10 HF,gas 0.47 -11.45 -11.92 -5.960 0.20353E+05 -10.221 11 HCl,gas 5.19 -10.23 -15.42 -7.710 0.26328E+05 -13.720 16 albite-high 0.69 -1.07 -1.77 -0.136 0.30139E+04 17 albite -0.38 -1.07 -0.69 -0.053 0.11751E+04 21 analcite 3.32 1.92 -1.40 -0.156 0.23981E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57112E+04 38 aragonite 0.97 -1.70 -2.66 -0.887 0.45447E+04 40 calcite 0.81 -1.70 -2.51 -0.836 0.42804E+04 41 carnegieite-low 9.02 4.91 -4.12 -0.588 0.70288E+04 55 chloritoid-Mn 11.40 7.32 -4.08 -0.272 0.69715E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63808E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 66 cymrite-K 1.69 -3.23 -4.91 -0.409 0.83864E+04 68 diaspore 2.87 2.32 -0.55 -0.092 0.94020E+03 69 diamond -3.10 -5.17 -2.07 -0.592 0.35354E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.17 -1.63 -0.465 0.27776E+04 94 heulandite -5.83 -8.75 -2.92 -0.133 0.49929E+04 98 jadeite 4.22 1.92 -2.30 -0.230 0.39236E+04 100 kalsilite 7.58 2.75 -4.83 -0.690 0.82492E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54971E+04 104 laumontite 2.88 0.22 -2.67 -0.178 0.45529E+04 105 lawsonite 9.62 6.20 -3.42 -0.228 0.58400E+04 106 leucite 4.12 -0.24 -4.36 -0.436 0.74371E+04 119 microcline -2.49 -3.23 -0.74 -0.057 0.12630E+04 123 muscovite 2.58 1.42 -1.16 -0.068 0.19849E+04 124 paragonite 4.24 3.57 -0.67 -0.039 0.11361E+04 125 nepheline 8.34 4.91 -3.43 -0.490 0.58611E+04 147 pyrrhotiteFe0.875 -6.02 -9.72 -3.70 -1.361 0.63191E+04 148 pyroxmangite 7.40 2.67 -4.73 -0.945 0.80706E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -3.56 -2.59 -0.862 0.44154E+04 155 rhodonite 7.45 2.67 -4.77 -0.955 0.81509E+04 156 sanidine -1.28 -3.23 -1.95 -0.150 0.33307E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61551E+04 166 stilbite -7.52 -8.75 -1.23 -0.059 0.20991E+04 172 sulfur -9.15 -11.83 -2.68 -0.823 0.45691E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50572E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 190 wairakite 3.95 0.22 -3.73 -0.220 0.63748E+04 196 beidellite-Ca -1.65 -4.32 -2.67 -0.165 0.45601E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.43 -2.91 -0.178 0.49687E+04 199 beidellite-Mg -1.79 -4.87 -3.08 -0.190 0.52551E+04 200 beidellite-Na -1.34 -3.72 -2.38 -0.146 0.40589E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.376 0.51383E+04 204 montmorillonite-Ca -2.29 -5.45 -3.16 -0.196 0.54011E+04 205 montmorillonite-K -2.24 -5.57 -3.33 -0.204 0.56879E+04 206 montmorillonite-Mg -2.48 -6.01 -3.53 -0.218 0.60193E+04 207 montmorillonite-Na -2.04 -4.86 -2.82 -0.173 0.48138E+04 214 topaz -16.55 -21.24 -4.69 -0.521 0.80081E+04 234 alabandite -0.98 -4.14 -3.16 -1.055 0.54016E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35571E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 0.38 -1.64 -0.126 0.27939E+04 248 an25ab75 2.65 0.74 -1.90 -0.146 0.32455E+04 249 an30ab70 3.28 1.11 -2.17 -0.167 0.37068E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0040000 MOLES Current total amount of reactant added: 0.1999900 MOLES New total amount of reactant added: 0.2039900 MOLES Mixing fraction reached given limit of 0.2000E+00 TOTMIX = 0.2040E+00 Execution stopped.