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. 0.15074E-02 0.58927E-07 0.8319 0.00000000E+00 H2O 2 0. 0.50010E+02 0.10000E+01 1.0000 0.00000000E+00 Cl- 3 -1. 0.13178E-02 0.14547E-02 0.8262 0.00000000E+00 SO4-- 4 -2. 0.93997E-03 0.10416E-02 0.4978 0.00000000E+00 HCO3- 5 -1. 0.14472E-01 0.14726E-01 0.8276 0.00000000E+00 HS- 6 -1. 0.39453E-02 0.38867E-02 0.8263 0.00000000E+00 Al+++ 7 3. 0.47754E-05 0.11821E-18 0.2097 0.00000000E+00 H4SiO4 8 0. 0.12153E-01 0.10246E-02 1.0000 0.00000000E+00 Ca++ 9 2. 0.20808E-06 0.16441E-06 0.4937 0.00000000E+00 Mg++ 10 2. 0.83683E-10 0.75446E-10 0.4911 0.00000000E+00 Fe++ 11 2. 0.32592E-07 0.11838E-13 0.4917 0.00000000E+00 K+ 12 1. 0.14123E-03 0.15543E-03 0.8278 0.00000000E+00 Na+ 13 1. 0.20032E-01 0.22210E-01 0.8260 0.00000000E+00 Mn++ 14 2. 0.22519E-08 0.22393E-08 0.4922 0.00000000E+00 F- 15 -1. 0.80096E-04 0.88522E-04 0.8243 0.00000000E+00 HPO4-- 16 -2. 0.41688E-07 0.29947E-07 0.4979 0.00000000E+00 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1318E-06 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 50.0000 SLIM = 0.400000E+00 TEMP = 100.0000 SINC = 0.1000E-01 TEMPC = 0.0000 TOTMIX = 0.199990E+00 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 0.0000E+00 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 0.3259E-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 0.1120E-01 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 0.2244E-05 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: 0.1999900 moles log = -0.6990 Original solution: 1000.0103000 g Original solution / Rock added: 5000.30 (Water/Rock Ratio), log = 3.6990 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 = 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: 0.0100000 MOLES Current total amount of reactant added: 0.1999900 MOLES New total amount of reactant added: 0.2099900 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 = 0.2099900 Water: Moles liquid = 0.5004E+02 kg liquid = 0.9015E+00 Moles total = 0.5002E+02 kg total = 0.9011E+00 Activity = 0.9999 Stoichiometric ionic strength = .2491597E-01 Osmotic coef. = 0.9119 True ionic strength = .2348499E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1377E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.98183E-07 -7.0080 0.81666E-07 -7.0880 0.83177E+00 -0.0800 2 H2O 0.99995E+00 0.0000 0.99995E+00 0.0000 3 Cl- 0.15196E-02 -2.8183 0.12553E-02 -2.9012 0.82611E+00 -0.0830 4 SO4-- 0.10943E-02 -2.9609 0.54450E-03 -3.2640 0.49760E+00 -0.3031 5 HCO3- 0.14691E-01 -1.8329 0.12157E-01 -1.9152 0.82748E+00 -0.0822 6 HS- 0.37952E-02 -2.4208 0.31358E-02 -2.5037 0.82625E+00 -0.0829 7 Al+++ 0.54712E-18 -18.2619 0.11461E-18 -18.9408 0.20948E+00 -0.6789 8 H4SiO4 0.10245E-02 -2.9895 0.10245E-02 -2.9895 0.10000E+01 0.0000 9 Ca++ 0.17056E-06 -6.7681 0.84161E-07 -7.0749 0.49345E+00 -0.3068 10 Mg++ 0.76418E-10 -10.1168 0.37513E-10 -10.4258 0.49089E+00 -0.3090 11 Fe++ 0.10738E-13 -13.9691 0.52775E-14 -14.2776 0.49150E+00 -0.3085 12 K+ 0.15534E-03 -3.8087 0.12857E-03 -3.8909 0.82770E+00 -0.0821 13 Na+ 0.22208E-01 -1.6535 0.18343E-01 -1.7365 0.82594E+00 -0.0831 14 Mn++ 0.22610E-08 -8.6457 0.11123E-08 -8.9538 0.49196E+00 -0.3081 15 F- 0.92909E-04 -4.0319 0.76575E-04 -4.1159 0.82419E+00 -0.0840 16 HPO4-- 0.24253E-07 -7.6152 0.12070E-07 -7.9183 0.49768E+00 -0.3031 18 HSiO3- 0.14180E-04 -4.8483 0.11715E-04 -4.9313 0.82611E+00 -0.0830 19 Ca(HSiO3)+ 0.27120E-10 -10.5667 0.22453E-10 -10.6487 0.82790E+00 -0.0820 20 Mg(HSiO3)+ 0.15044E-13 -13.8226 0.12455E-13 -13.9047 0.82790E+00 -0.0820 21 NaHSiO3,aq 0.34754E-05 -5.4590 0.34754E-05 -5.4590 0.10000E+01 0.0000 22 AlO+ 0.28237E-11 -11.5492 0.23378E-11 -11.6312 0.82790E+00 -0.0820 23 AlOH+2 0.19302E-14 -14.7144 0.95064E-15 -15.0220 0.49251E+00 -0.3076 24 HAlO2,aq 0.57005E-08 -8.2441 0.57005E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.18742E-06 -6.7272 0.15452E-06 -6.8110 0.82443E+00 -0.0838 26 CH4,aq 0.68513E-07 -7.1642 0.68003E-07 -7.1675 0.99256E+00 -0.0032 27 C2H6,aq 0.22811E-16 -16.6419 0.22641E-16 -16.6451 0.99256E+00 -0.0032 31 CO,aq 0.18609E-11 -11.7303 0.18609E-11 -11.7303 0.10000E+01 0.0000 32 CO2,aq 0.21374E-02 -2.6701 0.21215E-02 -2.6734 0.99256E+00 -0.0032 33 CO3-2 0.26193E-04 -4.5818 0.13002E-04 -4.8860 0.49640E+00 -0.3042 34 CaCO3,aq 0.13721E-07 -7.8626 0.13721E-07 -7.8626 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31545E-07 -7.5011 0.26116E-07 -7.5831 0.82790E+00 -0.0820 36 CaCl+ 0.20652E-09 -9.6850 0.17097E-09 -9.7671 0.82790E+00 -0.0820 37 CaCl2,aq 0.50991E-13 -13.2925 0.50991E-13 -13.2925 0.10000E+01 0.0000 38 CaF+ 0.11365E-09 -9.9444 0.94092E-10 -10.0264 0.82790E+00 -0.0820 39 CaOH+ 0.88710E-10 -10.0520 0.73443E-10 -10.1340 0.82790E+00 -0.0820 40 CaSO4,aq 0.14552E-07 -7.8371 0.14552E-07 -7.8371 0.10000E+01 0.0000 41 HCl,aq 0.18786E-10 -10.7262 0.18786E-10 -10.7262 0.10000E+01 0.0000 45 HF,aq 0.42810E-07 -7.3685 0.42810E-07 -7.3685 0.10000E+01 0.0000 46 HF2- 0.13398E-11 -11.8730 0.11068E-11 -11.9559 0.82611E+00 -0.0830 48 FeCl+ 0.12666E-16 -16.8974 0.10486E-16 -16.9794 0.82790E+00 -0.0820 51 FeF+ 0.24944E-16 -16.6030 0.20651E-16 -16.6850 0.82790E+00 -0.0820 53 FeO,aq 0.30754E-16 -16.5121 0.30754E-16 -16.5121 0.10000E+01 0.0000 54 FeOH+ 0.25407E-14 -14.5950 0.21035E-14 -14.6771 0.82790E+00 -0.0820 55 HFeO2- 0.47693E-17 -17.3215 0.39400E-17 -17.4045 0.82611E+00 -0.0830 56 FeO+ 0.32431E-19 -19.4890 0.26850E-19 -19.5711 0.82790E+00 -0.0820 58 FeO2- 0.99713E-18 -18.0012 0.82374E-18 -18.0842 0.82611E+00 -0.0830 59 HFeO2,aq 0.85559E-17 -17.0677 0.85559E-17 -17.0677 0.10000E+01 0.0000 60 H2,aq 0.35179E-07 -7.4537 0.34917E-07 -7.4570 0.99256E+00 -0.0032 61 KCl,aq 0.29252E-08 -8.5338 0.29252E-08 -8.5338 0.10000E+01 0.0000 62 KHSO4,aq 0.16165E-13 -13.7914 0.16165E-13 -13.7914 0.10000E+01 0.0000 63 KOH,aq 0.67231E-09 -9.1724 0.67231E-09 -9.1724 0.10000E+01 0.0000 64 KSO4- 0.13150E-05 -5.8811 0.10863E-05 -5.9640 0.82611E+00 -0.0830 65 MgCO3,aq 0.15330E-11 -11.8145 0.15330E-11 -11.8145 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14367E-10 -10.8426 0.11895E-10 -10.9246 0.82790E+00 -0.0820 67 MgCl+ 0.83429E-13 -13.0787 0.69071E-13 -13.1607 0.82790E+00 -0.0820 68 MgF+ 0.18765E-12 -12.7266 0.15536E-12 -12.8087 0.82790E+00 -0.0820 69 MgOH+ 0.21880E-12 -12.6600 0.18114E-12 -12.7420 0.82790E+00 -0.0820 71 MnF+ 0.17329E-11 -11.7612 0.14347E-11 -11.8432 0.82790E+00 -0.0820 72 MnO,aq 0.17271E-12 -12.7627 0.17271E-12 -12.7627 0.10000E+01 0.0000 73 MnOH+ 0.49746E-10 -10.3032 0.41185E-10 -10.3853 0.82790E+00 -0.0820 75 HMnO2- 0.18613E-16 -16.7302 0.15376E-16 -16.8132 0.82611E+00 -0.0830 78 MnCl+ 0.10386E-10 -10.9836 0.85986E-11 -11.0656 0.82790E+00 -0.0820 79 MnSO4,aq 0.17485E-09 -9.7573 0.17485E-09 -9.7573 0.10000E+01 0.0000 80 NaCl,aq 0.76309E-05 -5.1174 0.76309E-05 -5.1174 0.10000E+01 0.0000 81 NaF,aq 0.32884E-06 -6.4830 0.32884E-06 -6.4830 0.10000E+01 0.0000 82 NaOH,aq 0.96498E-07 -7.0155 0.96498E-07 -7.0155 0.10000E+01 0.0000 84 OH- 0.85811E-05 -5.0665 0.70745E-05 -5.1503 0.82443E+00 -0.0838 89 HPO3-2 0.26459E-17 -17.5774 0.13134E-17 -17.8816 0.49640E+00 -0.3042 91 H2PO3- 0.26037E-18 -18.5844 0.21509E-18 -18.6674 0.82611E+00 -0.0830 92 H3PO4,aq 0.56300E-12 -12.2495 0.56300E-12 -12.2495 0.10000E+01 0.0000 93 H2PO4- 0.21987E-07 -7.6578 0.18184E-07 -7.7403 0.82700E+00 -0.0825 94 PO4-3 0.54453E-12 -12.2640 0.12059E-12 -12.9187 0.22145E+00 -0.6547 97 H2P2O7-2 0.52230E-16 -16.2821 0.25927E-16 -16.5862 0.49640E+00 -0.3042 98 HP2O7-3 0.30226E-15 -15.5196 0.63393E-16 -16.1980 0.20973E+00 -0.6783 99 P2O7-4 0.28512E-17 -17.5450 0.18544E-18 -18.7318 0.65042E-01 -1.1868 100 H2S,aq 0.79739E-03 -3.0983 0.79146E-03 -3.1016 0.99256E+00 -0.0032 101 S2-2 0.12571E-07 -7.9006 0.62400E-08 -8.2048 0.49640E+00 -0.3042 102 S3-2 0.38388E-09 -9.4158 0.19056E-09 -9.7200 0.49640E+00 -0.3042 103 S3- 0.67576E-10 -10.1702 0.55825E-10 -10.2532 0.82611E+00 -0.0830 104 S4-2 0.77440E-11 -11.1110 0.38441E-11 -11.4152 0.49640E+00 -0.3042 105 S5-2 0.10417E-12 -12.9823 0.51708E-13 -13.2864 0.49640E+00 -0.3042 106 SO2,aq 0.56634E-15 -15.2469 0.56634E-15 -15.2469 0.10000E+01 0.0000 107 SO3-2 0.48972E-11 -11.3101 0.24708E-11 -11.6072 0.50453E+00 -0.2971 108 HSO3- 0.15293E-10 -10.8155 0.12634E-10 -10.8985 0.82611E+00 -0.0830 109 HSO4- 0.51705E-07 -7.2865 0.42854E-07 -7.3680 0.82882E+00 -0.0815 111 S2O3-2 0.10199E-07 -7.9915 0.50626E-08 -8.2956 0.49640E+00 -0.3042 112 HS2O3- 0.89484E-13 -13.0483 0.73924E-13 -13.1312 0.82611E+00 -0.0830 113 H2S2O3,aq 0.96781E-19 -19.0142 0.96781E-19 -19.0142 0.10000E+01 0.0000 Charge balance for all species = -.6109E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9818278E-07 0.2881670E-02 0.2898983E+01 0.0000 2 H2O 0.1000000E+01 0.5550610E+02 0.9980422E+06 0.0000 3 Cl- 0.1519566E-02 0.1527200E-02 0.5404002E+02 4.1867 4 SO4-- 0.1094267E-02 0.1095585E-02 0.1050419E+03 10.9119 5 HCO3- 0.1469128E-01 0.1685496E-01 0.1026471E+04 5.1728 6 HS- 0.3795200E-02 0.4592704E-02 0.1515987E+03 4.5843 7 Al+++ 0.5471154E-18 0.1931246E-06 0.5200803E-02 2.3231 8 H4SiO4 0.1024517E-02 0.1042173E-02 0.9997684E+02 -2.9895 9 Ca++ 0.1705559E-06 0.2308100E-06 0.9232671E-02 7.1010 10 Mg++ 0.7641775E-10 0.9282302E-10 0.2252387E-05 3.7501 11 Fe++ 0.1073754E-13 0.1336098E-13 0.7447401E-09 -0.1016 12 K+ 0.1553356E-03 0.1566542E-03 0.6113751E+01 3.1971 13 Na+ 0.2220849E-01 0.2222003E-01 0.5098547E+03 5.3514 14 Mn++ 0.2261002E-08 0.2497892E-08 0.1369661E-03 5.2222 15 F- 0.9290905E-04 0.9328082E-04 0.1768752E+01 2.9720 16 HPO4-- 0.2425276E-07 0.4624130E-07 0.4429686E-02 6.2576 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2584133E-02 0.2597929E-02 -.1379558E-04 0.0000000E+00 2 H2O 0.5001833E+02 0.5004074E+02 -.2241546E-01 0.0000000E+00 3 Cl- 0.1376825E-02 0.1376825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9877172E-03 0.9877090E-03 0.8148064E-08 0.0000000E+00 5 HCO3- 0.1519535E-01 0.1519535E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.4140544E-02 0.4140487E-02 0.5703645E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1741088E-06 0.4601243E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9395562E-03 0.1121346E-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 0.1204540E-13 0.3259226E-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- 0.8409600E-04 0.8409600E-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: 0.5162E-21 Mass of aqueous solution: 0.903267E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2099900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2301E-05 -5.638 0.5939E-03 -3.226 0.8812E-01 0.2285E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5802E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6734 -0.172 99.91 0.2543 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 = 0.674026 g Volume = 0.254545 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: 0.2099900 moles log = -0.6778 Original solution: 1000.0103000 g Original solution / Rock added: 4762.18 (Water/Rock Ratio), log = 3.6778 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.2713 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8050E+00 0.9829 0.1006E+01 0.1023E+01 CO2,gas 0.1777E+00 1.0047 0.2270E+00 0.2259E+00 CH4,gas 0.7788E-04 1.0110 0.1001E-03 0.9900E-04 H2,gas 0.3603E-04 1.0007 0.4584E-04 0.4581E-04 H2S,gas 0.1720E-01 0.9951 0.2176E-01 0.2186E-01 S2,gas 0.6651E-14 1.0000 0.8455E-14 0.8455E-14 CO,gas 0.2181E-08 1.0000 0.2773E-08 0.2773E-08 SO3,gas 0.1080E-32 1.0000 0.1373E-32 0.1373E-32 SO2,gas 0.1926E-14 1.0000 0.2449E-14 0.2449E-14 HF,gas 0.8268E-10 1.0000 0.1051E-09 0.1051E-09 HCl,gas 0.2607E-13 1.0000 0.3315E-13 0.3315E-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 0.00000E+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 0.28966E+04 0.003 2 CO2,gas -6.66 -9.00 -2.34 -0.781 0.40006E+04 -0.644 3 CH4,gas 4.54 -1.15 -5.70 -1.425 0.97301E+04 -4.000 4 H2,gas 8.00 1.96 -6.04 -3.450 0.10309E+05 -4.339 5 H2S,gas -6.23 -9.59 -3.36 -1.681 0.57395E+04 -1.662 6 S2,gas -7.34 -23.11 -15.77 -2.426 0.26930E+05 -14.073 7 CO,gas 3.21 -7.04 -10.26 -3.156 0.17512E+05 -8.557 8 SO3,gas 17.12 -17.44 -34.56 -8.640 0.59012E+05 -32.862 9 SO2,gas 0.83 -15.48 -16.31 -4.349 0.27849E+05 -14.611 10 HF,gas 0.47 -11.20 -11.68 -5.839 0.19939E+05 -9.978 11 HCl,gas 5.19 -9.99 -15.18 -7.589 0.25917E+05 -13.480 16 albite-high 0.69 -1.29 -1.99 -0.153 0.33925E+04 17 albite -0.38 -1.29 -0.91 -0.070 0.15537E+04 21 analcite 3.32 1.70 -1.63 -0.181 0.27768E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57112E+04 38 aragonite 0.97 -1.90 -2.87 -0.956 0.48981E+04 40 calcite 0.81 -1.90 -2.71 -0.905 0.46339E+04 41 carnegieite-low 9.02 4.69 -4.34 -0.620 0.74074E+04 55 chloritoid-Mn 11.40 6.88 -4.52 -0.301 0.77216E+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 68 diaspore 2.87 2.32 -0.55 -0.092 0.94019E+03 69 diamond -3.10 -5.08 -1.98 -0.565 0.33750E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.08 -1.53 -0.438 0.26172E+04 94 heulandite -5.83 -9.18 -3.35 -0.152 0.57231E+04 98 jadeite 4.22 1.70 -2.52 -0.252 0.43023E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54971E+04 104 laumontite 2.88 -0.21 -3.09 -0.206 0.52831E+04 105 lawsonite 9.62 5.77 -3.85 -0.257 0.65701E+04 106 leucite 4.12 -0.46 -4.58 -0.458 0.78161E+04 119 microcline -2.49 -3.45 -0.96 -0.074 0.16420E+04 123 muscovite 2.58 1.20 -1.38 -0.081 0.23639E+04 124 paragonite 4.24 3.35 -0.89 -0.052 0.15147E+04 125 nepheline 8.34 4.69 -3.65 -0.522 0.62398E+04 147 pyrrhotiteFe0.875 -6.02 -9.92 -3.91 -1.437 0.66709E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -3.78 -2.80 -0.935 0.47889E+04 156 sanidine -1.28 -3.45 -2.17 -0.167 0.37097E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61551E+04 166 stilbite -7.52 -9.18 -1.66 -0.079 0.28293E+04 172 sulfur -9.15 -11.55 -2.40 -0.739 0.41002E+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 -0.21 -4.16 -0.245 0.71050E+04 196 beidellite-Ca -1.65 -4.39 -2.74 -0.170 0.46806E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.50 -2.98 -0.183 0.50938E+04 199 beidellite-Mg -1.79 -4.94 -3.15 -0.195 0.53784E+04 200 beidellite-Na -1.34 -3.79 -2.45 -0.150 0.41838E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.376 0.51403E+04 204 montmorillonite-Ca -2.29 -5.67 -3.38 -0.209 0.57684E+04 205 montmorillonite-K -2.24 -5.79 -3.55 -0.217 0.60597E+04 206 montmorillonite-Mg -2.48 -6.22 -3.74 -0.231 0.63895E+04 207 montmorillonite-Na -2.04 -5.07 -3.04 -0.186 0.51855E+04 214 topaz -16.55 -20.75 -4.20 -0.467 0.71795E+04 234 alabandite -0.98 -4.37 -3.39 -1.131 0.57910E+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 0.12 -1.90 -0.146 0.32428E+04 248 an25ab75 2.65 0.47 -2.17 -0.167 0.37120E+04 249 an30ab70 3.28 0.82 -2.45 -0.189 0.41909E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2099900 MOLES New total amount of reactant added: 0.2199900 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 = 0.2199900 Water: Moles liquid = 0.5005E+02 kg liquid = 0.9017E+00 Moles total = 0.5003E+02 kg total = 0.9012E+00 Activity = 0.9999 Stoichiometric ionic strength = .2556170E-01 Osmotic coef. = 0.9110 True ionic strength = .2352658E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1436E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.13895E-06 -6.8572 0.11556E-06 -6.9372 0.83166E+00 -0.0801 2 H2O 0.99993E+00 0.0000 0.99993E+00 0.0000 3 Cl- 0.15844E-02 -2.8001 0.13087E-02 -2.8832 0.82599E+00 -0.0830 4 SO4-- 0.11469E-02 -2.9405 0.57042E-03 -3.2438 0.49734E+00 -0.3033 5 HCO3- 0.14624E-01 -1.8349 0.12100E-01 -1.9172 0.82736E+00 -0.0823 6 HS- 0.37064E-02 -2.4311 0.30619E-02 -2.5140 0.82613E+00 -0.0830 7 Al+++ 0.15519E-17 -17.8091 0.32472E-18 -18.4885 0.20924E+00 -0.6793 8 H4SiO4 0.10245E-02 -2.9895 0.10245E-02 -2.9895 0.10000E+01 0.0000 9 Ca++ 0.17320E-06 -6.7614 0.85423E-07 -7.0684 0.49320E+00 -0.3070 10 Mg++ 0.76888E-10 -10.1141 0.37724E-10 -10.4234 0.49064E+00 -0.3092 11 Fe++ 0.10151E-13 -13.9935 0.49865E-14 -14.3022 0.49125E+00 -0.3087 12 K+ 0.15525E-03 -3.8090 0.12848E-03 -3.8912 0.82758E+00 -0.0822 13 Na+ 0.22205E-01 -1.6535 0.18337E-01 -1.7367 0.82582E+00 -0.0831 14 Mn++ 0.22660E-08 -8.6447 0.11142E-08 -8.9530 0.49171E+00 -0.3083 15 F- 0.97292E-04 -4.0119 0.80176E-04 -4.0960 0.82407E+00 -0.0840 16 HPO4-- 0.20256E-07 -7.6934 0.10076E-07 -7.9967 0.49742E+00 -0.3033 18 HSiO3- 0.10023E-04 -4.9990 0.82788E-05 -5.0820 0.82599E+00 -0.0830 19 Ca(HSiO3)+ 0.19456E-10 -10.7109 0.16106E-10 -10.7930 0.82778E+00 -0.0821 20 Mg(HSiO3)+ 0.10693E-13 -13.9709 0.88516E-14 -14.0530 0.82778E+00 -0.0821 21 NaHSiO3,aq 0.24553E-05 -5.6099 0.24553E-05 -5.6099 0.10000E+01 0.0000 22 AlO+ 0.39962E-11 -11.3983 0.33080E-11 -11.4804 0.82778E+00 -0.0821 23 AlOH+2 0.38668E-14 -14.4127 0.19034E-14 -14.7205 0.49225E+00 -0.3078 24 HAlO2,aq 0.57006E-08 -8.2441 0.57006E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.13247E-06 -6.8779 0.10920E-06 -6.9618 0.82431E+00 -0.0839 26 CH4,aq 0.63571E-07 -7.1967 0.63086E-07 -7.2001 0.99238E+00 -0.0033 27 C2H6,aq 0.21796E-16 -16.6616 0.21630E-16 -16.6650 0.99238E+00 -0.0033 31 CO,aq 0.23612E-11 -11.6269 0.23612E-11 -11.6269 0.10000E+01 0.0000 32 CO2,aq 0.30108E-02 -2.5213 0.29878E-02 -2.5246 0.99238E+00 -0.0033 33 CO3-2 0.18434E-04 -4.7344 0.91459E-05 -5.0388 0.49615E+00 -0.3044 34 CaCO3,aq 0.97963E-08 -8.0089 0.97963E-08 -8.0089 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31873E-07 -7.4966 0.26384E-07 -7.5787 0.82778E+00 -0.0821 36 CaCl+ 0.21856E-09 -9.6604 0.18092E-09 -9.7425 0.82778E+00 -0.0821 37 CaCl2,aq 0.56251E-13 -13.2499 0.56251E-13 -13.2499 0.10000E+01 0.0000 38 CaF+ 0.12080E-09 -9.9179 0.99994E-10 -10.0000 0.82778E+00 -0.0821 39 CaOH+ 0.63641E-10 -10.1963 0.52681E-10 -10.2783 0.82778E+00 -0.0821 40 CaSO4,aq 0.15473E-07 -7.8104 0.15473E-07 -7.8104 0.10000E+01 0.0000 41 HCl,aq 0.27712E-10 -10.5573 0.27712E-10 -10.5573 0.10000E+01 0.0000 45 HF,aq 0.63424E-07 -7.1977 0.63424E-07 -7.1977 0.10000E+01 0.0000 46 HF2- 0.20785E-11 -11.6822 0.17168E-11 -11.7653 0.82599E+00 -0.0830 48 FeCl+ 0.12478E-16 -16.9038 0.10329E-16 -16.9859 0.82778E+00 -0.0821 51 FeF+ 0.24681E-16 -16.6076 0.20430E-16 -16.6897 0.82778E+00 -0.0821 53 FeO,aq 0.14512E-16 -16.8383 0.14512E-16 -16.8383 0.10000E+01 0.0000 54 FeOH+ 0.16967E-14 -14.7704 0.14045E-14 -14.8525 0.82778E+00 -0.0821 55 HFeO2- 0.15907E-17 -17.7984 0.13139E-17 -17.8814 0.82599E+00 -0.0830 56 FeO+ 0.22819E-19 -19.6417 0.18889E-19 -19.7238 0.82778E+00 -0.0821 58 FeO2- 0.35040E-18 -18.4554 0.28943E-18 -18.5385 0.82599E+00 -0.0830 59 HFeO2,aq 0.42537E-17 -17.3712 0.42537E-17 -17.3712 0.10000E+01 0.0000 60 H2,aq 0.31698E-07 -7.4990 0.31456E-07 -7.5023 0.99238E+00 -0.0033 61 KCl,aq 0.30474E-08 -8.5161 0.30474E-08 -8.5161 0.10000E+01 0.0000 62 KHSO4,aq 0.23944E-13 -13.6208 0.23944E-13 -13.6208 0.10000E+01 0.0000 63 KOH,aq 0.47478E-09 -9.3235 0.47478E-09 -9.3235 0.10000E+01 0.0000 64 KSO4- 0.13768E-05 -5.8611 0.11372E-05 -5.9442 0.82599E+00 -0.0830 65 MgCO3,aq 0.10844E-11 -11.9648 0.10844E-11 -11.9648 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14382E-10 -10.8422 0.11906E-10 -10.9242 0.82778E+00 -0.0821 67 MgCl+ 0.87478E-13 -13.0581 0.72413E-13 -13.1402 0.82778E+00 -0.0821 68 MgF+ 0.19761E-12 -12.7042 0.16358E-12 -12.7863 0.82778E+00 -0.0821 69 MgOH+ 0.15552E-12 -12.8082 0.12874E-12 -12.8903 0.82778E+00 -0.0821 71 MnF+ 0.18177E-11 -11.7405 0.15047E-11 -11.8226 0.82778E+00 -0.0821 72 MnO,aq 0.86405E-13 -13.0635 0.86405E-13 -13.0635 0.10000E+01 0.0000 73 MnOH+ 0.35220E-10 -10.4532 0.29154E-10 -10.5353 0.82778E+00 -0.0821 75 HMnO2- 0.65814E-17 -17.1817 0.54362E-17 -17.2647 0.82599E+00 -0.0830 78 MnCl+ 0.10847E-10 -10.9647 0.89793E-11 -11.0468 0.82778E+00 -0.0821 79 MnSO4,aq 0.18348E-09 -9.7364 0.18348E-09 -9.7364 0.10000E+01 0.0000 80 NaCl,aq 0.79531E-05 -5.0995 0.79531E-05 -5.0995 0.10000E+01 0.0000 81 NaF,aq 0.34420E-06 -6.4632 0.34420E-06 -6.4632 0.10000E+01 0.0000 82 NaOH,aq 0.68175E-07 -7.1664 0.68175E-07 -7.1664 0.10000E+01 0.0000 84 OH- 0.60652E-05 -5.2172 0.49996E-05 -5.3011 0.82431E+00 -0.0839 89 HPO3-2 0.19909E-17 -17.7009 0.98779E-18 -18.0053 0.49615E+00 -0.3044 91 H2PO3- 0.27711E-18 -18.5573 0.22889E-18 -18.6404 0.82599E+00 -0.0830 92 H3PO4,aq 0.94101E-12 -12.0264 0.94101E-12 -12.0264 0.10000E+01 0.0000 93 H2PO4- 0.25976E-07 -7.5854 0.21479E-07 -7.6680 0.82688E+00 -0.0826 94 PO4-3 0.32159E-12 -12.4927 0.71141E-13 -13.1479 0.22122E+00 -0.6552 97 H2P2O7-2 0.72914E-16 -16.1372 0.36176E-16 -16.4416 0.49615E+00 -0.3044 98 HP2O7-3 0.29839E-15 -15.5252 0.62511E-16 -16.2040 0.20950E+00 -0.6788 99 P2O7-4 0.19908E-17 -17.7010 0.12923E-18 -18.8886 0.64915E-01 -1.1877 100 H2S,aq 0.11019E-02 -2.9578 0.10935E-02 -2.9612 0.99238E+00 -0.0033 101 S2-2 0.13311E-07 -7.8758 0.66042E-08 -8.1802 0.49615E+00 -0.3044 102 S3-2 0.62344E-09 -9.2052 0.30932E-09 -9.5096 0.49615E+00 -0.3044 103 S3- 0.16355E-09 -9.7863 0.13509E-09 -9.8694 0.82599E+00 -0.0830 104 S4-2 0.19288E-10 -10.7147 0.95699E-11 -11.0191 0.49615E+00 -0.3044 105 S5-2 0.39793E-12 -12.4002 0.19743E-12 -12.7046 0.49615E+00 -0.3044 106 SO2,aq 0.10702E-14 -14.9705 0.10702E-14 -14.9705 0.10000E+01 0.0000 107 SO3-2 0.46241E-11 -11.3350 0.23319E-11 -11.6323 0.50429E+00 -0.2973 108 HSO3- 0.20426E-10 -10.6898 0.16872E-10 -10.7728 0.82599E+00 -0.0830 109 HSO4- 0.76654E-07 -7.1155 0.63524E-07 -7.1971 0.82870E+00 -0.0816 111 S2O3-2 0.14770E-07 -7.8306 0.73279E-08 -8.1350 0.49615E+00 -0.3044 112 HS2O3- 0.18330E-12 -12.7368 0.15141E-12 -12.8199 0.82599E+00 -0.0830 113 H2S2O3,aq 0.28048E-18 -18.5521 0.28048E-18 -18.5521 0.10000E+01 0.0000 Charge balance for all species = -.6108E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1389467E-06 0.4075454E-02 0.4099741E+01 0.0000 2 H2O 0.1000000E+01 0.5550523E+02 0.9979785E+06 0.0000 3 Cl- 0.1584401E-02 0.1592358E-02 0.5634292E+02 4.0540 4 SO4-- 0.1146928E-02 0.1148344E-02 0.1100950E+03 10.6306 5 HCO3- 0.1462442E-01 0.1765375E-01 0.1075066E+04 5.0200 6 HS- 0.3706360E-02 0.4808416E-02 0.1587114E+03 4.4232 7 Al+++ 0.1551880E-17 0.1381790E-06 0.3720950E-02 2.3231 8 H4SiO4 0.1024473E-02 0.1036952E-02 0.9947117E+02 -2.9895 9 Ca++ 0.1732040E-06 0.2307686E-06 0.9230569E-02 6.8060 10 Mg++ 0.7688821E-10 0.9280636E-10 0.2251875E-05 3.4510 11 Fe++ 0.1015070E-13 0.1190533E-13 0.6635706E-09 -0.4278 12 K+ 0.1552458E-03 0.1566261E-03 0.6112360E+01 3.0460 13 Na+ 0.2220522E-01 0.2221604E-01 0.5097387E+03 5.2005 14 Mn++ 0.2265990E-08 0.2497444E-08 0.1369349E-03 4.9214 15 F- 0.9729240E-04 0.9770015E-04 0.1852460E+01 2.8412 16 HPO4-- 0.2025609E-07 0.4623300E-07 0.4428678E-02 5.8777 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3660883E-02 0.3674827E-02 -.1394412E-04 0.0000000E+00 2 H2O 0.5002651E+02 0.5004894E+02 -.2242441E-01 0.0000000E+00 3 Cl- 0.1435825E-02 0.1435825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1035467E-02 0.1035459E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.1591835E-01 0.1591835E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.4335794E-02 0.4335737E-02 0.5703645E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1245957E-06 0.4650756E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9350169E-03 0.1121800E-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 0.1073501E-13 0.3259226E-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- 0.8809600E-04 0.8809600E-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: -.4500E-21 Mass of aqueous solution: 0.903473E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2325E-05 -5.634 0.6003E-03 -3.222 0.8903E-01 0.2310E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5799E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6737 -0.172 99.91 0.2544 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 = 0.674302 g Volume = 0.254650 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: 0.2199900 moles log = -0.6576 Original solution: 1000.0103000 g Original solution / Rock added: 4545.71 (Water/Rock Ratio), log = 3.6576 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.3733 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7460E+00 0.9819 0.1006E+01 0.1024E+01 CO2,gas 0.2319E+00 1.0038 0.3197E+00 0.3184E+00 CH4,gas 0.6691E-04 1.0106 0.9286E-04 0.9189E-04 H2,gas 0.3005E-04 1.0007 0.4130E-04 0.4127E-04 H2S,gas 0.2201E-01 0.9947 0.3006E-01 0.3022E-01 S2,gas 0.1448E-13 1.0000 0.1989E-13 0.1989E-13 CO,gas 0.2562E-08 1.0000 0.3519E-08 0.3519E-08 SO3,gas 0.2097E-32 1.0000 0.2880E-32 0.2880E-32 SO2,gas 0.3370E-14 1.0000 0.4628E-14 0.4628E-14 HF,gas 0.1134E-09 1.0000 0.1557E-09 0.1557E-09 HCl,gas 0.3561E-13 1.0000 0.4890E-13 0.4890E-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 0.00000E+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 0.28966E+04 0.003 2 CO2,gas -6.66 -8.85 -2.19 -0.731 0.37467E+04 -0.495 3 CH4,gas 4.54 -1.19 -5.73 -1.433 0.97858E+04 -4.032 4 H2,gas 8.00 1.92 -6.08 -3.476 0.10387E+05 -4.384 5 H2S,gas -6.23 -9.45 -3.22 -1.610 0.54997E+04 -1.522 6 S2,gas -7.34 -22.74 -15.40 -2.369 0.26296E+05 -13.701 7 CO,gas 3.21 -6.94 -10.15 -3.124 0.17335E+05 -8.454 8 SO3,gas 17.12 -17.12 -34.24 -8.560 0.58463E+05 -32.541 9 SO2,gas 0.83 -15.20 -16.03 -4.276 0.27377E+05 -14.335 10 HF,gas 0.47 -11.03 -11.51 -5.753 0.19647E+05 -9.808 11 HCl,gas 5.19 -9.82 -15.01 -7.505 0.25629E+05 -13.311 16 albite-high 0.69 -1.44 -2.14 -0.164 0.36501E+04 17 albite -0.38 -1.44 -1.06 -0.082 0.18113E+04 21 analcite 3.32 1.54 -1.78 -0.197 0.30344E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57111E+04 25 anhydrite -5.32 -10.31 -5.00 -2.498 0.85296E+04 38 aragonite 0.97 -2.05 -3.01 -1.005 0.51480E+04 40 calcite 0.81 -2.05 -2.86 -0.953 0.48837E+04 41 carnegieite-low 9.02 4.53 -4.49 -0.641 0.76650E+04 55 chloritoid-Mn 11.40 6.58 -4.82 -0.322 0.82352E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63807E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94019E+03 69 diamond -3.10 -5.02 -1.92 -0.548 0.32758E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -5.02 -1.47 -0.421 0.25180E+04 94 heulandite -5.83 -9.47 -3.65 -0.166 0.62269E+04 98 jadeite 4.22 1.54 -2.67 -0.267 0.45599E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54970E+04 104 laumontite 2.88 -0.51 -3.39 -0.226 0.57869E+04 105 lawsonite 9.62 5.47 -4.14 -0.276 0.70739E+04 106 leucite 4.12 -0.61 -4.73 -0.473 0.80740E+04 119 microcline -2.49 -3.60 -1.11 -0.086 0.18999E+04 123 muscovite 2.58 1.05 -1.54 -0.090 0.26218E+04 124 paragonite 4.24 3.20 -1.04 -0.061 0.17723E+04 125 nepheline 8.34 4.53 -3.81 -0.544 0.64974E+04 147 pyrrhotiteFe0.875 -6.02 -10.06 -4.05 -1.488 0.69089E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19394E+04 154 rhodochrosite -0.98 -3.93 -2.96 -0.986 0.50485E+04 156 sanidine -1.28 -3.60 -2.32 -0.179 0.39677E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61551E+04 166 stilbite -7.52 -9.47 -1.95 -0.093 0.33331E+04 172 sulfur -9.15 -11.37 -2.22 -0.682 0.37831E+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 -0.51 -4.46 -0.262 0.76087E+04 196 beidellite-Ca -1.65 -4.44 -2.79 -0.173 0.47637E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.55 -3.03 -0.186 0.51789E+04 199 beidellite-Mg -1.79 -4.99 -3.20 -0.198 0.54627E+04 200 beidellite-Na -1.34 -3.84 -2.50 -0.153 0.42688E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.01 -0.377 0.51440E+04 204 montmorillonite-Ca -2.29 -5.82 -3.53 -0.218 0.60200E+04 205 montmorillonite-K -2.24 -5.93 -3.70 -0.226 0.63134E+04 206 montmorillonite-Mg -2.48 -6.37 -3.89 -0.241 0.66422E+04 207 montmorillonite-Na -2.04 -5.22 -3.19 -0.195 0.54390E+04 214 topaz -16.55 -20.41 -3.86 -0.429 0.65965E+04 234 alabandite -0.98 -4.53 -3.55 -1.184 0.60649E+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 -0.06 -2.08 -0.160 0.35496E+04 248 an25ab75 2.65 0.28 -2.36 -0.182 0.40312E+04 249 an30ab70 3.28 0.63 -2.65 -0.204 0.45223E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2199900 MOLES New total amount of reactant added: 0.2299900 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 = 0.2299900 Water: Moles liquid = 0.5006E+02 kg liquid = 0.9019E+00 Moles total = 0.5003E+02 kg total = 0.9014E+00 Activity = 0.9999 Stoichiometric ionic strength = .2620734E-01 Osmotic coef. = 0.9102 True ionic strength = .2357109E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1495E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18082E-06 -6.7428 0.15036E-06 -6.8229 0.83154E+00 -0.0801 2 H2O 0.99990E+00 0.0000 0.99990E+00 0.0000 3 Cl- 0.16492E-02 -2.7827 0.13620E-02 -2.8658 0.82587E+00 -0.0831 4 SO4-- 0.11996E-02 -2.9210 0.59628E-03 -3.2246 0.49708E+00 -0.3036 5 HCO3- 0.14542E-01 -1.8374 0.12030E-01 -1.9197 0.82724E+00 -0.0824 6 HS- 0.36225E-02 -2.4410 0.29922E-02 -2.5240 0.82600E+00 -0.0830 7 Al+++ 0.34229E-17 -17.4656 0.71535E-18 -18.1455 0.20899E+00 -0.6799 8 H4SiO4 0.10244E-02 -2.9895 0.10244E-02 -2.9895 0.10000E+01 0.0000 9 Ca++ 0.17455E-06 -6.7581 0.86041E-07 -7.0653 0.49292E+00 -0.3072 10 Mg++ 0.77183E-10 -10.1125 0.37848E-10 -10.4220 0.49036E+00 -0.3095 11 Fe++ 0.97912E-14 -14.0092 0.48072E-14 -14.3181 0.49097E+00 -0.3089 12 K+ 0.15516E-03 -3.8092 0.12839E-03 -3.8915 0.82746E+00 -0.0823 13 Na+ 0.22201E-01 -1.6536 0.18332E-01 -1.7368 0.82569E+00 -0.0832 14 Mn++ 0.22651E-08 -8.6449 0.11132E-08 -8.9534 0.49144E+00 -0.3085 15 F- 0.10167E-03 -3.9928 0.83772E-04 -4.0769 0.82394E+00 -0.0841 16 HPO4-- 0.17326E-07 -7.7613 0.86136E-08 -8.0648 0.49716E+00 -0.3035 18 HSiO3- 0.77040E-05 -5.1133 0.63625E-05 -5.1964 0.82587E+00 -0.0831 19 Ca(HSiO3)+ 0.15063E-10 -10.8221 0.12467E-10 -10.9042 0.82766E+00 -0.0821 20 Mg(HSiO3)+ 0.82462E-14 -14.0837 0.68250E-14 -14.1659 0.82766E+00 -0.0821 21 NaHSiO3,aq 0.18864E-05 -5.7244 0.18864E-05 -5.7244 0.10000E+01 0.0000 22 AlO+ 0.52006E-11 -11.2839 0.43044E-11 -11.3661 0.82766E+00 -0.0821 23 AlOH+2 0.65503E-14 -14.1837 0.32226E-14 -14.4918 0.49198E+00 -0.3081 24 HAlO2,aq 0.57006E-08 -8.2441 0.57006E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.10183E-06 -6.9921 0.83926E-07 -7.0761 0.82418E+00 -0.0840 26 CH4,aq 0.59097E-07 -7.2284 0.58635E-07 -7.2318 0.99219E+00 -0.0034 27 C2H6,aq 0.20455E-16 -16.6892 0.20296E-16 -16.6926 0.99219E+00 -0.0034 31 CO,aq 0.28123E-11 -11.5509 0.28123E-11 -11.5509 0.10000E+01 0.0000 32 CO2,aq 0.38957E-02 -2.4094 0.38653E-02 -2.4128 0.99219E+00 -0.0034 33 CO3-2 0.14093E-04 -4.8510 0.69886E-05 -5.1556 0.49588E+00 -0.3046 34 CaCO3,aq 0.75397E-08 -8.1226 0.75397E-08 -8.1226 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31923E-07 -7.4959 0.26421E-07 -7.5780 0.82766E+00 -0.0821 36 CaCl+ 0.22914E-09 -9.6399 0.18965E-09 -9.7220 0.82766E+00 -0.0821 37 CaCl2,aq 0.61369E-13 -13.2120 0.61369E-13 -13.2120 0.10000E+01 0.0000 38 CaF+ 0.12715E-09 -9.8957 0.10523E-09 -9.9778 0.82766E+00 -0.0821 39 CaOH+ 0.49271E-10 -10.3074 0.40780E-10 -10.3896 0.82766E+00 -0.0821 40 CaSO4,aq 0.16292E-07 -7.7880 0.16292E-07 -7.7880 0.10000E+01 0.0000 41 HCl,aq 0.37527E-10 -10.4257 0.37527E-10 -10.4257 0.10000E+01 0.0000 45 HF,aq 0.86226E-07 -7.0644 0.86226E-07 -7.0644 0.10000E+01 0.0000 46 HF2- 0.29530E-11 -11.5297 0.24388E-11 -11.6128 0.82587E+00 -0.0831 48 FeCl+ 0.12522E-16 -16.9023 0.10364E-16 -16.9845 0.82766E+00 -0.0821 51 FeF+ 0.24864E-16 -16.6044 0.20579E-16 -16.6866 0.82766E+00 -0.0821 53 FeO,aq 0.82637E-17 -17.0828 0.82637E-17 -17.0828 0.10000E+01 0.0000 54 FeOH+ 0.12573E-14 -14.9006 0.10406E-14 -14.9827 0.82766E+00 -0.0821 55 HFeO2- 0.69625E-18 -18.1572 0.57501E-18 -18.2403 0.82587E+00 -0.0831 56 FeO+ 0.17623E-19 -19.7539 0.14586E-19 -19.8361 0.82766E+00 -0.0821 58 FeO2- 0.15984E-18 -18.7963 0.13200E-18 -18.8794 0.82587E+00 -0.0831 59 HFeO2,aq 0.25243E-17 -17.5979 0.25243E-17 -17.5979 0.10000E+01 0.0000 60 H2,aq 0.29188E-07 -7.5348 0.28960E-07 -7.5382 0.99219E+00 -0.0034 61 KCl,aq 0.31693E-08 -8.4990 0.31693E-08 -8.4990 0.10000E+01 0.0000 62 KHSO4,aq 0.32544E-13 -13.4875 0.32544E-13 -13.4875 0.10000E+01 0.0000 63 KOH,aq 0.36462E-09 -9.4382 0.36462E-09 -9.4382 0.10000E+01 0.0000 64 KSO4- 0.14384E-05 -5.8421 0.11879E-05 -5.9252 0.82587E+00 -0.0831 65 MgCO3,aq 0.83132E-12 -12.0802 0.83132E-12 -12.0802 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14349E-10 -10.8432 0.11876E-10 -10.9253 0.82766E+00 -0.0821 67 MgCl+ 0.91355E-13 -13.0393 0.75611E-13 -13.1214 0.82766E+00 -0.0821 68 MgF+ 0.20718E-12 -12.6837 0.17148E-12 -12.7658 0.82766E+00 -0.0821 69 MgOH+ 0.11993E-12 -12.9211 0.99262E-13 -13.0032 0.82766E+00 -0.0821 71 MnF+ 0.18977E-11 -11.7218 0.15707E-11 -11.8039 0.82766E+00 -0.0821 72 MnO,aq 0.50987E-13 -13.2925 0.50987E-13 -13.2925 0.10000E+01 0.0000 73 MnOH+ 0.27046E-10 -10.5679 0.22385E-10 -10.6500 0.82766E+00 -0.0821 75 HMnO2- 0.29852E-17 -17.5250 0.24654E-17 -17.6081 0.82587E+00 -0.0831 78 MnCl+ 0.11280E-10 -10.9477 0.93363E-11 -11.0298 0.82766E+00 -0.0821 79 MnSO4,aq 0.19162E-09 -9.7176 0.19162E-09 -9.7176 0.10000E+01 0.0000 80 NaCl,aq 0.82745E-05 -5.0823 0.82745E-05 -5.0823 0.10000E+01 0.0000 81 NaF,aq 0.35953E-06 -6.4443 0.35953E-06 -6.4443 0.10000E+01 0.0000 82 NaOH,aq 0.52378E-07 -7.2808 0.52378E-07 -7.2808 0.10000E+01 0.0000 84 OH- 0.46620E-05 -5.3314 0.38423E-05 -5.4154 0.82418E+00 -0.0840 89 HPO3-2 0.15678E-17 -17.8047 0.77744E-18 -18.1093 0.49588E+00 -0.3046 91 H2PO3- 0.28383E-18 -18.5469 0.23441E-18 -18.6300 0.82587E+00 -0.0831 92 H3PO4,aq 0.13619E-11 -11.8659 0.13619E-11 -11.8659 0.10000E+01 0.0000 93 H2PO4- 0.28897E-07 -7.5391 0.23891E-07 -7.6218 0.82676E+00 -0.0826 94 PO4-3 0.21153E-12 -12.6746 0.46741E-13 -13.3303 0.22097E+00 -0.6557 97 H2P2O7-2 0.90263E-16 -16.0445 0.44760E-16 -16.3491 0.49588E+00 -0.3046 98 HP2O7-3 0.28408E-15 -15.5466 0.59442E-16 -16.2259 0.20924E+00 -0.6793 99 P2O7-4 0.14580E-17 -17.8363 0.94446E-19 -19.0248 0.64780E-01 -1.1886 100 H2S,aq 0.14014E-02 -2.8534 0.13905E-02 -2.8568 0.99219E+00 -0.0034 101 S2-2 0.13815E-07 -7.8597 0.68505E-08 -8.1643 0.49588E+00 -0.3046 102 S3-2 0.89363E-09 -9.0488 0.44314E-09 -9.3535 0.49588E+00 -0.3046 103 S3- 0.31778E-09 -9.4979 0.26245E-09 -9.5810 0.82587E+00 -0.0831 104 S4-2 0.38185E-10 -10.4181 0.18935E-10 -10.7227 0.49588E+00 -0.3046 105 S5-2 0.10880E-11 -11.9634 0.53952E-12 -12.2680 0.49588E+00 -0.3046 106 SO2,aq 0.17438E-14 -14.7585 0.17438E-14 -14.7585 0.10000E+01 0.0000 107 SO3-2 0.44526E-11 -11.3514 0.22442E-11 -11.6489 0.50403E+00 -0.2975 108 HSO3- 0.25582E-10 -10.5921 0.21127E-10 -10.6752 0.82587E+00 -0.0831 109 HSO4- 0.10428E-06 -6.9818 0.86401E-07 -7.0635 0.82858E+00 -0.0817 111 S2O3-2 0.19642E-07 -7.7068 0.97403E-08 -8.0114 0.49588E+00 -0.3046 112 HS2O3- 0.31707E-12 -12.4988 0.26186E-12 -12.5819 0.82587E+00 -0.0831 113 H2S2O3,aq 0.63118E-18 -18.1998 0.63118E-18 -18.1998 0.10000E+01 0.0000 Charge balance for all species = -.6107E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1808163E-06 0.5268736E-02 0.5299879E+01 0.0000 2 H2O 0.1000000E+01 0.5550435E+02 0.9979146E+06 0.0000 3 Cl- 0.1649214E-02 0.1657492E-02 0.5864477E+02 3.9571 4 SO4-- 0.1199567E-02 0.1201084E-02 0.1151458E+03 10.4212 5 HCO3- 0.1454233E-01 0.1845226E-01 0.1123639E+04 4.9031 6 HS- 0.3622525E-02 0.5024049E-02 0.1658209E+03 4.2989 7 Al+++ 0.3422857E-17 0.1075360E-06 0.2895641E-02 2.3232 8 H4SiO4 0.1024430E-02 0.1034020E-02 0.9918520E+02 -2.9895 9 Ca++ 0.1745524E-06 0.2307272E-06 0.9228468E-02 6.5805 10 Mg++ 0.7718309E-10 0.9278970E-10 0.2251362E-05 3.2238 11 Fe++ 0.9791202E-14 0.1109756E-13 0.6185180E-09 -0.6723 12 K+ 0.1551561E-03 0.1565980E-03 0.6110968E+01 2.9314 13 Na+ 0.2220148E-01 0.2221205E-01 0.5096226E+03 5.0861 14 Mn++ 0.2265101E-08 0.2496995E-08 0.1369038E-03 4.6923 15 F- 0.1016720E-03 0.1021179E-03 0.1936130E+01 2.7460 16 HPO4-- 0.1732565E-07 0.4622470E-07 0.4427669E-02 5.5809 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.4737633E-02 0.4751660E-02 -.1402696E-04 0.0000000E+00 2 H2O 0.5003470E+02 0.5005713E+02 -.2242929E-01 0.0000000E+00 3 Cl- 0.1494825E-02 0.1494825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1083217E-02 0.1083209E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.1664135E-01 0.1664135E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.4531044E-02 0.4530987E-02 0.5703645E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.9698234E-07 0.4678370E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9325411E-03 0.1122048E-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 0.1000844E-13 0.3259226E-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- 0.9209600E-04 0.9209600E-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: 0.1138E-20 Mass of aqueous solution: 0.903679E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2299900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2339E-05 -5.631 0.6039E-03 -3.219 0.8954E-01 0.2324E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5798E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6738 -0.171 99.91 0.2545 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 = 0.674453 g Volume = 0.254706 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: 0.2299900 moles log = -0.6383 Original solution: 1000.0103000 g Original solution / Rock added: 4348.06 (Water/Rock Ratio), log = 3.6383 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.4763 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6946E+00 0.9809 0.1006E+01 0.1025E+01 CO2,gas 0.2793E+00 1.0030 0.4135E+00 0.4123E+00 CH4,gas 0.5787E-04 1.0101 0.8631E-04 0.8544E-04 H2,gas 0.2573E-04 1.0008 0.3802E-04 0.3799E-04 H2S,gas 0.2604E-01 0.9943 0.3822E-01 0.3844E-01 S2,gas 0.2570E-13 1.0000 0.3794E-13 0.3794E-13 CO,gas 0.2839E-08 1.0000 0.4191E-08 0.4191E-08 SO3,gas 0.3453E-32 1.0000 0.5097E-32 0.5097E-32 SO2,gas 0.5108E-14 1.0000 0.7541E-14 0.7541E-14 HF,gas 0.1434E-09 1.0000 0.2117E-09 0.2117E-09 HCl,gas 0.4485E-13 1.0000 0.6622E-13 0.6622E-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 -0.64453E-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 0.28966E+04 0.003 2 CO2,gas -6.66 -8.74 -2.08 -0.694 0.35557E+04 -0.383 3 CH4,gas 4.54 -1.22 -5.76 -1.441 0.98400E+04 -4.064 4 H2,gas 8.00 1.88 -6.12 -3.497 0.10448E+05 -4.420 5 H2S,gas -6.23 -9.35 -3.12 -1.558 0.53216E+04 -1.418 6 S2,gas -7.34 -22.46 -15.12 -2.326 0.25817E+05 -13.421 7 CO,gas 3.21 -6.86 -10.08 -3.101 0.17206E+05 -8.378 8 SO3,gas 17.12 -16.87 -33.99 -8.498 0.58040E+05 -32.293 9 SO2,gas 0.83 -14.99 -15.82 -4.219 0.27015E+05 -14.123 10 HF,gas 0.47 -10.90 -11.37 -5.687 0.19419E+05 -9.674 11 HCl,gas 5.19 -9.69 -14.88 -7.439 0.25404E+05 -13.179 16 albite-high 0.69 -1.56 -2.25 -0.173 0.38456E+04 17 albite -0.38 -1.56 -1.18 -0.090 0.20068E+04 21 analcite 3.32 1.43 -1.89 -0.210 0.32299E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57111E+04 25 anhydrite -5.32 -10.29 -4.97 -2.487 0.84913E+04 38 aragonite 0.97 -2.16 -3.13 -1.043 0.53421E+04 40 calcite 0.81 -2.16 -2.97 -0.991 0.50779E+04 41 carnegieite-low 9.02 4.42 -4.60 -0.658 0.78605E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63807E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94018E+03 69 diamond -3.10 -4.98 -1.88 -0.537 0.32074E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.98 -1.43 -0.410 0.24497E+04 94 heulandite -5.83 -9.70 -3.87 -0.176 0.66121E+04 98 jadeite 4.22 1.43 -2.78 -0.278 0.47553E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54970E+04 104 laumontite 2.88 -0.73 -3.61 -0.241 0.61720E+04 105 lawsonite 9.62 5.25 -4.37 -0.291 0.74590E+04 106 leucite 4.12 -0.72 -4.84 -0.484 0.82697E+04 119 microcline -2.49 -3.71 -1.23 -0.094 0.20957E+04 123 muscovite 2.58 0.93 -1.65 -0.097 0.28175E+04 124 paragonite 4.24 3.09 -1.15 -0.068 0.19678E+04 125 nepheline 8.34 4.42 -3.92 -0.560 0.66929E+04 147 pyrrhotiteFe0.875 -6.02 -10.17 -4.15 -1.527 0.70885E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.05 -3.07 -1.025 0.52487E+04 156 sanidine -1.28 -3.71 -2.44 -0.188 0.41634E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61551E+04 166 stilbite -7.52 -9.70 -2.18 -0.104 0.37183E+04 172 sulfur -9.15 -11.23 -2.08 -0.639 0.35436E+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 -0.73 -4.68 -0.275 0.79938E+04 196 beidellite-Ca -1.65 -4.47 -2.83 -0.175 0.48272E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55190E+04 198 beidellite-K -1.52 -4.59 -3.07 -0.188 0.52434E+04 199 beidellite-Mg -1.79 -5.03 -3.24 -0.200 0.55267E+04 200 beidellite-Na -1.34 -3.88 -2.54 -0.155 0.43333E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.33 -3.02 -0.377 0.51485E+04 204 montmorillonite-Ca -2.29 -5.93 -3.64 -0.225 0.62116E+04 205 montmorillonite-K -2.24 -6.05 -3.81 -0.233 0.65060E+04 206 montmorillonite-Mg -2.48 -6.48 -4.00 -0.248 0.68343E+04 207 montmorillonite-Na -2.04 -5.34 -3.30 -0.202 0.56316E+04 214 topaz -16.55 -20.14 -3.60 -0.400 0.61410E+04 234 alabandite -0.98 -4.65 -3.68 -1.226 0.62779E+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 -0.20 -2.22 -0.170 0.37830E+04 248 an25ab75 2.65 0.14 -2.50 -0.193 0.42740E+04 249 an30ab70 3.28 0.48 -2.80 -0.215 0.47747E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2299900 MOLES New total amount of reactant added: 0.2399900 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 = 0.2399900 Water: Moles liquid = 0.5007E+02 kg liquid = 0.9020E+00 Moles total = 0.5004E+02 kg total = 0.9015E+00 Activity = 0.9999 Stoichiometric ionic strength = .2685281E-01 Osmotic coef. = 0.9094 True ionic strength = .2361695E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1554E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.22369E-06 -6.6504 0.18598E-06 -6.7305 0.83142E+00 -0.0802 2 H2O 0.99988E+00 -0.0001 0.99988E+00 -0.0001 3 Cl- 0.17140E-02 -2.7660 0.14153E-02 -2.8491 0.82574E+00 -0.0832 4 SO4-- 0.12522E-02 -2.9023 0.62209E-03 -3.2061 0.49680E+00 -0.3038 5 HCO3- 0.14451E-01 -1.8401 0.11952E-01 -1.9226 0.82711E+00 -0.0824 6 HS- 0.35437E-02 -2.4505 0.29267E-02 -2.5336 0.82588E+00 -0.0831 7 Al+++ 0.64858E-17 -17.1880 0.13538E-17 -17.8684 0.20873E+00 -0.6804 8 H4SiO4 0.10244E-02 -2.9895 0.10244E-02 -2.9895 0.10000E+01 0.0000 9 Ca++ 0.17529E-06 -6.7562 0.86355E-07 -7.0637 0.49265E+00 -0.3075 10 Mg++ 0.77399E-10 -10.1113 0.37932E-10 -10.4210 0.49008E+00 -0.3097 11 Fe++ 0.95548E-14 -14.0198 0.46885E-14 -14.3290 0.49069E+00 -0.3092 12 K+ 0.15507E-03 -3.8095 0.12829E-03 -3.8918 0.82733E+00 -0.0823 13 Na+ 0.22198E-01 -1.6537 0.18325E-01 -1.7369 0.82556E+00 -0.0833 14 Mn++ 0.22615E-08 -8.6456 0.11108E-08 -8.9544 0.49116E+00 -0.3088 15 F- 0.10605E-03 -3.9745 0.87363E-04 -4.0587 0.82381E+00 -0.0842 16 HPO4-- 0.15092E-07 -7.8213 0.74989E-08 -8.1250 0.49688E+00 -0.3037 18 HSiO3- 0.62293E-05 -5.2056 0.51438E-05 -5.2887 0.82574E+00 -0.0832 19 Ca(HSiO3)+ 0.12224E-10 -10.9128 0.10116E-10 -10.9950 0.82754E+00 -0.0822 20 Mg(HSiO3)+ 0.66824E-14 -14.1751 0.55299E-14 -14.2573 0.82754E+00 -0.0822 21 NaHSiO3,aq 0.15246E-05 -5.8169 0.15246E-05 -5.8169 0.10000E+01 0.0000 22 AlO+ 0.64339E-11 -11.1915 0.53243E-11 -11.2737 0.82754E+00 -0.0822 23 AlOH+2 0.10028E-13 -13.9988 0.49305E-14 -14.3071 0.49170E+00 -0.3083 24 HAlO2,aq 0.57007E-08 -8.2441 0.57007E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.82340E-07 -7.0844 0.67852E-07 -7.1684 0.82405E+00 -0.0840 26 CH4,aq 0.55055E-07 -7.2592 0.54615E-07 -7.2627 0.99201E+00 -0.0035 27 C2H6,aq 0.19024E-16 -16.7207 0.18871E-16 -16.7242 0.99201E+00 -0.0035 31 CO,aq 0.32248E-11 -11.4915 0.32248E-11 -11.4915 0.10000E+01 0.0000 32 CO2,aq 0.47885E-02 -2.3198 0.47502E-02 -2.3233 0.99201E+00 -0.0035 33 CO3-2 0.11327E-04 -4.9459 0.56135E-05 -5.2508 0.49560E+00 -0.3049 34 CaCO3,aq 0.60783E-08 -8.2162 0.60783E-08 -8.2162 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31837E-07 -7.4971 0.26346E-07 -7.5793 0.82754E+00 -0.0822 36 CaCl+ 0.23901E-09 -9.6216 0.19779E-09 -9.7038 0.82754E+00 -0.0822 37 CaCl2,aq 0.66507E-13 -13.1771 0.66507E-13 -13.1771 0.10000E+01 0.0000 38 CaF+ 0.13310E-09 -9.8758 0.11015E-09 -9.9580 0.82754E+00 -0.0822 39 CaOH+ 0.39985E-10 -10.3981 0.33089E-10 -10.4803 0.82754E+00 -0.0822 40 CaSO4,aq 0.17059E-07 -7.7681 0.17059E-07 -7.7681 0.10000E+01 0.0000 41 HCl,aq 0.48233E-10 -10.3167 0.48233E-10 -10.3167 0.10000E+01 0.0000 45 HF,aq 0.11123E-06 -6.9538 0.11123E-06 -6.9538 0.10000E+01 0.0000 46 HF2- 0.39731E-11 -11.4009 0.32807E-11 -11.4840 0.82574E+00 -0.0832 48 FeCl+ 0.12692E-16 -16.8965 0.10503E-16 -16.9787 0.82754E+00 -0.0822 51 FeF+ 0.25294E-16 -16.5970 0.20931E-16 -16.6792 0.82754E+00 -0.0822 53 FeO,aq 0.52678E-17 -17.2784 0.52678E-17 -17.2784 0.10000E+01 0.0000 54 FeOH+ 0.99152E-15 -15.0037 0.82052E-15 -15.0859 0.82754E+00 -0.0822 55 HFeO2- 0.35887E-18 -18.4451 0.29633E-18 -18.5282 0.82574E+00 -0.0832 56 FeO+ 0.14387E-19 -19.8420 0.11906E-19 -19.9242 0.82754E+00 -0.0822 58 FeO2- 0.85291E-19 -19.0691 0.70428E-19 -19.1523 0.82574E+00 -0.0832 59 HFeO2,aq 0.16659E-17 -17.7784 0.16659E-17 -17.7784 0.10000E+01 0.0000 60 H2,aq 0.27239E-07 -7.5648 0.27021E-07 -7.5683 0.99201E+00 -0.0035 61 KCl,aq 0.32909E-08 -8.4827 0.32909E-08 -8.4827 0.10000E+01 0.0000 62 KHSO4,aq 0.41966E-13 -13.3771 0.41966E-13 -13.3771 0.10000E+01 0.0000 63 KOH,aq 0.29456E-09 -9.5308 0.29456E-09 -9.5308 0.10000E+01 0.0000 64 KSO4- 0.14998E-05 -5.8240 0.12384E-05 -5.9071 0.82574E+00 -0.0832 65 MgCO3,aq 0.66923E-12 -12.1744 0.66923E-12 -12.1744 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14290E-10 -10.8450 0.11825E-10 -10.9272 0.82754E+00 -0.0822 67 MgCl+ 0.95154E-13 -13.0216 0.78743E-13 -13.1038 0.82754E+00 -0.0822 68 MgF+ 0.21657E-12 -12.6644 0.17922E-12 -12.7466 0.82754E+00 -0.0822 69 MgOH+ 0.97187E-13 -13.0124 0.80426E-13 -13.0946 0.82754E+00 -0.0822 71 MnF+ 0.19752E-11 -11.7044 0.16345E-11 -11.7866 0.82754E+00 -0.0822 72 MnO,aq 0.33254E-13 -13.4782 0.33254E-13 -13.4782 0.10000E+01 0.0000 73 MnOH+ 0.21822E-10 -10.6611 0.18058E-10 -10.7433 0.82754E+00 -0.0822 75 HMnO2- 0.15743E-17 -17.8029 0.12999E-17 -17.8861 0.82574E+00 -0.0832 78 MnCl+ 0.11698E-10 -10.9319 0.96808E-11 -11.0141 0.82754E+00 -0.0822 79 MnSO4,aq 0.19948E-09 -9.7001 0.19948E-09 -9.7001 0.10000E+01 0.0000 80 NaCl,aq 0.85954E-05 -5.0657 0.85954E-05 -5.0657 0.10000E+01 0.0000 81 NaF,aq 0.37482E-06 -6.4262 0.37482E-06 -6.4262 0.10000E+01 0.0000 82 NaOH,aq 0.42331E-07 -7.3733 0.42331E-07 -7.3733 0.10000E+01 0.0000 84 OH- 0.37696E-05 -5.4237 0.31063E-05 -5.5078 0.82405E+00 -0.0840 89 HPO3-2 0.12742E-17 -17.8947 0.63152E-18 -18.1996 0.49560E+00 -0.3049 91 H2PO3- 0.28522E-18 -18.5448 0.23552E-18 -18.6280 0.82574E+00 -0.0832 92 H3PO4,aq 0.18140E-11 -11.7414 0.18140E-11 -11.7414 0.10000E+01 0.0000 93 H2PO4- 0.31123E-07 -7.5069 0.25727E-07 -7.5896 0.82663E+00 -0.0827 94 PO4-3 0.14905E-12 -12.8267 0.32898E-13 -13.4828 0.22071E+00 -0.6562 97 H2P2O7-2 0.10473E-15 -15.9799 0.51904E-16 -16.2848 0.49560E+00 -0.3049 98 HP2O7-3 0.26666E-15 -15.5740 0.55727E-16 -16.2539 0.20898E+00 -0.6799 99 P2O7-4 0.11074E-17 -17.9557 0.71584E-19 -19.1452 0.64641E-01 -1.1895 100 H2S,aq 0.16958E-02 -2.7706 0.16822E-02 -2.7741 0.99201E+00 -0.0035 101 S2-2 0.14173E-07 -7.8486 0.70240E-08 -8.1534 0.49560E+00 -0.3049 102 S3-2 0.11887E-08 -8.9249 0.58914E-09 -9.2298 0.49560E+00 -0.3049 103 S3- 0.54108E-09 -9.2667 0.44679E-09 -9.3499 0.82574E+00 -0.0832 104 S4-2 0.65862E-10 -10.1814 0.32642E-10 -10.4862 0.49560E+00 -0.3049 105 S5-2 0.24333E-11 -11.6138 0.12059E-11 -11.9187 0.49560E+00 -0.3049 106 SO2,aq 0.25971E-14 -14.5855 0.25971E-14 -14.5855 0.10000E+01 0.0000 107 SO3-2 0.43367E-11 -11.3628 0.21846E-11 -11.6606 0.50376E+00 -0.2978 108 HSO3- 0.30807E-10 -10.5113 0.25439E-10 -10.5945 0.82574E+00 -0.0832 109 HSO4- 0.13458E-06 -6.8710 0.11150E-06 -6.9527 0.82846E+00 -0.0817 111 S2O3-2 0.24807E-07 -7.6054 0.12294E-07 -7.9103 0.49560E+00 -0.3049 112 HS2O3- 0.49510E-12 -12.3053 0.40882E-12 -12.3885 0.82574E+00 -0.0832 113 H2S2O3,aq 0.12189E-17 -17.9140 0.12189E-17 -17.9140 0.10000E+01 0.0000 Charge balance for all species = -.6106E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2236855E-06 0.6461555E-02 0.6499437E+01 0.0000 2 H2O 0.1000000E+01 0.5550346E+02 0.9978506E+06 0.0000 3 Cl- 0.1714004E-02 0.1722603E-02 0.6094557E+02 3.8814 4 SO4-- 0.1252186E-02 0.1253805E-02 0.1201943E+03 10.2549 5 HCO3- 0.1445055E-01 0.1925048E-01 0.1172189E+04 4.8080 6 HS- 0.3543726E-02 0.5239605E-02 0.1729271E+03 4.1969 7 Al+++ 0.6485802E-17 0.8804744E-07 0.2370756E-02 2.3232 8 H4SiO4 0.1024386E-02 0.1032140E-02 0.9900007E+02 -2.9895 9 Ca++ 0.1752874E-06 0.2306857E-06 0.9226367E-02 6.3974 10 Mg++ 0.7739858E-10 0.9277303E-10 0.2250849E-05 3.0401 11 Fe++ 0.9554809E-14 0.1059171E-13 0.5902959E-09 -0.8679 12 K+ 0.1550665E-03 0.1565699E-03 0.6109576E+01 2.8387 13 Na+ 0.2219752E-01 0.2220806E-01 0.5095066E+03 4.9936 14 Mn++ 0.2261533E-08 0.2496547E-08 0.1368726E-03 4.5067 15 F- 0.1060478E-03 0.1065340E-03 0.2019762E+01 2.6719 16 HPO4-- 0.1509182E-07 0.4621640E-07 0.4426661E-02 5.3361 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.5814383E-02 0.5828463E-02 -.1407965E-04 0.0000000E+00 2 H2O 0.5004289E+02 0.5006532E+02 -.2243231E-01 0.0000000E+00 3 Cl- 0.1553825E-02 0.1553825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1130967E-02 0.1130959E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.1736435E-01 0.1736435E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.4726294E-02 0.4726237E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.7942070E-07 0.4695931E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9310125E-03 0.1122201E-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 0.9553949E-14 0.3259226E-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- 0.9609600E-04 0.9609600E-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: -.7279E-21 Mass of aqueous solution: 0.903885E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2348E-05 -5.629 0.6062E-03 -3.217 0.8986E-01 0.2332E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5797E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6739 -0.171 99.91 0.2545 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 = 0.674546 g Volume = 0.254742 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: 0.2399900 moles log = -0.6198 Original solution: 1000.0103000 g Original solution / Rock added: 4166.88 (Water/Rock Ratio), log = 3.6198 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.5801 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6496E+00 0.9800 0.1006E+01 0.1026E+01 CO2,gas 0.3209E+00 1.0023 0.5082E+00 0.5071E+00 CH4,gas 0.5038E-04 1.0098 0.8039E-04 0.7961E-04 H2,gas 0.2243E-04 1.0008 0.3548E-04 0.3545E-04 H2S,gas 0.2945E-01 0.9939 0.4624E-01 0.4653E-01 S2,gas 0.4037E-13 1.0000 0.6378E-13 0.6378E-13 CO,gas 0.3041E-08 1.0000 0.4806E-08 0.4806E-08 SO3,gas 0.5149E-32 1.0000 0.8136E-32 0.8136E-32 SO2,gas 0.7108E-14 1.0000 0.1123E-13 0.1123E-13 HF,gas 0.1728E-09 1.0000 0.2731E-09 0.2731E-09 HCl,gas 0.5386E-13 1.0000 0.8511E-13 0.8511E-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 -0.64453E-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 0.28966E+04 0.003 2 CO2,gas -6.66 -8.65 -1.99 -0.664 0.34028E+04 -0.294 3 CH4,gas 4.54 -1.25 -5.79 -1.448 0.98927E+04 -4.095 4 H2,gas 8.00 1.85 -6.15 -3.514 0.10499E+05 -4.450 5 H2S,gas -6.23 -9.26 -3.03 -1.517 0.51803E+04 -1.335 6 S2,gas -7.34 -22.23 -14.89 -2.291 0.25432E+05 -13.195 7 CO,gas 3.21 -6.80 -10.02 -3.082 0.17104E+05 -8.318 8 SO3,gas 17.12 -16.67 -33.79 -8.447 0.57693E+05 -32.090 9 SO2,gas 0.83 -14.82 -15.65 -4.173 0.26719E+05 -13.950 10 HF,gas 0.47 -10.79 -11.26 -5.631 0.19231E+05 -9.564 11 HCl,gas 5.19 -9.58 -14.77 -7.384 0.25218E+05 -13.070 16 albite-high 0.69 -1.65 -2.34 -0.180 0.40035E+04 17 albite -0.38 -1.65 -1.27 -0.098 0.21647E+04 21 analcite 3.32 1.34 -1.98 -0.220 0.33878E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57111E+04 25 anhydrite -5.32 -10.27 -4.95 -2.477 0.84572E+04 38 aragonite 0.97 -2.26 -3.22 -1.074 0.55019E+04 40 calcite 0.81 -2.26 -3.07 -1.022 0.52377E+04 41 carnegieite-low 9.02 4.33 -4.70 -0.671 0.80184E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63807E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94017E+03 69 diamond -3.10 -4.95 -1.85 -0.528 0.31573E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.95 -1.41 -0.402 0.23996E+04 94 heulandite -5.83 -9.88 -4.06 -0.184 0.69248E+04 98 jadeite 4.22 1.34 -2.88 -0.288 0.49132E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54970E+04 104 laumontite 2.88 -0.91 -3.80 -0.253 0.64847E+04 105 lawsonite 9.62 5.06 -4.55 -0.303 0.77716E+04 106 leucite 4.12 -0.82 -4.94 -0.494 0.84279E+04 119 microcline -2.49 -3.81 -1.32 -0.102 0.22539E+04 123 muscovite 2.58 0.84 -1.74 -0.103 0.29757E+04 124 paragonite 4.24 2.99 -1.24 -0.073 0.21257E+04 125 nepheline 8.34 4.33 -4.01 -0.573 0.68508E+04 147 pyrrhotiteFe0.875 -6.02 -10.25 -4.24 -1.558 0.72330E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.15 -3.17 -1.057 0.54128E+04 156 sanidine -1.28 -3.81 -2.53 -0.195 0.43216E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61550E+04 166 stilbite -7.52 -9.88 -2.36 -0.112 0.40310E+04 172 sulfur -9.15 -11.11 -1.96 -0.604 0.33510E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 190 wairakite 3.95 -0.91 -4.86 -0.286 0.83065E+04 196 beidellite-Ca -1.65 -4.50 -2.86 -0.177 0.48787E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55189E+04 198 beidellite-K -1.52 -4.62 -3.10 -0.190 0.52956E+04 199 beidellite-Mg -1.79 -5.06 -3.27 -0.202 0.55784E+04 200 beidellite-Na -1.34 -3.91 -2.57 -0.157 0.43854E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.34 -3.02 -0.377 0.51535E+04 204 montmorillonite-Ca -2.29 -6.02 -3.73 -0.231 0.63667E+04 205 montmorillonite-K -2.24 -6.14 -3.90 -0.239 0.66617E+04 206 montmorillonite-Mg -2.48 -6.57 -4.09 -0.253 0.69896E+04 207 montmorillonite-Na -2.04 -5.43 -3.39 -0.208 0.57872E+04 214 topaz -16.55 -19.92 -3.38 -0.375 0.57633E+04 234 alabandite -0.98 -4.76 -3.78 -1.260 0.64535E+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 -0.31 -2.33 -0.179 0.39718E+04 248 an25ab75 2.65 0.03 -2.62 -0.201 0.44706E+04 249 an30ab70 3.28 0.36 -2.92 -0.224 0.49790E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2399900 MOLES New total amount of reactant added: 0.2499900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.2499900 Water: Moles liquid = 0.5008E+02 kg liquid = 0.9022E+00 Moles total = 0.5005E+02 kg total = 0.9017E+00 Activity = 0.9999 Stoichiometric ionic strength = .2749810E-01 Osmotic coef. = 0.9086 True ionic strength = .2366352E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1613E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.26752E-06 -6.5726 0.22239E-06 -6.6529 0.83130E+00 -0.0802 2 H2O 0.99986E+00 -0.0001 0.99986E+00 -0.0001 3 Cl- 0.17788E-02 -2.7499 0.14686E-02 -2.8331 0.82561E+00 -0.0832 4 SO4-- 0.13048E-02 -2.8845 0.64786E-03 -3.1885 0.49652E+00 -0.3041 5 HCO3- 0.14352E-01 -1.8431 0.11869E-01 -1.9256 0.82699E+00 -0.0825 6 HS- 0.34695E-02 -2.4597 0.28650E-02 -2.5429 0.82575E+00 -0.0832 7 Al+++ 0.11105E-16 -16.9545 0.23150E-17 -17.6354 0.20847E+00 -0.6810 8 H4SiO4 0.10243E-02 -2.9896 0.10243E-02 -2.9896 0.10000E+01 0.0000 9 Ca++ 0.17569E-06 -6.7553 0.86502E-07 -7.0630 0.49236E+00 -0.3077 10 Mg++ 0.77572E-10 -10.1103 0.37995E-10 -10.4203 0.48980E+00 -0.3100 11 Fe++ 0.93938E-14 -14.0272 0.46068E-14 -14.3366 0.49041E+00 -0.3094 12 K+ 0.15498E-03 -3.8097 0.12820E-03 -3.8921 0.82720E+00 -0.0824 13 Na+ 0.22193E-01 -1.6538 0.18319E-01 -1.7371 0.82543E+00 -0.0833 14 Mn++ 0.22565E-08 -8.6466 0.11077E-08 -8.9556 0.49087E+00 -0.3090 15 F- 0.11042E-03 -3.9570 0.90950E-04 -4.0412 0.82368E+00 -0.0842 16 HPO4-- 0.13335E-07 -7.8750 0.66222E-08 -8.1790 0.49661E+00 -0.3040 18 HSiO3- 0.52100E-05 -5.2832 0.43014E-05 -5.3664 0.82561E+00 -0.0832 19 Ca(HSiO3)+ 0.10241E-10 -10.9896 0.84737E-11 -11.0719 0.82741E+00 -0.0823 20 Mg(HSiO3)+ 0.55982E-14 -14.2519 0.46320E-14 -14.3342 0.82741E+00 -0.0823 21 NaHSiO3,aq 0.12745E-05 -5.8947 0.12745E-05 -5.8947 0.10000E+01 0.0000 22 AlO+ 0.76951E-11 -11.1138 0.63670E-11 -11.1961 0.82741E+00 -0.0823 23 AlOH+2 0.14348E-13 -13.8432 0.70507E-14 -14.1518 0.49142E+00 -0.3085 24 HAlO2,aq 0.57007E-08 -8.2441 0.57007E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.68869E-07 -7.1620 0.56742E-07 -7.2461 0.82392E+00 -0.0841 26 CH4,aq 0.51397E-07 -7.2891 0.50976E-07 -7.2926 0.99182E+00 -0.0036 27 C2H6,aq 0.17605E-16 -16.7544 0.17461E-16 -16.7579 0.99182E+00 -0.0036 31 CO,aq 0.36057E-11 -11.4430 0.36057E-11 -11.4430 0.10000E+01 0.0000 32 CO2,aq 0.56873E-02 -2.2451 0.56407E-02 -2.2487 0.99182E+00 -0.0036 33 CO3-2 0.94109E-05 -5.0264 0.46615E-05 -5.3315 0.49533E+00 -0.3051 34 CaCO3,aq 0.50560E-08 -8.2962 0.50560E-08 -8.2962 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31673E-07 -7.4993 0.26207E-07 -7.5816 0.82741E+00 -0.0823 36 CaCl+ 0.24847E-09 -9.6047 0.20558E-09 -9.6870 0.82741E+00 -0.0823 37 CaCl2,aq 0.71728E-13 -13.1443 0.71728E-13 -13.1443 0.10000E+01 0.0000 38 CaF+ 0.13883E-09 -9.8575 0.11487E-09 -9.9398 0.82741E+00 -0.0823 39 CaOH+ 0.33499E-10 -10.4750 0.27717E-10 -10.5572 0.82741E+00 -0.0823 40 CaSO4,aq 0.17796E-07 -7.7497 0.17796E-07 -7.7497 0.10000E+01 0.0000 41 HCl,aq 0.59848E-10 -10.2230 0.59848E-10 -10.2230 0.10000E+01 0.0000 45 HF,aq 0.13847E-06 -6.8587 0.13847E-06 -6.8587 0.10000E+01 0.0000 46 HF2- 0.51500E-11 -11.2882 0.42519E-11 -11.3714 0.82561E+00 -0.0832 48 FeCl+ 0.12942E-16 -16.8880 0.10708E-16 -16.9703 0.82741E+00 -0.0823 51 FeF+ 0.25877E-16 -16.5871 0.21411E-16 -16.6694 0.82741E+00 -0.0823 53 FeO,aq 0.36196E-17 -17.4413 0.36196E-17 -17.4413 0.10000E+01 0.0000 54 FeOH+ 0.81482E-15 -15.0889 0.67419E-15 -15.1712 0.82741E+00 -0.0823 55 HFeO2- 0.20624E-18 -18.6856 0.17027E-18 -18.7689 0.82561E+00 -0.0832 56 FeO+ 0.12185E-19 -19.9142 0.10082E-19 -19.9965 0.82741E+00 -0.0823 58 FeO2- 0.50513E-19 -19.2966 0.41704E-19 -19.3798 0.82561E+00 -0.0832 59 HFeO2,aq 0.11796E-17 -17.9283 0.11796E-17 -17.9283 0.10000E+01 0.0000 60 H2,aq 0.25652E-07 -7.5909 0.25442E-07 -7.5944 0.99182E+00 -0.0036 61 KCl,aq 0.34122E-08 -8.4670 0.34122E-08 -8.4670 0.10000E+01 0.0000 62 KHSO4,aq 0.52223E-13 -13.2821 0.52223E-13 -13.2821 0.10000E+01 0.0000 63 KOH,aq 0.24614E-09 -9.6088 0.24614E-09 -9.6088 0.10000E+01 0.0000 64 KSO4- 0.15610E-05 -5.8066 0.12888E-05 -5.8898 0.82561E+00 -0.0832 65 MgCO3,aq 0.55665E-12 -12.2544 0.55665E-12 -12.2544 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14215E-10 -10.8472 0.11762E-10 -10.9295 0.82741E+00 -0.0823 67 MgCl+ 0.98913E-13 -13.0047 0.81842E-13 -13.0870 0.82741E+00 -0.0823 68 MgF+ 0.22588E-12 -12.6461 0.18689E-12 -12.7284 0.82741E+00 -0.0823 69 MgOH+ 0.81420E-13 -13.0893 0.67367E-13 -13.1716 0.82741E+00 -0.0823 71 MnF+ 0.20508E-11 -11.6881 0.16969E-11 -11.7703 0.82741E+00 -0.0823 72 MnO,aq 0.23190E-13 -13.6347 0.23190E-13 -13.6347 0.10000E+01 0.0000 73 MnOH+ 0.18200E-10 -10.7399 0.15059E-10 -10.8222 0.82741E+00 -0.0823 75 HMnO2- 0.91819E-18 -18.0371 0.75807E-18 -18.1203 0.82561E+00 -0.0832 78 MnCl+ 0.12107E-10 -10.9170 0.10017E-10 -10.9993 0.82741E+00 -0.0823 79 MnSO4,aq 0.20717E-09 -9.6837 0.20717E-09 -9.6837 0.10000E+01 0.0000 80 NaCl,aq 0.89157E-05 -5.0498 0.89157E-05 -5.0498 0.10000E+01 0.0000 81 NaF,aq 0.39007E-06 -6.4089 0.39007E-06 -6.4089 0.10000E+01 0.0000 82 NaOH,aq 0.35387E-07 -7.4512 0.35387E-07 -7.4512 0.10000E+01 0.0000 84 OH- 0.31528E-05 -5.5013 0.25976E-05 -5.5854 0.82392E+00 -0.0841 89 HPO3-2 0.10602E-17 -17.9746 0.52512E-18 -18.2797 0.49533E+00 -0.3051 91 H2PO3- 0.28365E-18 -18.5472 0.23418E-18 -18.6304 0.82561E+00 -0.0832 92 H3PO4,aq 0.22907E-11 -11.6400 0.22907E-11 -11.6400 0.10000E+01 0.0000 93 H2PO4- 0.32871E-07 -7.4832 0.27168E-07 -7.5659 0.82650E+00 -0.0828 94 PO4-3 0.11020E-12 -12.9578 0.24295E-13 -13.6145 0.22045E+00 -0.6567 97 H2P2O7-2 0.11686E-15 -15.9324 0.57881E-16 -16.2375 0.49533E+00 -0.3051 98 HP2O7-3 0.24899E-15 -15.6038 0.51969E-16 -16.2843 0.20872E+00 -0.6804 99 P2O7-4 0.86551E-18 -18.0627 0.55826E-19 -19.2532 0.64500E-01 -1.1904 100 H2S,aq 0.19854E-02 -2.7021 0.19692E-02 -2.7057 0.99182E+00 -0.0036 101 S2-2 0.14432E-07 -7.8407 0.71485E-08 -8.1458 0.49533E+00 -0.3051 102 S3-2 0.15049E-08 -8.8225 0.74542E-09 -9.1276 0.49533E+00 -0.3051 103 S3- 0.84383E-09 -9.0737 0.69667E-09 -9.1570 0.82561E+00 -0.0832 104 S4-2 0.10366E-09 -9.9844 0.51346E-10 -10.2895 0.49533E+00 -0.3051 105 S5-2 0.47612E-11 -11.3223 0.23584E-11 -11.6274 0.49533E+00 -0.3051 106 SO2,aq 0.36417E-14 -14.4387 0.36417E-14 -14.4387 0.10000E+01 0.0000 107 SO3-2 0.42548E-11 -11.3711 0.21422E-11 -11.6691 0.50349E+00 -0.2980 108 HSO3- 0.36130E-10 -10.4421 0.29830E-10 -10.5254 0.82561E+00 -0.0832 109 HSO4- 0.16763E-06 -6.7757 0.13885E-06 -6.8575 0.82833E+00 -0.0818 111 S2O3-2 0.30259E-07 -7.5191 0.14988E-07 -7.8243 0.49533E+00 -0.3051 112 HS2O3- 0.72188E-12 -12.1415 0.59599E-12 -12.2248 0.82561E+00 -0.0832 113 H2S2O3,aq 0.21248E-17 -17.6727 0.21248E-17 -17.6727 0.10000E+01 0.0000 Charge balance for all species = -.6105E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2675245E-06 0.7653927E-02 0.7698430E+01 0.0000 2 H2O 0.1000000E+01 0.5550256E+02 0.9977866E+06 0.0000 3 Cl- 0.1778771E-02 0.1787690E-02 0.6324532E+02 3.8198 4 SO4-- 0.1304782E-02 0.1306507E-02 0.1252404E+03 10.1172 5 HCO3- 0.1435165E-01 0.2004841E-01 0.1220718E+04 4.7273 6 HS- 0.3469547E-02 0.5455083E-02 0.1800300E+03 4.1100 7 Al+++ 0.1110502E-16 0.7457767E-07 0.2007974E-02 2.3232 8 H4SiO4 0.1024342E-02 0.1030827E-02 0.9886936E+02 -2.9896 9 Ca++ 0.1756882E-06 0.2306442E-06 0.9224266E-02 6.2428 10 Mg++ 0.7757245E-10 0.9275636E-10 0.2250337E-05 2.8855 11 Fe++ 0.9393766E-14 0.1025248E-13 0.5713626E-09 -1.0308 12 K+ 0.1549770E-03 0.1565417E-03 0.6108185E+01 2.7608 13 Na+ 0.2219345E-01 0.2220407E-01 0.5093905E+03 4.9158 14 Mn++ 0.2256547E-08 0.2496098E-08 0.1368414E-03 4.3502 15 F- 0.1104199E-03 0.1109486E-03 0.2103356E+01 2.6117 16 HPO4-- 0.1333489E-07 0.4620809E-07 0.4425653E-02 5.1268 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6891133E-02 0.6905249E-02 -.1411606E-04 0.0000000E+00 2 H2O 0.5005108E+02 0.5007351E+02 -.2243431E-01 0.0000000E+00 3 Cl- 0.1612825E-02 0.1612825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1178717E-02 0.1178709E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.1808735E-01 0.1808735E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.4921544E-02 0.4921487E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.6728277E-07 0.4708069E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9299950E-03 0.1122303E-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 0.9249619E-14 0.3259226E-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- 0.1000960E-03 0.1000960E-03 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: 0.7809E-21 Mass of aqueous solution: 0.904090E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2499900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2354E-05 -5.628 0.6077E-03 -3.216 0.9008E-01 0.2338E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5797E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6740 -0.171 99.91 0.2545 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 = 0.674608 g Volume = 0.254765 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: 0.2499900 moles log = -0.6021 Original solution: 1000.0103000 g Original solution / Rock added: 4000.20 (Water/Rock Ratio), log = 3.6021 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.6844 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6099E+00 0.9791 0.1006E+01 0.1027E+01 CO2,gas 0.3577E+00 1.0016 0.6035E+00 0.6025E+00 CH4,gas 0.4413E-04 1.0095 0.7503E-04 0.7433E-04 H2,gas 0.1981E-04 1.0009 0.3340E-04 0.3337E-04 H2S,gas 0.3235E-01 0.9935 0.5413E-01 0.5449E-01 S2,gas 0.5853E-13 1.0000 0.9858E-13 0.9858E-13 CO,gas 0.3190E-08 1.0000 0.5373E-08 0.5373E-08 SO3,gas 0.7194E-32 1.0000 0.1212E-31 0.1212E-31 SO2,gas 0.9350E-14 1.0000 0.1575E-13 0.1575E-13 HF,gas 0.2018E-09 1.0000 0.3400E-09 0.3400E-09 HCl,gas 0.6270E-13 1.0000 0.1056E-12 0.1056E-12 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 0.17819E-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 0.28966E+04 0.003 2 CO2,gas -6.66 -8.58 -1.92 -0.639 0.32754E+04 -0.219 3 CH4,gas 4.54 -1.28 -5.82 -1.456 0.99438E+04 -4.125 4 H2,gas 8.00 1.82 -6.18 -3.529 0.10544E+05 -4.476 5 H2S,gas -6.23 -9.20 -2.97 -1.483 0.50635E+04 -1.267 6 S2,gas -7.34 -22.04 -14.71 -2.262 0.25109E+05 -13.006 7 CO,gas 3.21 -6.75 -9.97 -3.067 0.17021E+05 -8.270 8 SO3,gas 17.12 -16.49 -33.62 -8.404 0.57398E+05 -31.917 9 SO2,gas 0.83 -14.67 -15.50 -4.134 0.26469E+05 -13.803 10 HF,gas 0.47 -10.69 -11.17 -5.584 0.19068E+05 -9.469 11 HCl,gas 5.19 -9.49 -14.68 -7.338 0.25058E+05 -12.976 16 albite-high 0.69 -1.73 -2.42 -0.186 0.41363E+04 17 albite -0.38 -1.73 -1.35 -0.104 0.22975E+04 21 analcite 3.32 1.26 -2.06 -0.229 0.35207E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57110E+04 25 anhydrite -5.32 -10.25 -4.93 -2.467 0.84258E+04 38 aragonite 0.97 -2.34 -3.30 -1.101 0.56384E+04 40 calcite 0.81 -2.34 -3.15 -1.049 0.53742E+04 41 carnegieite-low 9.02 4.25 -4.77 -0.682 0.81512E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63806E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94016E+03 69 diamond -3.10 -4.93 -1.83 -0.522 0.31192E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.93 -1.38 -0.395 0.23614E+04 94 heulandite -5.83 -10.04 -4.21 -0.191 0.71888E+04 98 jadeite 4.22 1.26 -2.96 -0.296 0.50461E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54970E+04 104 laumontite 2.88 -1.07 -3.95 -0.263 0.67487E+04 105 lawsonite 9.62 4.91 -4.71 -0.314 0.80356E+04 119 microcline -2.49 -3.88 -1.40 -0.108 0.23870E+04 123 muscovite 2.58 0.76 -1.82 -0.107 0.31089E+04 124 paragonite 4.24 2.92 -1.32 -0.078 0.22585E+04 125 nepheline 8.34 4.25 -4.09 -0.584 0.69836E+04 147 pyrrhotiteFe0.875 -6.02 -10.32 -4.31 -1.584 0.73542E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.23 -3.25 -1.084 0.55527E+04 156 sanidine -1.28 -3.88 -2.61 -0.201 0.44547E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61550E+04 166 stilbite -7.52 -10.04 -2.52 -0.120 0.42951E+04 172 sulfur -9.15 -11.02 -1.87 -0.575 0.31895E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.53 -2.88 -0.178 0.49223E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55189E+04 198 beidellite-K -1.52 -4.65 -3.13 -0.191 0.53396E+04 199 beidellite-Mg -1.79 -5.08 -3.29 -0.204 0.56220E+04 200 beidellite-Na -1.34 -3.94 -2.59 -0.159 0.44292E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.34 -3.02 -0.378 0.51590E+04 204 montmorillonite-Ca -2.29 -6.10 -3.81 -0.235 0.64974E+04 205 montmorillonite-K -2.24 -6.21 -3.98 -0.244 0.67928E+04 206 montmorillonite-Mg -2.48 -6.65 -4.17 -0.258 0.71202E+04 207 montmorillonite-Na -2.04 -5.50 -3.47 -0.212 0.59181E+04 214 topaz -16.55 -19.73 -3.19 -0.354 0.54384E+04 234 alabandite -0.98 -4.85 -3.87 -1.289 0.66040E+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 -0.40 -2.42 -0.186 0.41309E+04 248 an25ab75 2.65 -0.07 -2.72 -0.209 0.46362E+04 249 an30ab70 3.28 0.26 -3.02 -0.232 0.51512E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2499900 MOLES New total amount of reactant added: 0.2599900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.2599900 Water: Moles liquid = 0.5009E+02 kg liquid = 0.9023E+00 Moles total = 0.5006E+02 kg total = 0.9018E+00 Activity = 0.9998 Stoichiometric ionic strength = .2814319E-01 Osmotic coef. = 0.9078 True ionic strength = .2371051E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1672E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.31233E-06 -6.5054 0.25960E-06 -6.5857 0.83118E+00 -0.0803 2 H2O 0.99984E+00 -0.0001 0.99984E+00 -0.0001 3 Cl- 0.18435E-02 -2.7344 0.15218E-02 -2.8176 0.82548E+00 -0.0833 4 SO4-- 0.13574E-02 -2.8673 0.67358E-03 -3.1716 0.49624E+00 -0.3043 5 HCO3- 0.14247E-01 -1.8463 0.11780E-01 -1.9288 0.82686E+00 -0.0826 6 HS- 0.33995E-02 -2.4686 0.28067E-02 -2.5518 0.82562E+00 -0.0832 7 Al+++ 0.17687E-16 -16.7523 0.36825E-17 -17.4339 0.20820E+00 -0.6815 8 H4SiO4 0.10243E-02 -2.9896 0.10243E-02 -2.9896 0.10000E+01 0.0000 9 Ca++ 0.17589E-06 -6.7548 0.86551E-07 -7.0627 0.49208E+00 -0.3080 10 Mg++ 0.77722E-10 -10.1095 0.38046E-10 -10.4197 0.48951E+00 -0.3102 11 Fe++ 0.92829E-14 -14.0323 0.45497E-14 -14.3420 0.49012E+00 -0.3097 12 K+ 0.15489E-03 -3.8100 0.12810E-03 -3.8924 0.82708E+00 -0.0825 13 Na+ 0.22189E-01 -1.6539 0.18313E-01 -1.7372 0.82530E+00 -0.0834 14 Mn++ 0.22507E-08 -8.6477 0.11042E-08 -8.9570 0.49059E+00 -0.3093 15 F- 0.11479E-03 -3.9401 0.94533E-04 -4.0244 0.82354E+00 -0.0843 16 HPO4-- 0.11918E-07 -7.9238 0.59151E-08 -8.2280 0.49633E+00 -0.3042 18 HSiO3- 0.44639E-05 -5.3503 0.36848E-05 -5.4336 0.82548E+00 -0.0833 19 Ca(HSiO3)+ 0.87795E-11 -11.0565 0.72631E-11 -11.1389 0.82728E+00 -0.0823 20 Mg(HSiO3)+ 0.48029E-14 -14.3185 0.39734E-14 -14.4008 0.82728E+00 -0.0823 21 NaHSiO3,aq 0.10914E-05 -5.9620 0.10914E-05 -5.9620 0.10000E+01 0.0000 22 AlO+ 0.89843E-11 -11.0465 0.74325E-11 -11.1289 0.82728E+00 -0.0823 23 AlOH+2 0.19562E-13 -13.7086 0.96077E-14 -14.0174 0.49113E+00 -0.3088 24 HAlO2,aq 0.57008E-08 -8.2441 0.57008E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.59008E-07 -7.2291 0.48610E-07 -7.3133 0.82378E+00 -0.0842 26 CH4,aq 0.48076E-07 -7.3181 0.47674E-07 -7.3217 0.99164E+00 -0.0036 27 C2H6,aq 0.16248E-16 -16.7892 0.16112E-16 -16.7928 0.99164E+00 -0.0036 31 CO,aq 0.39599E-11 -11.4023 0.39599E-11 -11.4023 0.10000E+01 0.0000 32 CO2,aq 0.65908E-02 -2.1811 0.65357E-02 -2.1847 0.99164E+00 -0.0036 33 CO3-2 0.80067E-05 -5.0965 0.39637E-05 -5.4019 0.49504E+00 -0.3054 34 CaCO3,aq 0.43016E-08 -8.3664 0.43016E-08 -8.3664 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31460E-07 -7.5022 0.26026E-07 -7.5846 0.82728E+00 -0.0823 36 CaCl+ 0.25765E-09 -9.5890 0.21315E-09 -9.6713 0.82728E+00 -0.0823 37 CaCl2,aq 0.77063E-13 -13.1132 0.77063E-13 -13.1132 0.10000E+01 0.0000 38 CaF+ 0.14440E-09 -9.8404 0.11946E-09 -9.9228 0.82728E+00 -0.0823 39 CaOH+ 0.28718E-10 -10.5419 0.23757E-10 -10.6242 0.82728E+00 -0.0823 40 CaSO4,aq 0.18513E-07 -7.7325 0.18513E-07 -7.7325 0.10000E+01 0.0000 41 HCl,aq 0.72392E-10 -10.1403 0.72392E-10 -10.1403 0.10000E+01 0.0000 45 HF,aq 0.16800E-06 -6.7747 0.16800E-06 -6.7747 0.10000E+01 0.0000 46 HF2- 0.64956E-11 -11.1874 0.53620E-11 -11.2707 0.82548E+00 -0.0833 48 FeCl+ 0.13247E-16 -16.8779 0.10959E-16 -16.9602 0.82728E+00 -0.0823 51 FeF+ 0.26568E-16 -16.5756 0.21979E-16 -16.6580 0.82728E+00 -0.0823 53 FeO,aq 0.26234E-17 -17.5811 0.26234E-17 -17.5811 0.10000E+01 0.0000 54 FeOH+ 0.68948E-15 -15.1615 0.57040E-15 -15.2438 0.82728E+00 -0.0823 55 HFeO2- 0.12807E-18 -18.8926 0.10572E-18 -18.9758 0.82548E+00 -0.0833 56 FeO+ 0.10590E-19 -19.9751 0.87611E-20 -20.0574 0.82728E+00 -0.0823 58 FeO2- 0.32220E-19 -19.4919 0.26597E-19 -19.5752 0.82548E+00 -0.0833 59 HFeO2,aq 0.87814E-18 -18.0564 0.87814E-18 -18.0564 0.10000E+01 0.0000 60 H2,aq 0.24318E-07 -7.6141 0.24115E-07 -7.6177 0.99164E+00 -0.0036 61 KCl,aq 0.35332E-08 -8.4518 0.35332E-08 -8.4518 0.10000E+01 0.0000 62 KHSO4,aq 0.63335E-13 -13.1984 0.63335E-13 -13.1984 0.10000E+01 0.0000 63 KOH,aq 0.21070E-09 -9.6763 0.21070E-09 -9.6763 0.10000E+01 0.0000 64 KSO4- 0.16221E-05 -5.7899 0.13390E-05 -5.8732 0.82548E+00 -0.0833 65 MgCO3,aq 0.47396E-12 -12.3243 0.47396E-12 -12.3243 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14131E-10 -10.8498 0.11690E-10 -10.9322 0.82728E+00 -0.0823 67 MgCl+ 0.10265E-12 -12.9886 0.84921E-13 -13.0710 0.82728E+00 -0.0823 68 MgF+ 0.23513E-12 -12.6287 0.19452E-12 -12.7110 0.82728E+00 -0.0823 69 MgOH+ 0.69853E-13 -13.1558 0.57788E-13 -13.2382 0.82728E+00 -0.0823 71 MnF+ 0.21252E-11 -11.6726 0.17582E-11 -11.7549 0.82728E+00 -0.0823 72 MnO,aq 0.16965E-13 -13.7704 0.16965E-13 -13.7704 0.10000E+01 0.0000 73 MnOH+ 0.15545E-10 -10.8084 0.12860E-10 -10.8908 0.82728E+00 -0.0823 75 HMnO2- 0.57551E-18 -18.2399 0.47507E-18 -18.3232 0.82548E+00 -0.0833 78 MnCl+ 0.12508E-10 -10.9028 0.10347E-10 -10.9852 0.82728E+00 -0.0823 79 MnSO4,aq 0.21472E-09 -9.6681 0.21472E-09 -9.6681 0.10000E+01 0.0000 80 NaCl,aq 0.92356E-05 -5.0345 0.92356E-05 -5.0345 0.10000E+01 0.0000 81 NaF,aq 0.40530E-06 -6.3922 0.40530E-06 -6.3922 0.10000E+01 0.0000 82 NaOH,aq 0.30304E-07 -7.5185 0.30304E-07 -7.5185 0.10000E+01 0.0000 84 OH- 0.27013E-05 -5.5684 0.22253E-05 -5.6526 0.82378E+00 -0.0842 89 HPO3-2 0.89810E-18 -18.0467 0.44460E-18 -18.3520 0.49504E+00 -0.3054 91 H2PO3- 0.28038E-18 -18.5523 0.23145E-18 -18.6355 0.82548E+00 -0.0833 92 H3PO4,aq 0.27881E-11 -11.5547 0.27881E-11 -11.5547 0.10000E+01 0.0000 93 H2PO4- 0.34279E-07 -7.4650 0.28327E-07 -7.5478 0.82637E+00 -0.0828 94 PO4-3 0.84428E-13 -13.0735 0.18590E-13 -13.7307 0.22019E+00 -0.6572 97 H2P2O7-2 0.12712E-15 -15.8958 0.62929E-16 -16.2012 0.49504E+00 -0.3054 98 HP2O7-3 0.23219E-15 -15.6341 0.48403E-16 -16.3151 0.20846E+00 -0.6810 99 P2O7-4 0.69209E-18 -18.1598 0.44542E-19 -19.3512 0.64359E-01 -1.1914 100 H2S,aq 0.22709E-02 -2.6438 0.22519E-02 -2.6475 0.99164E+00 -0.0036 101 S2-2 0.14621E-07 -7.8350 0.72382E-08 -8.1404 0.49504E+00 -0.3054 102 S3-2 0.18395E-08 -8.7353 0.91062E-09 -9.0407 0.49504E+00 -0.3054 103 S3- 0.12362E-08 -8.9079 0.10204E-08 -8.9912 0.82548E+00 -0.0833 104 S4-2 0.15287E-09 -9.8157 0.75677E-10 -10.1210 0.49504E+00 -0.3054 105 S5-2 0.84713E-11 -11.0720 0.41937E-11 -11.3774 0.49504E+00 -0.3054 106 SO2,aq 0.48904E-14 -14.3107 0.48904E-14 -14.3107 0.10000E+01 0.0000 107 SO3-2 0.41954E-11 -11.3772 0.21112E-11 -11.6755 0.50321E+00 -0.2982 108 HSO3- 0.41570E-10 -10.3812 0.34315E-10 -10.4645 0.82548E+00 -0.0833 109 HSO4- 0.20347E-06 -6.6915 0.16852E-06 -6.7734 0.82820E+00 -0.0819 111 S2O3-2 0.35998E-07 -7.4437 0.17821E-07 -7.7491 0.49504E+00 -0.3054 112 HS2O3- 0.10021E-11 -11.9991 0.82719E-12 -12.0824 0.82548E+00 -0.0833 113 H2S2O3,aq 0.34425E-17 -17.4631 0.34425E-17 -17.4631 0.10000E+01 0.0000 Charge balance for all species = -.6104E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3123303E-06 0.8845859E-02 0.8896866E+01 0.0000 2 H2O 0.1000000E+01 0.5550166E+02 0.9977226E+06 0.0000 3 Cl- 0.1843515E-02 0.1852754E-02 0.6554402E+02 3.7680 4 SO4-- 0.1357358E-02 0.1359189E-02 0.1302843E+03 9.9998 5 HCO3- 0.1424717E-01 0.2084605E-01 0.1269224E+04 4.6569 6 HS- 0.3399495E-02 0.5670483E-02 0.1871297E+03 4.0339 7 Al+++ 0.1768695E-16 0.6471819E-07 0.1742428E-02 2.3232 8 H4SiO4 0.1024298E-02 0.1029853E-02 0.9877130E+02 -2.9896 9 Ca++ 0.1758886E-06 0.2306028E-06 0.9222166E-02 6.1087 10 Mg++ 0.7772235E-10 0.9273968E-10 0.2249824E-05 2.7517 11 Fe++ 0.9282863E-14 0.1001583E-13 0.5581480E-09 -1.1706 12 K+ 0.1548878E-03 0.1565136E-03 0.6106795E+01 2.6933 13 Na+ 0.2218931E-01 0.2220008E-01 0.5092746E+03 4.8484 14 Mn++ 0.2250738E-08 0.2495649E-08 0.1368103E-03 4.2144 15 F- 0.1147881E-03 0.1153615E-03 0.2186911E+01 2.5613 16 HPO4-- 0.1191786E-07 0.4619978E-07 0.4424646E-02 4.9434 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7967883E-02 0.7982026E-02 -.1414271E-04 0.0000000E+00 2 H2O 0.5005926E+02 0.5008170E+02 -.2243571E-01 0.0000000E+00 3 Cl- 0.1671825E-02 0.1671825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1226467E-02 0.1226459E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.1881035E-01 0.1881035E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.5116794E-02 0.5116737E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5839820E-07 0.4716954E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9292842E-03 0.1122374E-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 0.9037748E-14 0.3259226E-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- 0.1040960E-03 0.1040960E-03 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: 0.8206E-21 Mass of aqueous solution: 0.904296E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2358E-05 -5.627 0.6089E-03 -3.215 0.9025E-01 0.2343E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5796E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6740 -0.171 99.91 0.2545 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 = 0.674651 g Volume = 0.254781 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: 0.2599900 moles log = -0.5850 Original solution: 1000.0103000 g Original solution / Rock added: 3846.34 (Water/Rock Ratio), log = 3.5850 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.7891 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.5746E+00 0.9783 0.1006E+01 0.1028E+01 CO2,gas 0.3905E+00 1.0010 0.6992E+00 0.6986E+00 CH4,gas 0.3886E-04 1.0092 0.7017E-04 0.6953E-04 H2,gas 0.1768E-04 1.0010 0.3166E-04 0.3163E-04 H2S,gas 0.3484E-01 0.9931 0.6190E-01 0.6233E-01 S2,gas 0.8021E-13 1.0000 0.1435E-12 0.1435E-12 CO,gas 0.3298E-08 1.0000 0.5901E-08 0.5901E-08 SO3,gas 0.9595E-32 1.0000 0.1717E-31 0.1717E-31 SO2,gas 0.1182E-13 1.0000 0.2115E-13 0.2115E-13 HF,gas 0.2306E-09 1.0000 0.4125E-09 0.4125E-09 HCl,gas 0.7140E-13 1.0000 0.1277E-12 0.1277E-12 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 0.75827E-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 0.28967E+04 0.003 2 CO2,gas -6.66 -8.51 -1.85 -0.618 0.31662E+04 -0.155 3 CH4,gas 4.54 -1.31 -5.85 -1.463 0.99935E+04 -4.154 4 H2,gas 8.00 1.80 -6.20 -3.542 0.10584E+05 -4.499 5 H2S,gas -6.23 -9.14 -2.91 -1.454 0.49641E+04 -1.208 6 S2,gas -7.34 -21.88 -14.54 -2.237 0.24830E+05 -12.843 7 CO,gas 3.21 -6.71 -9.93 -3.055 0.16952E+05 -8.229 8 SO3,gas 17.12 -16.34 -33.46 -8.366 0.57139E+05 -31.765 9 SO2,gas 0.83 -14.54 -15.37 -4.100 0.26250E+05 -13.675 10 HF,gas 0.47 -10.61 -11.08 -5.542 0.18925E+05 -9.385 11 HCl,gas 5.19 -9.40 -14.59 -7.296 0.24917E+05 -12.894 16 albite-high 0.69 -1.80 -2.49 -0.192 0.42513E+04 17 albite -0.38 -1.80 -1.41 -0.109 0.24125E+04 21 analcite 3.32 1.19 -2.13 -0.237 0.36357E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57110E+04 25 anhydrite -5.32 -10.23 -4.92 -2.459 0.83966E+04 38 aragonite 0.97 -2.41 -3.37 -1.124 0.57583E+04 40 calcite 0.81 -2.41 -3.22 -1.073 0.54940E+04 41 carnegieite-low 9.02 4.18 -4.84 -0.692 0.82662E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63806E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94015E+03 69 diamond -3.10 -4.91 -1.81 -0.517 0.30894E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.91 -1.37 -0.390 0.23316E+04 94 heulandite -5.83 -10.17 -4.34 -0.197 0.74179E+04 98 jadeite 4.22 1.19 -3.02 -0.302 0.51610E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54969E+04 104 laumontite 2.88 -1.20 -4.09 -0.272 0.69778E+04 105 lawsonite 9.62 4.78 -4.84 -0.323 0.82646E+04 119 microcline -2.49 -3.95 -1.47 -0.113 0.25022E+04 123 muscovite 2.58 0.69 -1.89 -0.111 0.32241E+04 124 paragonite 4.24 2.85 -1.39 -0.082 0.23734E+04 125 nepheline 8.34 4.18 -4.16 -0.594 0.70986E+04 147 pyrrhotiteFe0.875 -6.02 -10.39 -4.37 -1.607 0.74586E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.30 -3.32 -1.108 0.56753E+04 156 sanidine -1.28 -3.95 -2.68 -0.206 0.45700E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61550E+04 166 stilbite -7.52 -10.17 -2.65 -0.126 0.45242E+04 172 sulfur -9.15 -10.94 -1.79 -0.550 0.30503E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.55 -2.90 -0.180 0.49600E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55189E+04 198 beidellite-K -1.52 -4.67 -3.15 -0.193 0.53776E+04 199 beidellite-Mg -1.79 -5.10 -3.31 -0.205 0.56596E+04 200 beidellite-Na -1.34 -3.96 -2.62 -0.160 0.44671E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.34 -3.02 -0.378 0.51648E+04 204 montmorillonite-Ca -2.29 -6.16 -3.87 -0.240 0.66105E+04 205 montmorillonite-K -2.24 -6.28 -4.04 -0.248 0.69062E+04 206 montmorillonite-Mg -2.48 -6.72 -4.24 -0.262 0.72333E+04 207 montmorillonite-Na -2.04 -5.57 -3.53 -0.216 0.60315E+04 214 topaz -16.55 -19.56 -3.02 -0.335 0.51516E+04 234 alabandite -0.98 -4.92 -3.95 -1.315 0.67363E+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 -0.48 -2.50 -0.192 0.42687E+04 248 an25ab75 2.65 -0.15 -2.80 -0.215 0.47797E+04 249 an30ab70 3.28 0.18 -3.10 -0.239 0.53003E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2599900 MOLES New total amount of reactant added: 0.2699900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.2699900 Water: Moles liquid = 0.5010E+02 kg liquid = 0.9025E+00 Moles total = 0.5007E+02 kg total = 0.9020E+00 Activity = 0.9998 Stoichiometric ionic strength = .2878808E-01 Osmotic coef. = 0.9070 True ionic strength = .2375777E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1731E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.35811E-06 -6.4460 0.29761E-06 -6.5264 0.83105E+00 -0.0804 2 H2O 0.99982E+00 -0.0001 0.99982E+00 -0.0001 3 Cl- 0.19082E-02 -2.7194 0.15750E-02 -2.8027 0.82535E+00 -0.0834 4 SO4-- 0.14099E-02 -2.8508 0.69926E-03 -3.1554 0.49596E+00 -0.3046 5 HCO3- 0.14138E-01 -1.8496 0.11688E-01 -1.9322 0.82673E+00 -0.0826 6 HS- 0.33331E-02 -2.4772 0.27514E-02 -2.5604 0.82548E+00 -0.0833 7 Al+++ 0.26684E-16 -16.5737 0.55487E-17 -17.2558 0.20794E+00 -0.6821 8 H4SiO4 0.10243E-02 -2.9896 0.10243E-02 -2.9896 0.10000E+01 0.0000 9 Ca++ 0.17596E-06 -6.7546 0.86536E-07 -7.0628 0.49179E+00 -0.3082 10 Mg++ 0.77858E-10 -10.1087 0.38090E-10 -10.4192 0.48922E+00 -0.3105 11 Fe++ 0.92074E-14 -14.0359 0.45101E-14 -14.3458 0.48984E+00 -0.3099 12 K+ 0.15480E-03 -3.8102 0.12801E-03 -3.8928 0.82695E+00 -0.0825 13 Na+ 0.22185E-01 -1.6539 0.18306E-01 -1.7374 0.82517E+00 -0.0835 14 Mn++ 0.22444E-08 -8.6489 0.11004E-08 -8.9584 0.49030E+00 -0.3095 15 F- 0.11915E-03 -3.9239 0.98111E-04 -4.0083 0.82341E+00 -0.0844 16 HPO4-- 0.10751E-07 -7.9685 0.53331E-08 -8.2730 0.49604E+00 -0.3045 18 HSiO3- 0.38943E-05 -5.4096 0.32141E-05 -5.4929 0.82535E+00 -0.0834 19 Ca(HSiO3)+ 0.76580E-11 -11.1159 0.63343E-11 -11.1983 0.82715E+00 -0.0824 20 Mg(HSiO3)+ 0.41949E-14 -14.3773 0.34698E-14 -14.4597 0.82715E+00 -0.0824 21 NaHSiO3,aq 0.95165E-06 -6.0215 0.95165E-06 -6.0215 0.10000E+01 0.0000 22 AlO+ 0.10302E-10 -10.9871 0.85210E-11 -11.0695 0.82715E+00 -0.0824 23 AlOH+2 0.25726E-13 -13.5896 0.12627E-13 -13.8987 0.49085E+00 -0.3091 24 HAlO2,aq 0.57009E-08 -8.2441 0.57009E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.51481E-07 -7.2884 0.42402E-07 -7.3726 0.82365E+00 -0.0843 26 CH4,aq 0.45051E-07 -7.3463 0.44666E-07 -7.3500 0.99146E+00 -0.0037 27 C2H6,aq 0.14974E-16 -16.8247 0.14846E-16 -16.8284 0.99146E+00 -0.0037 31 CO,aq 0.42911E-11 -11.3674 0.42911E-11 -11.3674 0.10000E+01 0.0000 32 CO2,aq 0.74983E-02 -2.1250 0.74342E-02 -2.1288 0.99146E+00 -0.0037 33 CO3-2 0.69335E-05 -5.1590 0.34304E-05 -5.4647 0.49476E+00 -0.3056 34 CaCO3,aq 0.37223E-08 -8.4292 0.37223E-08 -8.4292 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.31214E-07 -7.5056 0.25819E-07 -7.5881 0.82715E+00 -0.0824 36 CaCl+ 0.26665E-09 -9.5741 0.22056E-09 -9.6565 0.82715E+00 -0.0824 37 CaCl2,aq 0.82529E-13 -13.0834 0.82529E-13 -13.0834 0.10000E+01 0.0000 38 CaF+ 0.14986E-09 -9.8243 0.12396E-09 -9.9067 0.82715E+00 -0.0824 39 CaOH+ 0.25049E-10 -10.6012 0.20719E-10 -10.6836 0.82715E+00 -0.0824 40 CaSO4,aq 0.19215E-07 -7.7164 0.19215E-07 -7.7164 0.10000E+01 0.0000 41 HCl,aq 0.85891E-10 -10.0661 0.85891E-10 -10.0661 0.10000E+01 0.0000 45 HF,aq 0.19989E-06 -6.6992 0.19989E-06 -6.6992 0.10000E+01 0.0000 46 HF2- 0.80224E-11 -11.0957 0.66212E-11 -11.1791 0.82535E+00 -0.0834 48 FeCl+ 0.13593E-16 -16.8667 0.11243E-16 -16.9491 0.82715E+00 -0.0824 51 FeF+ 0.27338E-16 -16.5632 0.22612E-16 -16.6457 0.82715E+00 -0.0824 53 FeO,aq 0.19787E-17 -17.7036 0.19787E-17 -17.7036 0.10000E+01 0.0000 54 FeOH+ 0.59627E-15 -15.2246 0.49321E-15 -15.3070 0.82715E+00 -0.0824 55 HFeO2- 0.84271E-19 -19.0743 0.69553E-19 -19.1577 0.82535E+00 -0.0834 58 FeO2- 0.21721E-19 -19.6631 0.17927E-19 -19.7465 0.82535E+00 -0.0834 59 HFeO2,aq 0.67858E-18 -18.1684 0.67858E-18 -18.1684 0.10000E+01 0.0000 60 H2,aq 0.23171E-07 -7.6351 0.22973E-07 -7.6388 0.99146E+00 -0.0037 61 KCl,aq 0.36540E-08 -8.4372 0.36540E-08 -8.4372 0.10000E+01 0.0000 62 KHSO4,aq 0.75321E-13 -13.1231 0.75321E-13 -13.1231 0.10000E+01 0.0000 63 KOH,aq 0.18366E-09 -9.7360 0.18366E-09 -9.7360 0.10000E+01 0.0000 64 KSO4- 0.16830E-05 -5.7739 0.13890E-05 -5.8573 0.82535E+00 -0.0834 65 MgCO3,aq 0.41067E-12 -12.3865 0.41067E-12 -12.3865 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.14039E-10 -10.8527 0.11612E-10 -10.9351 0.82715E+00 -0.0824 67 MgCl+ 0.10638E-12 -12.9732 0.87990E-13 -13.0556 0.82715E+00 -0.0824 68 MgF+ 0.24435E-12 -12.6120 0.20211E-12 -12.6944 0.82715E+00 -0.0824 69 MgOH+ 0.61010E-13 -13.2146 0.50464E-13 -13.2970 0.82715E+00 -0.0824 71 MnF+ 0.21985E-11 -11.6579 0.18185E-11 -11.7403 0.82715E+00 -0.0824 72 MnO,aq 0.12864E-13 -13.8906 0.12864E-13 -13.8906 0.10000E+01 0.0000 73 MnOH+ 0.13515E-10 -10.8692 0.11179E-10 -10.9516 0.82715E+00 -0.0824 75 HMnO2- 0.38072E-18 -18.4194 0.31423E-18 -18.5028 0.82535E+00 -0.0834 78 MnCl+ 0.12903E-10 -10.8893 0.10673E-10 -10.9717 0.82715E+00 -0.0824 79 MnSO4,aq 0.22215E-09 -9.6534 0.22215E-09 -9.6534 0.10000E+01 0.0000 80 NaCl,aq 0.95550E-05 -5.0198 0.95550E-05 -5.0198 0.10000E+01 0.0000 81 NaF,aq 0.42049E-06 -6.3762 0.42049E-06 -6.3762 0.10000E+01 0.0000 82 NaOH,aq 0.26424E-07 -7.5780 0.26424E-07 -7.5780 0.10000E+01 0.0000 84 OH- 0.23566E-05 -5.6277 0.19410E-05 -5.7120 0.82365E+00 -0.0843 89 HPO3-2 0.77184E-18 -18.1125 0.38188E-18 -18.4181 0.49476E+00 -0.3056 91 H2PO3- 0.27613E-18 -18.5589 0.22790E-18 -18.6422 0.82535E+00 -0.0834 92 H3PO4,aq 0.33037E-11 -11.4810 0.33037E-11 -11.4810 0.10000E+01 0.0000 93 H2PO4- 0.35437E-07 -7.4505 0.29279E-07 -7.5334 0.82624E+00 -0.0829 94 PO4-3 0.66478E-13 -13.1773 0.14621E-13 -13.8350 0.21993E+00 -0.6577 97 H2P2O7-2 0.13589E-15 -15.8668 0.67232E-16 -16.1724 0.49476E+00 -0.3056 98 HP2O7-3 0.21666E-15 -15.6642 0.45108E-16 -16.3457 0.20819E+00 -0.6815 99 P2O7-4 0.56384E-18 -18.2488 0.36209E-19 -19.4412 0.64218E-01 -1.1923 100 H2S,aq 0.25526E-02 -2.5930 0.25308E-02 -2.5967 0.99146E+00 -0.0037 101 S2-2 0.14758E-07 -7.8310 0.73017E-08 -8.1366 0.49476E+00 -0.3056 102 S3-2 0.21903E-08 -8.6595 0.10837E-08 -8.9651 0.49476E+00 -0.3056 103 S3- 0.17282E-08 -8.7624 0.14263E-08 -8.8458 0.82535E+00 -0.0834 104 S4-2 0.21474E-09 -9.6681 0.10625E-09 -9.9737 0.49476E+00 -0.3056 105 S5-2 0.14038E-10 -10.8527 0.69456E-11 -11.1583 0.49476E+00 -0.3056 106 SO2,aq 0.63567E-14 -14.1968 0.63567E-14 -14.1968 0.10000E+01 0.0000 107 SO3-2 0.41515E-11 -11.3818 0.20879E-11 -11.6803 0.50294E+00 -0.2985 108 HSO3- 0.47140E-10 -10.3266 0.38907E-10 -10.4100 0.82535E+00 -0.0834 109 HSO4- 0.24220E-06 -6.6158 0.20056E-06 -6.6978 0.82808E+00 -0.0819 111 S2O3-2 0.42024E-07 -7.3765 0.20792E-07 -7.6821 0.49476E+00 -0.3056 112 HS2O3- 0.13405E-11 -11.8727 0.11064E-11 -11.9561 0.82535E+00 -0.0834 113 H2S2O3,aq 0.52787E-17 -17.2775 0.52787E-17 -17.2775 0.10000E+01 0.0000 Charge balance for all species = -.6103E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3581126E-06 0.1003736E-01 0.1009475E+02 0.0000 2 H2O 0.1000000E+01 0.5550075E+02 0.9976586E+06 0.0000 3 Cl- 0.1908235E-02 0.1917794E-02 0.6784168E+02 3.7236 4 SO4-- 0.1409911E-02 0.1411853E-02 0.1353259E+03 9.8973 5 HCO3- 0.1413810E-01 0.2164340E-01 0.1317708E+04 4.5941 6 HS- 0.3333104E-02 0.5885804E-02 0.1942262E+03 3.9659 7 Al+++ 0.2668413E-16 0.5719230E-07 0.1539732E-02 2.3232 8 H4SiO4 0.1024254E-02 0.1029100E-02 0.9869434E+02 -2.9896 9 Ca++ 0.1759604E-06 0.2305613E-06 0.9220067E-02 5.9899 10 Mg++ 0.7785753E-10 0.9272300E-10 0.2249312E-05 2.6335 11 Fe++ 0.9207448E-14 0.9847423E-14 0.5487367E-09 -1.2931 12 K+ 0.1547986E-03 0.1564854E-03 0.6105405E+01 2.6336 13 Na+ 0.2218513E-01 0.2219608E-01 0.5091587E+03 4.7890 14 Mn++ 0.2244423E-08 0.2495200E-08 0.1367791E-03 4.0943 15 F- 0.1191523E-03 0.1197729E-03 0.2270429E+01 2.5181 16 HPO4-- 0.1075130E-07 0.4619148E-07 0.4423639E-02 4.7797 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.9044633E-02 0.9058796E-02 -.1416306E-04 0.0000000E+00 2 H2O 0.5006745E+02 0.5008989E+02 -.2243672E-01 0.0000000E+00 3 Cl- 0.1730825E-02 0.1730825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1274217E-02 0.1274209E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.1953335E-01 0.1953335E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.5312044E-02 0.5311987E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5161652E-07 0.4723735E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9287715E-03 0.1122425E-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 0.8887381E-14 0.3259226E-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- 0.1080960E-03 0.1080960E-03 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: -.1059E-21 Mass of aqueous solution: 0.904502E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2699900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2362E-05 -5.627 0.6097E-03 -3.215 0.9037E-01 0.2346E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5796E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674683 g Volume = 0.254793 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: 0.2699900 moles log = -0.5687 Original solution: 1000.0103000 g Original solution / Rock added: 3703.88 (Water/Rock Ratio), log = 3.5687 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.8942 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.5432E+00 0.9775 0.1006E+01 0.1029E+01 CO2,gas 0.4198E+00 1.0003 0.7954E+00 0.7951E+00 CH4,gas 0.3440E-04 1.0090 0.6575E-04 0.6516E-04 H2,gas 0.1591E-04 1.0010 0.3016E-04 0.3013E-04 H2S,gas 0.3700E-01 0.9927 0.6957E-01 0.7008E-01 S2,gas 0.1054E-12 1.0000 0.1997E-12 0.1997E-12 CO,gas 0.3376E-08 1.0000 0.6395E-08 0.6395E-08 SO3,gas 0.1237E-31 1.0000 0.2342E-31 0.2342E-31 SO2,gas 0.1451E-13 1.0000 0.2749E-13 0.2749E-13 HF,gas 0.2591E-09 1.0000 0.4908E-09 0.4908E-09 HCl,gas 0.8001E-13 1.0000 0.1516E-12 0.1516E-12 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 0.28967E+04 0.003 2 CO2,gas -6.66 -8.46 -1.80 -0.599 0.30707E+04 -0.099 3 CH4,gas 4.54 -1.34 -5.88 -1.470 0.10042E+05 -4.182 4 H2,gas 8.00 1.78 -6.22 -3.554 0.10620E+05 -4.521 5 H2S,gas -6.23 -9.09 -2.86 -1.428 0.48775E+04 -1.158 6 S2,gas -7.34 -21.73 -14.40 -2.215 0.24585E+05 -12.700 7 CO,gas 3.21 -6.68 -9.89 -3.044 0.16892E+05 -8.194 8 SO3,gas 17.12 -16.21 -33.33 -8.332 0.56909E+05 -31.630 9 SO2,gas 0.83 -14.43 -15.26 -4.069 0.26056E+05 -13.561 10 HF,gas 0.47 -10.53 -11.01 -5.504 0.18796E+05 -9.309 11 HCl,gas 5.19 -9.33 -14.52 -7.259 0.24790E+05 -12.819 16 albite-high 0.69 -1.86 -2.55 -0.196 0.43529E+04 17 albite -0.38 -1.86 -1.47 -0.113 0.25141E+04 21 analcite 3.32 1.13 -2.19 -0.243 0.37373E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57110E+04 25 anhydrite -5.32 -10.22 -4.90 -2.451 0.83689E+04 38 aragonite 0.97 -2.47 -3.44 -1.145 0.58655E+04 40 calcite 0.81 -2.47 -3.28 -1.093 0.56013E+04 41 carnegieite-low 9.02 4.12 -4.90 -0.700 0.83678E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63806E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94015E+03 69 diamond -3.10 -4.90 -1.80 -0.513 0.30658E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.90 -1.35 -0.386 0.23080E+04 94 heulandite -5.83 -10.29 -4.46 -0.203 0.76208E+04 98 jadeite 4.22 1.13 -3.08 -0.308 0.52626E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54969E+04 104 laumontite 2.88 -1.32 -4.21 -0.280 0.71806E+04 105 lawsonite 9.62 4.66 -4.96 -0.331 0.84674E+04 119 microcline -2.49 -4.01 -1.53 -0.117 0.26041E+04 123 muscovite 2.58 0.63 -1.95 -0.115 0.33259E+04 124 paragonite 4.24 2.79 -1.45 -0.085 0.24750E+04 125 nepheline 8.34 4.12 -4.22 -0.602 0.72001E+04 147 pyrrhotiteFe0.875 -6.02 -10.44 -4.42 -1.626 0.75505E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.36 -3.39 -1.129 0.57849E+04 156 sanidine -1.28 -4.01 -2.74 -0.210 0.46719E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61549E+04 166 stilbite -7.52 -10.29 -2.77 -0.132 0.47271E+04 172 sulfur -9.15 -10.87 -1.71 -0.528 0.29278E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.57 -2.92 -0.181 0.49935E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55189E+04 198 beidellite-K -1.52 -4.69 -3.17 -0.194 0.54112E+04 199 beidellite-Mg -1.79 -5.12 -3.33 -0.206 0.56929E+04 200 beidellite-Na -1.34 -3.98 -2.64 -0.161 0.45006E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.35 -3.03 -0.379 0.51708E+04 204 montmorillonite-Ca -2.29 -6.22 -3.93 -0.243 0.67106E+04 205 montmorillonite-K -2.24 -6.34 -4.10 -0.251 0.70064E+04 206 montmorillonite-Mg -2.48 -6.77 -4.29 -0.266 0.73332E+04 207 montmorillonite-Na -2.04 -5.63 -3.59 -0.220 0.61316E+04 214 topaz -16.55 -19.41 -2.87 -0.318 0.48938E+04 234 alabandite -0.98 -4.99 -4.01 -1.338 0.68549E+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 -0.55 -2.57 -0.198 0.43905E+04 248 an25ab75 2.65 -0.23 -2.87 -0.221 0.49066E+04 249 an30ab70 3.28 0.10 -3.18 -0.245 0.54323E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2699900 MOLES New total amount of reactant added: 0.2799900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.2799900 Water: Moles liquid = 0.5011E+02 kg liquid = 0.9027E+00 Moles total = 0.5008E+02 kg total = 0.9021E+00 Activity = 0.9998 Stoichiometric ionic strength = .2943277E-01 Osmotic coef. = 0.9063 True ionic strength = .2380521E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1790E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.40489E-06 -6.3927 0.33643E-06 -6.4731 0.83093E+00 -0.0804 2 H2O 0.99980E+00 -0.0001 0.99980E+00 -0.0001 3 Cl- 0.19729E-02 -2.7049 0.16281E-02 -2.7883 0.82522E+00 -0.0834 4 SO4-- 0.14624E-02 -2.8349 0.72491E-03 -3.1397 0.49568E+00 -0.3048 5 HCO3- 0.14025E-01 -1.8531 0.11593E-01 -1.9358 0.82660E+00 -0.0827 6 HS- 0.32700E-02 -2.4855 0.26989E-02 -2.5688 0.82535E+00 -0.0834 7 Al+++ 0.38600E-16 -16.4134 0.80161E-17 -17.0960 0.20767E+00 -0.6826 8 H4SiO4 0.10242E-02 -2.9896 0.10242E-02 -2.9896 0.10000E+01 0.0000 9 Ca++ 0.17595E-06 -6.7546 0.86479E-07 -7.0631 0.49151E+00 -0.3085 10 Mg++ 0.77983E-10 -10.1080 0.38129E-10 -10.4187 0.48894E+00 -0.3107 11 Fe++ 0.91584E-14 -14.0382 0.44835E-14 -14.3484 0.48955E+00 -0.3102 12 K+ 0.15471E-03 -3.8105 0.12792E-03 -3.8931 0.82682E+00 -0.0826 13 Na+ 0.22181E-01 -1.6540 0.18300E-01 -1.7375 0.82504E+00 -0.0835 14 Mn++ 0.22378E-08 -8.6502 0.10965E-08 -8.9600 0.49001E+00 -0.3098 15 F- 0.12351E-03 -3.9083 0.10169E-03 -3.9927 0.82328E+00 -0.0845 16 HPO4-- 0.97745E-08 -8.0099 0.48458E-08 -8.3146 0.49576E+00 -0.3047 18 HSiO3- 0.34454E-05 -5.4628 0.28432E-05 -5.5462 0.82522E+00 -0.0834 19 Ca(HSiO3)+ 0.67707E-11 -11.1694 0.55995E-11 -11.2519 0.82702E+00 -0.0825 20 Mg(HSiO3)+ 0.37152E-14 -14.4300 0.30725E-14 -14.5125 0.82702E+00 -0.0825 21 NaHSiO3,aq 0.84152E-06 -6.0749 0.84152E-06 -6.0749 0.10000E+01 0.0000 22 AlO+ 0.11648E-10 -10.9338 0.96329E-11 -11.0162 0.82702E+00 -0.0825 23 AlOH+2 0.32896E-13 -13.4829 0.16137E-13 -13.7922 0.49056E+00 -0.3093 24 HAlO2,aq 0.57009E-08 -8.2441 0.57009E-08 -8.2441 0.10000E+01 0.0000 25 AlO2- 0.45548E-07 -7.3415 0.37510E-07 -7.4259 0.82352E+00 -0.0843 26 CH4,aq 0.42287E-07 -7.3738 0.41918E-07 -7.3776 0.99127E+00 -0.0038 27 C2H6,aq 0.13791E-16 -16.8604 0.13671E-16 -16.8642 0.99127E+00 -0.0038 31 CO,aq 0.46022E-11 -11.3370 0.46022E-11 -11.3370 0.10000E+01 0.0000 32 CO2,aq 0.84091E-02 -2.0752 0.83357E-02 -2.0791 0.99127E+00 -0.0038 33 CO3-2 0.60869E-05 -5.2156 0.30099E-05 -5.5215 0.49448E+00 -0.3059 34 CaCO3,aq 0.32637E-08 -8.4863 0.32637E-08 -8.4863 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.30944E-07 -7.5094 0.25591E-07 -7.5919 0.82702E+00 -0.0825 36 CaCl+ 0.27551E-09 -9.5599 0.22785E-09 -9.6423 0.82702E+00 -0.0825 37 CaCl2,aq 0.88133E-13 -13.0549 0.88133E-13 -13.0549 0.10000E+01 0.0000 38 CaF+ 0.15524E-09 -9.8090 0.12839E-09 -9.8915 0.82702E+00 -0.0825 39 CaOH+ 0.22147E-10 -10.6547 0.18316E-10 -10.7372 0.82702E+00 -0.0825 40 CaSO4,aq 0.19907E-07 -7.7010 0.19907E-07 -7.7010 0.10000E+01 0.0000 41 HCl,aq 0.10037E-09 -9.9984 0.10037E-09 -9.9984 0.10000E+01 0.0000 45 HF,aq 0.23419E-06 -6.6304 0.23419E-06 -6.6304 0.10000E+01 0.0000 46 HF2- 0.97431E-11 -11.0113 0.80402E-11 -11.0947 0.82522E+00 -0.0834 48 FeCl+ 0.13971E-16 -16.8548 0.11554E-16 -16.9373 0.82702E+00 -0.0825 51 FeF+ 0.28170E-16 -16.5502 0.23297E-16 -16.6327 0.82702E+00 -0.0825 53 FeO,aq 0.15392E-17 -17.8127 0.15392E-17 -17.8127 0.10000E+01 0.0000 54 FeOH+ 0.52442E-15 -15.2803 0.43370E-15 -15.3628 0.82702E+00 -0.0825 55 HFeO2- 0.57997E-19 -19.2366 0.47860E-19 -19.3200 0.82522E+00 -0.0834 58 FeO2- 0.15285E-19 -19.8157 0.12614E-19 -19.8992 0.82522E+00 -0.0834 59 HFeO2,aq 0.53972E-18 -18.2678 0.53972E-18 -18.2678 0.10000E+01 0.0000 60 H2,aq 0.22167E-07 -7.6543 0.21973E-07 -7.6581 0.99127E+00 -0.0038 61 KCl,aq 0.37746E-08 -8.4231 0.37746E-08 -8.4231 0.10000E+01 0.0000 62 KHSO4,aq 0.88205E-13 -13.0545 0.88205E-13 -13.0545 0.10000E+01 0.0000 63 KOH,aq 0.16234E-09 -9.7896 0.16234E-09 -9.7896 0.10000E+01 0.0000 64 KSO4- 0.17437E-05 -5.7585 0.14389E-05 -5.8420 0.82522E+00 -0.0834 65 MgCO3,aq 0.36069E-12 -12.4429 0.36069E-12 -12.4429 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13941E-10 -10.8557 0.11530E-10 -10.9382 0.82702E+00 -0.0825 67 MgCl+ 0.11010E-12 -12.9582 0.91052E-13 -13.0407 0.82702E+00 -0.0825 68 MgF+ 0.25355E-12 -12.5959 0.20969E-12 -12.6784 0.82702E+00 -0.0825 69 MgOH+ 0.54032E-13 -13.2673 0.44686E-13 -13.3498 0.82702E+00 -0.0825 71 MnF+ 0.22709E-11 -11.6438 0.18781E-11 -11.7263 0.82702E+00 -0.0825 72 MnO,aq 0.10031E-13 -13.9987 0.10031E-13 -13.9987 0.10000E+01 0.0000 73 MnOH+ 0.11915E-10 -10.9239 0.98538E-11 -11.0064 0.82702E+00 -0.0825 75 HMnO2- 0.26264E-18 -18.5806 0.21674E-18 -18.6641 0.82522E+00 -0.0834 78 MnCl+ 0.13293E-10 -10.8764 0.10994E-10 -10.9589 0.82702E+00 -0.0825 79 MnSO4,aq 0.22948E-09 -9.6393 0.22948E-09 -9.6393 0.10000E+01 0.0000 80 NaCl,aq 0.98739E-05 -5.0055 0.98739E-05 -5.0055 0.10000E+01 0.0000 81 NaF,aq 0.43566E-06 -6.3609 0.43566E-06 -6.3609 0.10000E+01 0.0000 82 NaOH,aq 0.23366E-07 -7.6314 0.23366E-07 -7.6314 0.10000E+01 0.0000 84 OH- 0.20850E-05 -5.6809 0.17170E-05 -5.7652 0.82352E+00 -0.0843 89 HPO3-2 0.67119E-18 -18.1732 0.33189E-18 -18.4790 0.49448E+00 -0.3059 91 H2PO3- 0.27133E-18 -18.5665 0.22391E-18 -18.6499 0.82522E+00 -0.0834 92 H3PO4,aq 0.38361E-11 -11.4161 0.38361E-11 -11.4161 0.10000E+01 0.0000 93 H2PO4- 0.36405E-07 -7.4388 0.30074E-07 -7.5218 0.82611E+00 -0.0830 94 PO4-3 0.53497E-13 -13.2717 0.11752E-13 -13.9299 0.21967E+00 -0.6582 97 H2P2O7-2 0.14345E-15 -15.8433 0.70934E-16 -16.1491 0.49448E+00 -0.3059 98 HP2O7-3 0.20248E-15 -15.6936 0.42100E-16 -16.3757 0.20793E+00 -0.6821 99 P2O7-4 0.46655E-18 -18.3311 0.29895E-19 -19.5244 0.64076E-01 -1.1933 100 H2S,aq 0.28310E-02 -2.5481 0.28062E-02 -2.5519 0.99127E+00 -0.0038 101 S2-2 0.14854E-07 -7.8281 0.73451E-08 -8.1340 0.49448E+00 -0.3059 102 S3-2 0.25558E-08 -8.5925 0.12638E-08 -8.8983 0.49448E+00 -0.3059 103 S3- 0.23300E-08 -8.6327 0.19227E-08 -8.7161 0.82522E+00 -0.0834 104 S4-2 0.29049E-09 -9.5369 0.14364E-09 -9.8427 0.49448E+00 -0.3059 105 S5-2 0.22016E-10 -10.6573 0.10886E-10 -10.9631 0.49448E+00 -0.3059 106 SO2,aq 0.80550E-14 -14.0939 0.80550E-14 -14.0939 0.10000E+01 0.0000 107 SO3-2 0.41187E-11 -11.3852 0.20703E-11 -11.6840 0.50266E+00 -0.2987 108 HSO3- 0.52848E-10 -10.2770 0.43611E-10 -10.3604 0.82522E+00 -0.0834 109 HSO4- 0.28387E-06 -6.5469 0.23503E-06 -6.6289 0.82795E+00 -0.0820 111 S2O3-2 0.48336E-07 -7.3157 0.23901E-07 -7.6216 0.49448E+00 -0.3059 112 HS2O3- 0.17423E-11 -11.7589 0.14378E-11 -11.8423 0.82522E+00 -0.0834 113 H2S2O3,aq 0.77545E-17 -17.1104 0.77545E-17 -17.1104 0.10000E+01 0.0000 Charge balance for all species = -.6101E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4048880E-06 0.1122842E-01 0.1129208E+02 0.0000 2 H2O 0.1000000E+01 0.5549984E+02 0.9975946E+06 0.0000 3 Cl- 0.1972933E-02 0.1982811E-02 0.7013829E+02 3.6848 4 SO4-- 0.1462443E-02 0.1464498E-02 0.1403652E+03 9.8065 5 HCO3- 0.1402517E-01 0.2244046E-01 0.1366171E+04 4.5373 6 HS- 0.3269960E-02 0.6101049E-02 0.2013195E+03 3.9043 7 Al+++ 0.3859964E-16 0.5126094E-07 0.1379982E-02 2.3233 8 H4SiO4 0.1024210E-02 0.1028497E-02 0.9863181E+02 -2.9896 9 Ca++ 0.1759456E-06 0.2305199E-06 0.9217969E-02 5.8831 10 Mg++ 0.7798325E-10 0.9270633E-10 0.2248800E-05 2.5275 11 Fe++ 0.9158400E-14 0.9727120E-14 0.5420071E-09 -1.4022 12 K+ 0.1547097E-03 0.1564573E-03 0.6104016E+01 2.5800 13 Na+ 0.2218092E-01 0.2219209E-01 0.5090428E+03 4.7356 14 Mn++ 0.2237784E-08 0.2494752E-08 0.1367480E-03 3.9862 15 F- 0.1235126E-03 0.1241826E-03 0.2353908E+01 2.4804 16 HPO4-- 0.9774454E-08 0.4618317E-07 0.4422632E-02 4.6316 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1012138E-01 0.1013556E-01 -.1417909E-04 0.0000000E+00 2 H2O 0.5007564E+02 0.5009807E+02 -.2243746E-01 0.0000000E+00 3 Cl- 0.1789825E-02 0.1789825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1321967E-02 0.1321959E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2025635E-01 0.2025635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.5507294E-02 0.5507237E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4627175E-07 0.4729080E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9283944E-03 0.1122463E-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 0.8780385E-14 0.3259226E-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- 0.1120960E-03 0.1120960E-03 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: -.9661E-21 Mass of aqueous solution: 0.904708E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2365E-05 -5.626 0.6104E-03 -3.214 0.9047E-01 0.2349E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5796E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674706 g Volume = 0.254802 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: 0.2799900 moles log = -0.5529 Original solution: 1000.0103000 g Original solution / Rock added: 3571.59 (Water/Rock Ratio), log = 3.5529 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.9996 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.5149E+00 0.9768 0.1006E+01 0.1030E+01 CO2,gas 0.4461E+00 0.9997 0.8918E+00 0.8921E+00 CH4,gas 0.3059E-04 1.0087 0.6170E-04 0.6117E-04 H2,gas 0.1441E-04 1.0011 0.2885E-04 0.2882E-04 H2S,gas 0.3888E-01 0.9923 0.7714E-01 0.7774E-01 S2,gas 0.1342E-12 1.0000 0.2684E-12 0.2684E-12 CO,gas 0.3430E-08 1.0000 0.6858E-08 0.6858E-08 SO3,gas 0.1552E-31 1.0000 0.3103E-31 0.3103E-31 SO2,gas 0.1742E-13 1.0000 0.3483E-13 0.3483E-13 HF,gas 0.2876E-09 1.0000 0.5750E-09 0.5750E-09 HCl,gas 0.8857E-13 1.0000 0.1771E-12 0.1771E-12 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 0.28967E+04 0.002 2 CO2,gas -6.66 -8.41 -1.75 -0.583 0.29858E+04 -0.050 3 CH4,gas 4.54 -1.36 -5.91 -1.477 0.10089E+05 -4.210 4 H2,gas 8.00 1.76 -6.24 -3.565 0.10653E+05 -4.540 5 H2S,gas -6.23 -9.04 -2.81 -1.406 0.48009E+04 -1.113 6 S2,gas -7.34 -21.61 -14.27 -2.195 0.24366E+05 -12.571 7 CO,gas 3.21 -6.65 -9.86 -3.035 0.16840E+05 -8.164 8 SO3,gas 17.12 -16.09 -33.21 -8.302 0.56700E+05 -31.508 9 SO2,gas 0.83 -14.32 -15.16 -4.042 0.25880E+05 -13.458 10 HF,gas 0.47 -10.47 -10.94 -5.470 0.18679E+05 -9.240 11 HCl,gas 5.19 -9.26 -14.45 -7.225 0.24674E+05 -12.752 16 albite-high 0.69 -1.91 -2.60 -0.200 0.44441E+04 17 albite -0.38 -1.91 -1.53 -0.117 0.26052E+04 21 analcite 3.32 1.08 -2.24 -0.249 0.38284E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57110E+04 25 anhydrite -5.32 -10.20 -4.89 -2.443 0.83427E+04 38 aragonite 0.97 -2.53 -3.49 -1.164 0.59630E+04 40 calcite 0.81 -2.53 -3.34 -1.113 0.56988E+04 41 carnegieite-low 9.02 4.07 -4.95 -0.708 0.84590E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63806E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94014E+03 69 diamond -3.10 -4.89 -1.78 -0.510 0.30469E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.89 -1.34 -0.383 0.22891E+04 94 heulandite -5.83 -10.40 -4.57 -0.208 0.78032E+04 98 jadeite 4.22 1.08 -3.14 -0.314 0.53538E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54969E+04 104 laumontite 2.88 -1.43 -4.31 -0.287 0.73630E+04 119 microcline -2.49 -4.07 -1.58 -0.121 0.26956E+04 123 muscovite 2.58 0.58 -2.00 -0.118 0.34174E+04 124 paragonite 4.24 2.74 -1.50 -0.088 0.25662E+04 125 nepheline 8.34 4.07 -4.27 -0.610 0.72913E+04 147 pyrrhotiteFe0.875 -6.02 -10.49 -4.47 -1.644 0.76328E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.42 -3.45 -1.149 0.58845E+04 156 sanidine -1.28 -4.07 -2.79 -0.215 0.47633E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61549E+04 166 stilbite -7.52 -10.40 -2.88 -0.137 0.49095E+04 172 sulfur -9.15 -10.80 -1.65 -0.508 0.28182E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.59 -2.94 -0.182 0.50236E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55189E+04 198 beidellite-K -1.52 -4.71 -3.19 -0.195 0.54413E+04 199 beidellite-Mg -1.79 -5.14 -3.35 -0.207 0.57228E+04 200 beidellite-Na -1.34 -4.00 -2.65 -0.162 0.45307E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.35 -3.03 -0.379 0.51772E+04 204 montmorillonite-Ca -2.29 -6.27 -3.98 -0.246 0.68004E+04 205 montmorillonite-K -2.24 -6.39 -4.16 -0.255 0.70963E+04 206 montmorillonite-Mg -2.48 -6.83 -4.35 -0.269 0.74228E+04 207 montmorillonite-Na -2.04 -5.68 -3.64 -0.223 0.62214E+04 214 topaz -16.55 -19.27 -2.73 -0.303 0.46589E+04 234 alabandite -0.98 -5.06 -4.08 -1.359 0.69628E+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 -0.62 -2.64 -0.203 0.44999E+04 248 an25ab75 2.65 -0.29 -2.94 -0.226 0.50205E+04 249 an30ab70 3.28 0.03 -3.25 -0.250 0.55508E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2799900 MOLES New total amount of reactant added: 0.2899900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.2899900 Water: Moles liquid = 0.5011E+02 kg liquid = 0.9028E+00 Moles total = 0.5008E+02 kg total = 0.9023E+00 Activity = 0.9998 Stoichiometric ionic strength = .3007726E-01 Osmotic coef. = 0.9055 True ionic strength = .2385276E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1849E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.45268E-06 -6.3442 0.37609E-06 -6.4247 0.83080E+00 -0.0805 2 H2O 0.99978E+00 -0.0001 0.99978E+00 -0.0001 3 Cl- 0.20376E-02 -2.6909 0.16812E-02 -2.7744 0.82508E+00 -0.0835 4 SO4-- 0.15150E-02 -2.8196 0.75051E-03 -3.1246 0.49540E+00 -0.3050 5 HCO3- 0.13909E-01 -1.8567 0.11495E-01 -1.9395 0.82647E+00 -0.0828 6 HS- 0.32097E-02 -2.4935 0.26487E-02 -2.5770 0.82522E+00 -0.0834 7 Al+++ 0.53992E-16 -16.2677 0.11198E-16 -16.9508 0.20741E+00 -0.6832 8 H4SiO4 0.10242E-02 -2.9896 0.10242E-02 -2.9896 0.10000E+01 0.0000 9 Ca++ 0.17587E-06 -6.7548 0.86391E-07 -7.0635 0.49122E+00 -0.3087 10 Mg++ 0.78103E-10 -10.1073 0.38165E-10 -10.4183 0.48865E+00 -0.3110 11 Fe++ 0.91297E-14 -14.0395 0.44668E-14 -14.3500 0.48926E+00 -0.3105 12 K+ 0.15462E-03 -3.8107 0.12782E-03 -3.8934 0.82669E+00 -0.0827 13 Na+ 0.22177E-01 -1.6541 0.18294E-01 -1.7377 0.82491E+00 -0.0836 14 Mn++ 0.22309E-08 -8.6515 0.10925E-08 -8.9616 0.48973E+00 -0.3100 15 F- 0.12787E-03 -3.8932 0.10525E-03 -3.9778 0.82314E+00 -0.0845 16 HPO4-- 0.89447E-08 -8.0484 0.44319E-08 -8.3534 0.49548E+00 -0.3050 18 HSiO3- 0.30825E-05 -5.5111 0.25434E-05 -5.5946 0.82508E+00 -0.0835 19 Ca(HSiO3)+ 0.60515E-11 -11.2181 0.50039E-11 -11.3007 0.82689E+00 -0.0826 20 Mg(HSiO3)+ 0.33270E-14 -14.4779 0.27511E-14 -14.5605 0.82689E+00 -0.0826 21 NaHSiO3,aq 0.75251E-06 -6.1235 0.75251E-06 -6.1235 0.10000E+01 0.0000 22 AlO+ 0.13023E-10 -10.8853 0.10769E-10 -10.9678 0.82689E+00 -0.0826 23 AlOH+2 0.41132E-13 -13.3858 0.20166E-13 -13.6954 0.49027E+00 -0.3096 24 HAlO2,aq 0.57010E-08 -8.2440 0.57010E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.40753E-07 -7.3898 0.33555E-07 -7.4742 0.82338E+00 -0.0844 26 CH4,aq 0.39754E-07 -7.4006 0.39400E-07 -7.4045 0.99109E+00 -0.0039 27 C2H6,aq 0.12699E-16 -16.8962 0.12586E-16 -16.9001 0.99109E+00 -0.0039 31 CO,aq 0.48953E-11 -11.3102 0.48953E-11 -11.3102 0.10000E+01 0.0000 32 CO2,aq 0.93228E-02 -2.0305 0.92398E-02 -2.0343 0.99109E+00 -0.0039 33 CO3-2 0.54023E-05 -5.2674 0.26698E-05 -5.5735 0.49420E+00 -0.3061 34 CaCO3,aq 0.28920E-08 -8.5388 0.28920E-08 -8.5388 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.30657E-07 -7.5135 0.25350E-07 -7.5960 0.82689E+00 -0.0826 36 CaCl+ 0.28425E-09 -9.5463 0.23505E-09 -9.6288 0.82689E+00 -0.0826 37 CaCl2,aq 0.93881E-13 -13.0274 0.93881E-13 -13.0274 0.10000E+01 0.0000 38 CaF+ 0.16055E-09 -9.7944 0.13276E-09 -9.8769 0.82689E+00 -0.0826 39 CaOH+ 0.19794E-10 -10.7035 0.16368E-10 -10.7860 0.82689E+00 -0.0826 40 CaSO4,aq 0.20589E-07 -7.6864 0.20589E-07 -7.6864 0.10000E+01 0.0000 41 HCl,aq 0.11586E-09 -9.9361 0.11586E-09 -9.9361 0.10000E+01 0.0000 45 HF,aq 0.27098E-06 -6.5671 0.27098E-06 -6.5671 0.10000E+01 0.0000 46 HF2- 0.11671E-10 -10.9329 0.96298E-11 -11.0164 0.82508E+00 -0.0835 48 FeCl+ 0.14375E-16 -16.8424 0.11886E-16 -16.9249 0.82689E+00 -0.0826 51 FeF+ 0.29055E-16 -16.5368 0.24026E-16 -16.6193 0.82689E+00 -0.0826 53 FeO,aq 0.12271E-17 -17.9111 0.12271E-17 -17.9111 0.10000E+01 0.0000 54 FeOH+ 0.46745E-15 -15.3303 0.38653E-15 -15.4128 0.82689E+00 -0.0826 55 HFeO2- 0.41369E-19 -19.3833 0.34133E-19 -19.4668 0.82508E+00 -0.0835 58 FeO2- 0.11130E-19 -19.9535 0.91831E-20 -20.0370 0.82508E+00 -0.0835 59 HFeO2,aq 0.43925E-18 -18.3573 0.43925E-18 -18.3573 0.10000E+01 0.0000 60 H2,aq 0.21275E-07 -7.6721 0.21086E-07 -7.6760 0.99109E+00 -0.0039 61 KCl,aq 0.38948E-08 -8.4095 0.38948E-08 -8.4095 0.10000E+01 0.0000 62 KHSO4,aq 0.10201E-12 -12.9914 0.10201E-12 -12.9914 0.10000E+01 0.0000 63 KOH,aq 0.14511E-09 -9.8383 0.14511E-09 -9.8383 0.10000E+01 0.0000 64 KSO4- 0.18042E-05 -5.7437 0.14886E-05 -5.8272 0.82508E+00 -0.0835 65 MgCO3,aq 0.32024E-12 -12.4945 0.32024E-12 -12.4945 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13838E-10 -10.8589 0.11443E-10 -10.9415 0.82689E+00 -0.0826 67 MgCl+ 0.11381E-12 -12.9438 0.94110E-13 -13.0264 0.82689E+00 -0.0826 68 MgF+ 0.26273E-12 -12.5805 0.21725E-12 -12.6630 0.82689E+00 -0.0826 69 MgOH+ 0.48387E-13 -13.3153 0.40011E-13 -13.3978 0.82689E+00 -0.0826 71 MnF+ 0.23424E-11 -11.6303 0.19369E-11 -11.7129 0.82689E+00 -0.0826 72 MnO,aq 0.79976E-14 -14.0970 0.79976E-14 -14.0970 0.10000E+01 0.0000 73 MnOH+ 0.10621E-10 -10.9738 0.87825E-11 -11.0564 0.82689E+00 -0.0826 75 HMnO2- 0.18735E-18 -18.7273 0.15458E-18 -18.8108 0.82508E+00 -0.0835 78 MnCl+ 0.13679E-10 -10.8640 0.11311E-10 -10.9465 0.82689E+00 -0.0826 79 MnSO4,aq 0.23672E-09 -9.6258 0.23672E-09 -9.6258 0.10000E+01 0.0000 80 NaCl,aq 0.10192E-04 -4.9917 0.10192E-04 -4.9917 0.10000E+01 0.0000 81 NaF,aq 0.45079E-06 -6.3460 0.45079E-06 -6.3460 0.10000E+01 0.0000 82 NaOH,aq 0.20894E-07 -7.6800 0.20894E-07 -7.6800 0.10000E+01 0.0000 84 OH- 0.18654E-05 -5.7292 0.15359E-05 -5.8136 0.82338E+00 -0.0844 89 HPO3-2 0.58941E-18 -18.2296 0.29129E-18 -18.5357 0.49420E+00 -0.3061 91 H2PO3- 0.26625E-18 -18.5747 0.21968E-18 -18.6582 0.82508E+00 -0.0835 92 H3PO4,aq 0.43842E-11 -11.3581 0.43842E-11 -11.3581 0.10000E+01 0.0000 93 H2PO4- 0.37226E-07 -7.4292 0.30748E-07 -7.5122 0.82598E+00 -0.0830 94 PO4-3 0.43821E-13 -13.3583 0.96148E-14 -14.0171 0.21941E+00 -0.6587 96 H3P2O7- 0.10429E-19 -19.9818 0.86047E-20 -20.0653 0.82508E+00 -0.0835 97 H2P2O7-2 0.15004E-15 -15.8238 0.74147E-16 -16.1299 0.49420E+00 -0.3061 98 HP2O7-3 0.18957E-15 -15.7222 0.39367E-16 -16.4049 0.20766E+00 -0.6826 99 P2O7-4 0.39113E-18 -18.4077 0.25007E-19 -19.6019 0.63935E-01 -1.1943 100 H2S,aq 0.31064E-02 -2.5077 0.30787E-02 -2.5116 0.99109E+00 -0.0039 101 S2-2 0.14918E-07 -7.8263 0.73725E-08 -8.1324 0.49420E+00 -0.3061 102 S3-2 0.29346E-08 -8.5324 0.14503E-08 -8.8385 0.49420E+00 -0.3061 103 S3- 0.30516E-08 -8.5155 0.25178E-08 -8.5990 0.82508E+00 -0.0835 104 S4-2 0.38134E-09 -9.4187 0.18846E-09 -9.7248 0.49420E+00 -0.3061 105 S5-2 0.33042E-10 -10.4809 0.16329E-10 -10.7870 0.49420E+00 -0.3061 106 SO2,aq 0.10001E-13 -14.0000 0.10001E-13 -14.0000 0.10000E+01 0.0000 107 SO3-2 0.40942E-11 -11.3878 0.20569E-11 -11.6868 0.50239E+00 -0.2990 108 HSO3- 0.58703E-10 -10.2313 0.48435E-10 -10.3148 0.82508E+00 -0.0835 109 HSO4- 0.32859E-06 -6.4833 0.27201E-06 -6.5654 0.82782E+00 -0.0821 111 S2O3-2 0.54934E-07 -7.2602 0.27148E-07 -7.5663 0.49420E+00 -0.3061 112 HS2O3- 0.22126E-11 -11.6551 0.18256E-11 -11.7386 0.82508E+00 -0.0835 113 H2S2O3,aq 0.11007E-16 -16.9583 0.11007E-16 -16.9583 0.10000E+01 0.0000 Charge balance for all species = -.6100E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4526774E-06 0.1241905E-01 0.1248887E+02 0.0000 2 H2O 0.1000000E+01 0.5549893E+02 0.9975306E+06 0.0000 3 Cl- 0.2037608E-02 0.2047804E-02 0.7243385E+02 3.6503 4 SO4-- 0.1514952E-02 0.1517123E-02 0.1454022E+03 9.7248 5 HCO3- 0.1390894E-01 0.2323724E-01 0.1414611E+04 4.4852 6 HS- 0.3209696E-02 0.6316215E-02 0.2084095E+03 3.8477 7 Al+++ 0.5399203E-16 0.4646697E-07 0.1250865E-02 2.3233 8 H4SiO4 0.1024167E-02 0.1028002E-02 0.9857957E+02 -2.9896 9 Ca++ 0.1758701E-06 0.2304784E-06 0.9215871E-02 5.7859 10 Mg++ 0.7810268E-10 0.9268966E-10 0.2248289E-05 2.4311 11 Fe++ 0.9129740E-14 0.9642342E-14 0.5372576E-09 -1.5006 12 K+ 0.1546209E-03 0.1564292E-03 0.6102627E+01 2.5313 13 Na+ 0.2217668E-01 0.2218810E-01 0.5089270E+03 4.6870 14 Mn++ 0.2230935E-08 0.2494303E-08 0.1367169E-03 3.8879 15 F- 0.1278688E-03 0.1285908E-03 0.2437350E+01 2.4470 16 HPO4-- 0.8944700E-08 0.4617486E-07 0.4421626E-02 4.4960 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1119813E-01 0.1121233E-01 -.1419205E-04 0.0000000E+00 2 H2O 0.5008382E+02 0.5010626E+02 -.2243801E-01 0.0000000E+00 3 Cl- 0.1848825E-02 0.1848825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1369717E-02 0.1369709E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2097935E-01 0.2097935E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.5702544E-02 0.5702487E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4195191E-07 0.4733400E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9281138E-03 0.1122491E-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 0.8705425E-14 0.3259226E-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- 0.1160960E-03 0.1160960E-03 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-21 Mass of aqueous solution: 0.904914E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2899900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2367E-05 -5.626 0.6110E-03 -3.214 0.9055E-01 0.2351E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5796E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674723 g Volume = 0.254808 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: 0.2899900 moles log = -0.5376 Original solution: 1000.0103000 g Original solution / Rock added: 3448.43 (Water/Rock Ratio), log = 3.5376 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.1052 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4895E+00 0.9761 0.1006E+01 0.1030E+01 CO2,gas 0.4700E+00 0.9992 0.9886E+00 0.9894E+00 CH4,gas 0.2731E-04 1.0085 0.5799E-04 0.5750E-04 H2,gas 0.1314E-04 1.0011 0.2768E-04 0.2765E-04 H2S,gas 0.4053E-01 0.9918 0.8463E-01 0.8533E-01 S2,gas 0.1667E-12 1.0000 0.3508E-12 0.3508E-12 CO,gas 0.3465E-08 1.0000 0.7295E-08 0.7295E-08 SO3,gas 0.1907E-31 1.0000 0.4015E-31 0.4015E-31 SO2,gas 0.2054E-13 1.0000 0.4325E-13 0.4325E-13 HF,gas 0.3161E-09 1.0000 0.6654E-09 0.6654E-09 HCl,gas 0.9711E-13 1.0000 0.2044E-12 0.2044E-12 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 0.28967E+04 0.002 2 CO2,gas -6.66 -8.36 -1.70 -0.568 0.29095E+04 -0.005 3 CH4,gas 4.54 -1.39 -5.94 -1.484 0.10135E+05 -4.237 4 H2,gas 8.00 1.74 -6.26 -3.575 0.10683E+05 -4.558 5 H2S,gas -6.23 -9.00 -2.77 -1.386 0.47322E+04 -1.072 6 S2,gas -7.34 -21.49 -14.15 -2.178 0.24167E+05 -12.455 7 CO,gas 3.21 -6.62 -9.84 -3.026 0.16795E+05 -8.137 8 SO3,gas 17.12 -15.97 -33.10 -8.274 0.56509E+05 -31.396 9 SO2,gas 0.83 -14.23 -15.06 -4.017 0.25720E+05 -13.364 10 HF,gas 0.47 -10.40 -10.88 -5.438 0.18570E+05 -9.177 11 HCl,gas 5.19 -9.20 -14.39 -7.194 0.24568E+05 -12.689 16 albite-high 0.69 -1.96 -2.65 -0.204 0.45269E+04 17 albite -0.38 -1.96 -1.57 -0.121 0.26881E+04 21 analcite 3.32 1.03 -2.29 -0.255 0.39113E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57109E+04 25 anhydrite -5.32 -10.19 -4.87 -2.436 0.83177E+04 38 aragonite 0.97 -2.58 -3.54 -1.182 0.60527E+04 40 calcite 0.81 -2.58 -3.39 -1.130 0.57885E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63805E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94013E+03 69 diamond -3.10 -4.88 -1.78 -0.507 0.30316E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29988E+04 89 graphite -3.55 -4.88 -1.33 -0.380 0.22739E+04 94 heulandite -5.83 -10.49 -4.67 -0.212 0.79693E+04 98 jadeite 4.22 1.03 -3.18 -0.318 0.54367E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54968E+04 104 laumontite 2.88 -1.53 -4.41 -0.294 0.75290E+04 119 microcline -2.49 -4.11 -1.63 -0.125 0.27787E+04 123 muscovite 2.58 0.53 -2.05 -0.121 0.35005E+04 124 paragonite 4.24 2.69 -1.55 -0.091 0.26490E+04 125 nepheline 8.34 4.02 -4.32 -0.617 0.73742E+04 147 pyrrhotiteFe0.875 -6.02 -10.53 -4.51 -1.660 0.77073E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19393E+04 154 rhodochrosite -0.98 -4.48 -3.50 -1.167 0.59762E+04 156 sanidine -1.28 -4.11 -2.84 -0.218 0.48465E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61549E+04 166 stilbite -7.52 -10.49 -2.97 -0.142 0.50756E+04 172 sulfur -9.15 -10.74 -1.59 -0.490 0.27189E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.60 -2.96 -0.183 0.50509E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55188E+04 198 beidellite-K -1.52 -4.72 -3.20 -0.196 0.54688E+04 199 beidellite-Mg -1.79 -5.16 -3.37 -0.208 0.57499E+04 200 beidellite-Na -1.34 -4.01 -2.67 -0.163 0.45580E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.35 -3.04 -0.379 0.51837E+04 204 montmorillonite-Ca -2.29 -6.32 -4.03 -0.249 0.68821E+04 205 montmorillonite-K -2.24 -6.44 -4.20 -0.257 0.71781E+04 206 montmorillonite-Mg -2.48 -6.87 -4.39 -0.272 0.75043E+04 207 montmorillonite-Na -2.04 -5.73 -3.69 -0.226 0.63031E+04 214 topaz -16.55 -19.15 -2.60 -0.289 0.44424E+04 234 alabandite -0.98 -5.11 -4.14 -1.379 0.70620E+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 -0.68 -2.69 -0.207 0.45994E+04 248 an25ab75 2.65 -0.36 -3.00 -0.231 0.51242E+04 249 an30ab70 3.28 -0.03 -3.31 -0.255 0.56586E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2899900 MOLES New total amount of reactant added: 0.2999900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.2999900 Water: Moles liquid = 0.5012E+02 kg liquid = 0.9030E+00 Moles total = 0.5009E+02 kg total = 0.9024E+00 Activity = 0.9998 Stoichiometric ionic strength = .3072153E-01 Osmotic coef. = 0.9048 True ionic strength = .2390040E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1908E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.50150E-06 -6.2997 0.41659E-06 -6.3803 0.83068E+00 -0.0806 2 H2O 0.99975E+00 -0.0001 0.99975E+00 -0.0001 3 Cl- 0.21023E-02 -2.6773 0.17343E-02 -2.7609 0.82495E+00 -0.0836 4 SO4-- 0.15674E-02 -2.8048 0.77607E-03 -3.1101 0.49512E+00 -0.3053 5 HCO3- 0.13790E-01 -1.8604 0.11395E-01 -1.9433 0.82634E+00 -0.0828 6 HS- 0.31520E-02 -2.5014 0.26007E-02 -2.5849 0.82509E+00 -0.0835 7 Al+++ 0.73481E-16 -16.1338 0.15221E-16 -16.8176 0.20714E+00 -0.6837 8 H4SiO4 0.10241E-02 -2.9896 0.10241E-02 -2.9896 0.10000E+01 0.0000 9 Ca++ 0.17575E-06 -6.7551 0.86283E-07 -7.0641 0.49094E+00 -0.3090 10 Mg++ 0.78218E-10 -10.1067 0.38198E-10 -10.4180 0.48836E+00 -0.3113 11 Fe++ 0.91174E-14 -14.0401 0.44582E-14 -14.3508 0.48897E+00 -0.3107 12 K+ 0.15453E-03 -3.8110 0.12773E-03 -3.8937 0.82656E+00 -0.0827 13 Na+ 0.22172E-01 -1.6542 0.18287E-01 -1.7379 0.82477E+00 -0.0837 14 Mn++ 0.22240E-08 -8.6529 0.10885E-08 -8.9632 0.48944E+00 -0.3103 15 F- 0.13222E-03 -3.8787 0.10882E-03 -3.9633 0.82301E+00 -0.0846 16 HPO4-- 0.82312E-08 -8.0845 0.40761E-08 -8.3898 0.49520E+00 -0.3052 18 HSiO3- 0.27832E-05 -5.5555 0.22960E-05 -5.6390 0.82495E+00 -0.0836 19 Ca(HSiO3)+ 0.54570E-11 -11.2630 0.45116E-11 -11.3457 0.82676E+00 -0.0826 20 Mg(HSiO3)+ 0.30066E-14 -14.5219 0.24857E-14 -14.6045 0.82676E+00 -0.0826 21 NaHSiO3,aq 0.67910E-06 -6.1681 0.67910E-06 -6.1681 0.10000E+01 0.0000 22 AlO+ 0.14428E-10 -10.8408 0.11929E-10 -10.9234 0.82676E+00 -0.0826 23 AlOH+2 0.50500E-13 -13.2967 0.24745E-13 -13.6065 0.48999E+00 -0.3098 24 HAlO2,aq 0.57011E-08 -8.2440 0.57011E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.36797E-07 -7.4342 0.30293E-07 -7.5187 0.82325E+00 -0.0845 26 CH4,aq 0.37424E-07 -7.4268 0.37084E-07 -7.4308 0.99091E+00 -0.0040 27 C2H6,aq 0.11694E-16 -16.9320 0.11588E-16 -16.9360 0.99091E+00 -0.0040 31 CO,aq 0.51722E-11 -11.2863 0.51722E-11 -11.2863 0.10000E+01 0.0000 32 CO2,aq 0.10239E-01 -1.9897 0.10146E-01 -1.9937 0.99091E+00 -0.0040 33 CO3-2 0.48373E-05 -5.3154 0.23892E-05 -5.6217 0.49391E+00 -0.3063 34 CaCO3,aq 0.25848E-08 -8.5876 0.25848E-08 -8.5876 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.30356E-07 -7.5178 0.25097E-07 -7.6004 0.82676E+00 -0.0826 36 CaCl+ 0.29290E-09 -9.5333 0.24216E-09 -9.6159 0.82676E+00 -0.0826 37 CaCl2,aq 0.99775E-13 -13.0010 0.99775E-13 -13.0010 0.10000E+01 0.0000 38 CaF+ 0.16581E-09 -9.7804 0.13708E-09 -9.8630 0.82676E+00 -0.0826 39 CaOH+ 0.17850E-10 -10.7484 0.14757E-10 -10.8310 0.82676E+00 -0.0826 40 CaSO4,aq 0.21263E-07 -7.6724 0.21263E-07 -7.6724 0.10000E+01 0.0000 41 HCl,aq 0.13239E-09 -9.8781 0.13239E-09 -9.8781 0.10000E+01 0.0000 45 HF,aq 0.31034E-06 -6.5082 0.31034E-06 -6.5082 0.10000E+01 0.0000 46 HF2- 0.13821E-10 -10.8595 0.11402E-10 -10.9430 0.82495E+00 -0.0836 48 FeCl+ 0.14802E-16 -16.8297 0.12238E-16 -16.9123 0.82676E+00 -0.0826 51 FeF+ 0.29986E-16 -16.5231 0.24791E-16 -16.6057 0.82676E+00 -0.0826 53 FeO,aq 0.99815E-18 -18.0008 0.99815E-18 -18.0008 0.10000E+01 0.0000 54 FeOH+ 0.42123E-15 -15.3755 0.34826E-15 -15.4581 0.82676E+00 -0.0826 55 HFeO2- 0.30382E-19 -19.5174 0.25064E-19 -19.6010 0.82495E+00 -0.0836 59 HFeO2,aq 0.36423E-18 -18.4386 0.36423E-18 -18.4386 0.10000E+01 0.0000 60 H2,aq 0.20474E-07 -7.6888 0.20288E-07 -7.6928 0.99091E+00 -0.0040 61 KCl,aq 0.40148E-08 -8.3963 0.40148E-08 -8.3963 0.10000E+01 0.0000 62 KHSO4,aq 0.11676E-12 -12.9327 0.11676E-12 -12.9327 0.10000E+01 0.0000 63 KOH,aq 0.13091E-09 -9.8830 0.13091E-09 -9.8830 0.10000E+01 0.0000 64 KSO4- 0.18646E-05 -5.7294 0.15382E-05 -5.8130 0.82495E+00 -0.0836 65 MgCO3,aq 0.28684E-12 -12.5424 0.28684E-12 -12.5424 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13732E-10 -10.8623 0.11353E-10 -10.9449 0.82676E+00 -0.0826 67 MgCl+ 0.11753E-12 -12.9299 0.97166E-13 -13.0125 0.82676E+00 -0.0826 68 MgF+ 0.27191E-12 -12.5656 0.22481E-12 -12.6482 0.82676E+00 -0.0826 69 MgOH+ 0.43727E-13 -13.3592 0.36152E-13 -13.4419 0.82676E+00 -0.0826 71 MnF+ 0.24131E-11 -11.6174 0.19951E-11 -11.7000 0.82676E+00 -0.0826 72 MnO,aq 0.64937E-14 -14.1875 0.64937E-14 -14.1875 0.10000E+01 0.0000 73 MnOH+ 0.95542E-11 -11.0198 0.78990E-11 -11.1024 0.82676E+00 -0.0826 75 HMnO2- 0.13735E-18 -18.8622 0.11331E-18 -18.9457 0.82495E+00 -0.0836 78 MnCl+ 0.14060E-10 -10.8520 0.11624E-10 -10.9346 0.82676E+00 -0.0826 79 MnSO4,aq 0.24387E-09 -9.6128 0.24387E-09 -9.6128 0.10000E+01 0.0000 80 NaCl,aq 0.10510E-04 -4.9784 0.10510E-04 -4.9784 0.10000E+01 0.0000 81 NaF,aq 0.46589E-06 -6.3317 0.46589E-06 -6.3317 0.10000E+01 0.0000 82 NaOH,aq 0.18856E-07 -7.7246 0.18856E-07 -7.7246 0.10000E+01 0.0000 84 OH- 0.16843E-05 -5.7736 0.13866E-05 -5.8581 0.82325E+00 -0.0845 89 HPO3-2 0.52191E-18 -18.2824 0.25778E-18 -18.5888 0.49391E+00 -0.3063 91 H2PO3- 0.26104E-18 -18.5833 0.21534E-18 -18.6669 0.82495E+00 -0.0836 92 H3PO4,aq 0.49475E-11 -11.3056 0.49475E-11 -11.3056 0.10000E+01 0.0000 93 H2PO4- 0.37930E-07 -7.4210 0.31325E-07 -7.5041 0.82585E+00 -0.0831 94 PO4-3 0.36428E-13 -13.4386 0.79831E-14 -14.0978 0.21915E+00 -0.6593 96 H3P2O7- 0.11992E-19 -19.9211 0.98928E-20 -20.0047 0.82495E+00 -0.0836 97 H2P2O7-2 0.15581E-15 -15.8074 0.76958E-16 -16.1137 0.49391E+00 -0.3063 98 HP2O7-3 0.17786E-15 -15.7499 0.36887E-16 -16.4331 0.20740E+00 -0.6832 99 P2O7-4 0.33158E-18 -18.4794 0.21153E-19 -19.6746 0.63794E-01 -1.1952 100 H2S,aq 0.33792E-02 -2.4712 0.33484E-02 -2.4752 0.99091E+00 -0.0040 101 S2-2 0.14956E-07 -7.8252 0.73869E-08 -8.1315 0.49391E+00 -0.3063 102 S3-2 0.33255E-08 -8.4781 0.16425E-08 -8.7845 0.49391E+00 -0.3063 103 S3- 0.39034E-08 -8.4086 0.32201E-08 -8.4921 0.82495E+00 -0.0836 104 S4-2 0.48846E-09 -9.3112 0.24125E-09 -9.6175 0.49391E+00 -0.3063 105 S5-2 0.47840E-10 -10.3202 0.23629E-10 -10.6266 0.49391E+00 -0.3063 106 SO2,aq 0.12209E-13 -13.9133 0.12209E-13 -13.9133 0.10000E+01 0.0000 107 SO3-2 0.40759E-11 -11.3898 0.20466E-11 -11.6890 0.50211E+00 -0.2992 108 HSO3- 0.64710E-10 -10.1890 0.53382E-10 -10.2726 0.82495E+00 -0.0836 109 HSO4- 0.37643E-06 -6.4243 0.31157E-06 -6.5064 0.82769E+00 -0.0821 111 S2O3-2 0.61819E-07 -7.2089 0.30533E-07 -7.5152 0.49391E+00 -0.3063 112 HS2O3- 0.27569E-11 -11.5596 0.22743E-11 -11.6431 0.82495E+00 -0.0836 113 H2S2O3,aq 0.15189E-16 -16.8185 0.15189E-16 -16.8185 0.10000E+01 0.0000 Charge balance for all species = -.6099E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5015049E-06 0.1360924E-01 0.1368511E+02 0.0000 2 H2O 0.1000000E+01 0.5549801E+02 0.9974666E+06 0.0000 3 Cl- 0.2102259E-02 0.2112774E-02 0.7472837E+02 3.6194 4 SO4-- 0.1567440E-02 0.1569730E-02 0.1504369E+03 9.6505 5 HCO3- 0.1378987E-01 0.2403373E-01 0.1463029E+04 4.4370 6 HS- 0.3151998E-02 0.6531304E-02 0.2154963E+03 3.7954 7 Al+++ 0.7348082E-16 0.4251252E-07 0.1144359E-02 2.3233 8 H4SiO4 0.1024123E-02 0.1027585E-02 0.9853493E+02 -2.9896 9 Ca++ 0.1757508E-06 0.2304369E-06 0.9213775E-02 5.6965 10 Mg++ 0.7821786E-10 0.9267298E-10 0.2247777E-05 2.3426 11 Fe++ 0.9117390E-14 0.9584821E-14 0.5340271E-09 -1.5903 12 K+ 0.1545323E-03 0.1564010E-03 0.6101239E+01 2.4866 13 Na+ 0.2217244E-01 0.2218411E-01 0.5088112E+03 4.6424 14 Mn++ 0.2223950E-08 0.2493854E-08 0.1366858E-03 3.7974 15 F- 0.1322209E-03 0.1329974E-03 0.2520753E+01 2.4170 16 HPO4-- 0.8231247E-08 0.4616656E-07 0.4420620E-02 4.3708 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1227488E-01 0.1228909E-01 -.1420274E-04 0.0000000E+00 2 H2O 0.5009201E+02 0.5011445E+02 -.2243842E-01 0.0000000E+00 3 Cl- 0.1907825E-02 0.1907825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1417467E-02 0.1417459E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2170235E-01 0.2170235E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.5897794E-02 0.5897737E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3838861E-07 0.4736963E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9279046E-03 0.1122512E-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 0.8655049E-14 0.3259226E-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- 0.1200960E-03 0.1200960E-03 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: -.3706E-21 Mass of aqueous solution: 0.905120E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.2999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2368E-05 -5.626 0.6114E-03 -3.214 0.9062E-01 0.2353E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674736 g Volume = 0.254813 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: 0.2999900 moles log = -0.5229 Original solution: 1000.0103000 g Original solution / Rock added: 3333.48 (Water/Rock Ratio), log = 3.5229 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.2110 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4663E+00 0.9754 0.1006E+01 0.1031E+01 CO2,gas 0.4916E+00 0.9986 0.1085E+01 0.1087E+01 CH4,gas 0.2448E-04 1.0084 0.5459E-04 0.5413E-04 H2,gas 0.1203E-04 1.0012 0.2664E-04 0.2660E-04 H2S,gas 0.4199E-01 0.9914 0.9205E-01 0.9284E-01 S2,gas 0.2027E-12 1.0000 0.4482E-12 0.4482E-12 CO,gas 0.3486E-08 1.0000 0.7708E-08 0.7708E-08 SO3,gas 0.2304E-31 1.0000 0.5094E-31 0.5094E-31 SO2,gas 0.2388E-13 1.0000 0.5280E-13 0.5280E-13 HF,gas 0.3446E-09 1.0000 0.7620E-09 0.7620E-09 HCl,gas 0.1057E-12 1.0000 0.2336E-12 0.2336E-12 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 0.28967E+04 0.002 2 CO2,gas -6.66 -8.32 -1.66 -0.554 0.28401E+04 0.036 3 CH4,gas 4.54 -1.42 -5.96 -1.490 0.10180E+05 -4.263 4 H2,gas 8.00 1.73 -6.27 -3.585 0.10712E+05 -4.575 5 H2S,gas -6.23 -8.97 -2.73 -1.367 0.46699E+04 -1.036 6 S2,gas -7.34 -21.38 -14.05 -2.161 0.23986E+05 -12.348 7 CO,gas 3.21 -6.60 -9.81 -3.019 0.16754E+05 -8.113 8 SO3,gas 17.12 -15.87 -32.99 -8.248 0.56333E+05 -31.293 9 SO2,gas 0.83 -14.14 -14.98 -3.994 0.25572E+05 -13.277 10 HF,gas 0.47 -10.34 -10.82 -5.409 0.18470E+05 -9.118 11 HCl,gas 5.19 -9.14 -14.33 -7.165 0.24469E+05 -12.632 16 albite-high 0.69 -2.00 -2.70 -0.207 0.46030E+04 17 albite -0.38 -2.00 -1.62 -0.125 0.27642E+04 21 analcite 3.32 0.99 -2.34 -0.259 0.39875E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57109E+04 25 anhydrite -5.32 -10.17 -4.86 -2.429 0.82938E+04 38 aragonite 0.97 -2.63 -3.59 -1.198 0.61360E+04 40 calcite 0.81 -2.63 -3.44 -1.146 0.58717E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63805E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94012E+03 69 diamond -3.10 -4.87 -1.77 -0.505 0.30194E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.87 -1.32 -0.378 0.22616E+04 94 heulandite -5.83 -10.58 -4.76 -0.216 0.81220E+04 98 jadeite 4.22 0.99 -3.23 -0.323 0.55128E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54968E+04 104 laumontite 2.88 -1.62 -4.50 -0.300 0.76817E+04 119 microcline -2.49 -4.16 -1.67 -0.129 0.28551E+04 123 muscovite 2.58 0.49 -2.09 -0.123 0.35769E+04 124 paragonite 4.24 2.64 -1.60 -0.094 0.27251E+04 125 nepheline 8.34 3.98 -4.36 -0.623 0.74503E+04 147 pyrrhotiteFe0.875 -6.02 -10.57 -4.55 -1.675 0.77755E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19392E+04 154 rhodochrosite -0.98 -4.53 -3.55 -1.183 0.60613E+04 156 sanidine -1.28 -4.16 -2.88 -0.222 0.49229E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61548E+04 166 stilbite -7.52 -10.58 -3.06 -0.146 0.52283E+04 172 sulfur -9.15 -10.69 -1.54 -0.474 0.26280E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50571E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.62 -2.97 -0.184 0.50761E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55188E+04 198 beidellite-K -1.52 -4.74 -3.22 -0.197 0.54939E+04 199 beidellite-Mg -1.79 -5.17 -3.38 -0.209 0.57748E+04 200 beidellite-Na -1.34 -4.03 -2.68 -0.164 0.45831E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.36 -3.04 -0.380 0.51904E+04 204 montmorillonite-Ca -2.29 -6.37 -4.07 -0.252 0.69571E+04 205 montmorillonite-K -2.24 -6.48 -4.25 -0.260 0.72531E+04 206 montmorillonite-Mg -2.48 -6.92 -4.44 -0.275 0.75790E+04 207 montmorillonite-Na -2.04 -5.77 -3.74 -0.229 0.63780E+04 214 topaz -16.55 -19.03 -2.48 -0.276 0.42413E+04 234 alabandite -0.98 -5.17 -4.19 -1.397 0.71542E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.73 -2.75 -0.211 0.46908E+04 248 an25ab75 2.65 -0.41 -3.06 -0.235 0.52194E+04 249 an30ab70 3.28 -0.09 -3.37 -0.259 0.57576E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.2999900 MOLES New total amount of reactant added: 0.3099900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3099900 Water: Moles liquid = 0.5013E+02 kg liquid = 0.9032E+00 Moles total = 0.5010E+02 kg total = 0.9026E+00 Activity = 0.9997 Stoichiometric ionic strength = .3136561E-01 Osmotic coef. = 0.9041 True ionic strength = .2394810E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1967E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.55140E-06 -6.2585 0.45797E-06 -6.3392 0.83056E+00 -0.0806 2 H2O 0.99973E+00 -0.0001 0.99973E+00 -0.0001 3 Cl- 0.21669E-02 -2.6642 0.17873E-02 -2.7478 0.82482E+00 -0.0836 4 SO4-- 0.16199E-02 -2.7905 0.80159E-03 -3.0960 0.49484E+00 -0.3055 5 HCO3- 0.13668E-01 -1.8643 0.11293E-01 -1.9472 0.82621E+00 -0.0829 6 HS- 0.30966E-02 -2.5091 0.25546E-02 -2.5927 0.82496E+00 -0.0836 7 Al+++ 0.97752E-16 -16.0099 0.20223E-16 -16.6942 0.20688E+00 -0.6843 8 H4SiO4 0.10241E-02 -2.9897 0.10241E-02 -2.9897 0.10000E+01 0.0000 9 Ca++ 0.17560E-06 -6.7555 0.86158E-07 -7.0647 0.49065E+00 -0.3092 10 Mg++ 0.78330E-10 -10.1061 0.38231E-10 -10.4176 0.48807E+00 -0.3115 11 Fe++ 0.91185E-14 -14.0401 0.44561E-14 -14.3510 0.48869E+00 -0.3110 12 K+ 0.15444E-03 -3.8112 0.12764E-03 -3.8940 0.82643E+00 -0.0828 13 Na+ 0.22168E-01 -1.6543 0.18281E-01 -1.7380 0.82464E+00 -0.0837 14 Mn++ 0.22169E-08 -8.6543 0.10844E-08 -8.9648 0.48915E+00 -0.3106 15 F- 0.13657E-03 -3.8646 0.11238E-03 -3.9493 0.82287E+00 -0.0847 16 HPO4-- 0.76113E-08 -8.1185 0.37670E-08 -8.4240 0.49492E+00 -0.3055 18 HSiO3- 0.25321E-05 -5.5965 0.20885E-05 -5.6802 0.82482E+00 -0.0836 19 Ca(HSiO3)+ 0.49575E-11 -11.3047 0.40980E-11 -11.3874 0.82663E+00 -0.0827 20 Mg(HSiO3)+ 0.27376E-14 -14.5626 0.22630E-14 -14.6453 0.82663E+00 -0.0827 21 NaHSiO3,aq 0.61751E-06 -6.2094 0.61751E-06 -6.2094 0.10000E+01 0.0000 22 AlO+ 0.15864E-10 -10.7996 0.13114E-10 -10.8823 0.82663E+00 -0.0827 23 AlOH+2 0.61068E-13 -13.2142 0.29905E-13 -13.5243 0.48970E+00 -0.3101 24 HAlO2,aq 0.57011E-08 -8.2440 0.57011E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.33478E-07 -7.4752 0.27556E-07 -7.5598 0.82311E+00 -0.0845 26 CH4,aq 0.35277E-07 -7.4525 0.34949E-07 -7.4566 0.99073E+00 -0.0040 27 C2H6,aq 0.10772E-16 -16.9677 0.10672E-16 -16.9717 0.99073E+00 -0.0040 31 CO,aq 0.54345E-11 -11.2648 0.54345E-11 -11.2648 0.10000E+01 0.0000 32 CO2,aq 0.11157E-01 -1.9524 0.11054E-01 -1.9565 0.99073E+00 -0.0040 33 CO3-2 0.43633E-05 -5.3602 0.21538E-05 -5.6668 0.49363E+00 -0.3066 34 CaCO3,aq 0.23268E-08 -8.6332 0.23268E-08 -8.6332 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.30045E-07 -7.5222 0.24836E-07 -7.6049 0.82663E+00 -0.0827 36 CaCl+ 0.30147E-09 -9.5208 0.24920E-09 -9.6034 0.82663E+00 -0.0827 37 CaCl2,aq 0.10582E-12 -12.9754 0.10582E-12 -12.9754 0.10000E+01 0.0000 38 CaF+ 0.17101E-09 -9.7670 0.14136E-09 -9.8497 0.82663E+00 -0.0827 39 CaOH+ 0.16216E-10 -10.7901 0.13404E-10 -10.8728 0.82663E+00 -0.0827 40 CaSO4,aq 0.21931E-07 -7.6589 0.21931E-07 -7.6589 0.10000E+01 0.0000 41 HCl,aq 0.14999E-09 -9.8239 0.14999E-09 -9.8239 0.10000E+01 0.0000 45 HF,aq 0.35232E-06 -6.4531 0.35232E-06 -6.4531 0.10000E+01 0.0000 46 HF2- 0.16207E-10 -10.7903 0.13368E-10 -10.8739 0.82482E+00 -0.0836 48 FeCl+ 0.15250E-16 -16.8167 0.12606E-16 -16.8994 0.82663E+00 -0.0827 51 FeF+ 0.30957E-16 -16.5092 0.25590E-16 -16.5919 0.82663E+00 -0.0827 53 FeO,aq 0.82553E-18 -18.0833 0.82553E-18 -18.0833 0.10000E+01 0.0000 54 FeOH+ 0.38305E-15 -15.4167 0.31664E-15 -15.4994 0.82663E+00 -0.0827 55 HFeO2- 0.22861E-19 -19.6409 0.18856E-19 -19.7246 0.82482E+00 -0.0836 59 HFeO2,aq 0.30674E-18 -18.5132 0.30674E-18 -18.5132 0.10000E+01 0.0000 60 H2,aq 0.19749E-07 -7.7045 0.19566E-07 -7.7085 0.99073E+00 -0.0040 61 KCl,aq 0.41346E-08 -8.3836 0.41346E-08 -8.3836 0.10000E+01 0.0000 62 KHSO4,aq 0.13248E-12 -12.8779 0.13248E-12 -12.8779 0.10000E+01 0.0000 63 KOH,aq 0.11899E-09 -9.9245 0.11899E-09 -9.9245 0.10000E+01 0.0000 64 KSO4- 0.19248E-05 -5.7156 0.15876E-05 -5.7992 0.82482E+00 -0.0836 65 MgCO3,aq 0.25880E-12 -12.5870 0.25880E-12 -12.5870 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13623E-10 -10.8657 0.11261E-10 -10.9484 0.82663E+00 -0.0827 67 MgCl+ 0.12124E-12 -12.9163 0.10022E-12 -12.9990 0.82663E+00 -0.0827 68 MgF+ 0.28109E-12 -12.5512 0.23236E-12 -12.6338 0.82663E+00 -0.0827 69 MgOH+ 0.39816E-13 -13.3999 0.32913E-13 -13.4826 0.82663E+00 -0.0827 71 MnF+ 0.24831E-11 -11.6050 0.20526E-11 -11.6877 0.82663E+00 -0.0827 72 MnO,aq 0.53530E-14 -14.2714 0.53530E-14 -14.2714 0.10000E+01 0.0000 73 MnOH+ 0.86594E-11 -11.0625 0.71582E-11 -11.1452 0.82663E+00 -0.0827 75 HMnO2- 0.10301E-18 -18.9871 0.84962E-19 -19.0708 0.82482E+00 -0.0836 78 MnCl+ 0.14438E-10 -10.8405 0.11935E-10 -10.9232 0.82663E+00 -0.0827 79 MnSO4,aq 0.25094E-09 -9.6004 0.25094E-09 -9.6004 0.10000E+01 0.0000 80 NaCl,aq 0.10828E-04 -4.9655 0.10828E-04 -4.9655 0.10000E+01 0.0000 81 NaF,aq 0.48097E-06 -6.3179 0.48097E-06 -6.3179 0.10000E+01 0.0000 82 NaOH,aq 0.17146E-07 -7.7658 0.17146E-07 -7.7658 0.10000E+01 0.0000 84 OH- 0.15323E-05 -5.8147 0.12613E-05 -5.8992 0.82311E+00 -0.0845 89 HPO3-2 0.46543E-18 -18.3321 0.22975E-18 -18.6387 0.49363E+00 -0.3066 91 H2PO3- 0.25580E-18 -18.5921 0.21099E-18 -18.6757 0.82482E+00 -0.0836 92 H3PO4,aq 0.55257E-11 -11.2576 0.55257E-11 -11.2576 0.10000E+01 0.0000 93 H2PO4- 0.38541E-07 -7.4141 0.31824E-07 -7.4972 0.82572E+00 -0.0832 94 PO4-3 0.30660E-13 -13.5134 0.67111E-14 -14.1732 0.21889E+00 -0.6598 96 H3P2O7- 0.13609E-19 -19.8662 0.11225E-19 -19.9498 0.82482E+00 -0.0836 97 H2P2O7-2 0.16092E-15 -15.7934 0.79434E-16 -16.1000 0.49363E+00 -0.3066 98 HP2O7-3 0.16721E-15 -15.7767 0.34634E-16 -16.4605 0.20713E+00 -0.6838 99 P2O7-4 0.28383E-18 -18.5469 0.18067E-19 -19.7431 0.63653E-01 -1.1962 100 H2S,aq 0.36496E-02 -2.4378 0.36157E-02 -2.4418 0.99073E+00 -0.0040 101 S2-2 0.14971E-07 -7.8247 0.73903E-08 -8.1313 0.49363E+00 -0.3066 102 S3-2 0.37274E-08 -8.4286 0.18400E-08 -8.7352 0.49363E+00 -0.3066 103 S3- 0.48957E-08 -8.3102 0.40381E-08 -8.3938 0.82482E+00 -0.0836 104 S4-2 0.61302E-09 -9.2125 0.30261E-09 -9.5191 0.49363E+00 -0.3066 105 S5-2 0.67227E-10 -10.1725 0.33185E-10 -10.4791 0.49363E+00 -0.3066 106 SO2,aq 0.14698E-13 -13.8327 0.14698E-13 -13.8327 0.10000E+01 0.0000 107 SO3-2 0.40624E-11 -11.3912 0.20386E-11 -11.6907 0.50184E+00 -0.2994 108 HSO3- 0.70872E-10 -10.1495 0.58457E-10 -10.2332 0.82482E+00 -0.0836 109 HSO4- 0.42750E-06 -6.3691 0.35378E-06 -6.4513 0.82756E+00 -0.0822 111 S2O3-2 0.68989E-07 -7.1612 0.34055E-07 -7.4678 0.49363E+00 -0.3066 112 HS2O3- 0.33809E-11 -11.4710 0.27886E-11 -11.5546 0.82482E+00 -0.0836 113 H2S2O3,aq 0.20473E-16 -16.6888 0.20473E-16 -16.6888 0.10000E+01 0.0000 Charge balance for all species = -.6098E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5513975E-06 0.1479901E-01 0.1488080E+02 0.0000 2 H2O 0.1000000E+01 0.5549709E+02 0.9974027E+06 0.0000 3 Cl- 0.2166888E-02 0.2177720E-02 0.7702184E+02 3.5914 4 SO4-- 0.1619905E-02 0.1622318E-02 0.1554693E+03 9.5823 5 HCO3- 0.1366829E-01 0.2482993E-01 0.1511425E+04 4.3920 6 HS- 0.3096590E-02 0.6746315E-02 0.2225799E+03 3.7465 7 Al+++ 0.9775246E-16 0.3919529E-07 0.1055015E-02 2.3233 8 H4SiO4 0.1024079E-02 0.1027228E-02 0.9849606E+02 -2.9897 9 Ca++ 0.1755992E-06 0.2303955E-06 0.9211680E-02 5.6136 10 Mg++ 0.7833009E-10 0.9265631E-10 0.2247266E-05 2.2607 11 Fe++ 0.9118478E-14 0.9548902E-14 0.5320006E-09 -1.6727 12 K+ 0.1544438E-03 0.1563729E-03 0.6099851E+01 2.4451 13 Na+ 0.2216818E-01 0.2218012E-01 0.5086955E+03 4.6012 14 Mn++ 0.2216878E-08 0.2493406E-08 0.1366547E-03 3.7135 15 F- 0.1365688E-03 0.1374023E-03 0.2604119E+01 2.3899 16 HPO4-- 0.7611315E-08 0.4615825E-07 0.4419615E-02 4.2543 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1335163E-01 0.1336584E-01 -.1421171E-04 0.0000000E+00 2 H2O 0.5010020E+02 0.5012264E+02 -.2243872E-01 0.0000000E+00 3 Cl- 0.1966825E-02 0.1966825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1465217E-02 0.1465209E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2242535E-01 0.2242535E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.6093044E-02 0.6092987E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3539953E-07 0.4739952E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9277495E-03 0.1122527E-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 0.8624166E-14 0.3259226E-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- 0.1240960E-03 0.1240960E-03 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: 0.905326E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3099900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2370E-05 -5.625 0.6118E-03 -3.213 0.9068E-01 0.2354E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674745 g Volume = 0.254817 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: 0.3099900 moles log = -0.5087 Original solution: 1000.0103000 g Original solution / Rock added: 3225.94 (Water/Rock Ratio), log = 3.5087 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.3170 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4453E+00 0.9747 0.1006E+01 0.1032E+01 CO2,gas 0.5114E+00 0.9981 0.1183E+01 0.1185E+01 CH4,gas 0.2202E-04 1.0082 0.5144E-04 0.5102E-04 H2,gas 0.1107E-04 1.0012 0.2569E-04 0.2566E-04 H2S,gas 0.4329E-01 0.9910 0.9939E-01 0.1003E+00 S2,gas 0.2425E-12 1.0000 0.5620E-12 0.5620E-12 CO,gas 0.3495E-08 1.0000 0.8098E-08 0.8098E-08 SO3,gas 0.2744E-31 1.0000 0.6358E-31 0.6358E-31 SO2,gas 0.2743E-13 1.0000 0.6356E-13 0.6356E-13 HF,gas 0.3734E-09 1.0000 0.8651E-09 0.8651E-09 HCl,gas 0.1142E-12 1.0000 0.2647E-12 0.2647E-12 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 -0.18578E-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 -1.697 0.28967E+04 0.002 2 CO2,gas -6.66 -8.29 -1.63 -0.542 0.27766E+04 0.073 3 CH4,gas 4.54 -1.44 -5.99 -1.497 0.10224E+05 -4.289 4 H2,gas 8.00 1.71 -6.29 -3.594 0.10739E+05 -4.590 5 H2S,gas -6.23 -8.93 -2.70 -1.351 0.46129E+04 -1.003 6 S2,gas -7.34 -21.28 -13.95 -2.146 0.23818E+05 -12.250 7 CO,gas 3.21 -6.58 -9.79 -3.012 0.16717E+05 -8.092 8 SO3,gas 17.12 -15.77 -32.90 -8.224 0.56168E+05 -31.197 9 SO2,gas 0.83 -14.06 -14.90 -3.972 0.25434E+05 -13.197 10 HF,gas 0.47 -10.29 -10.76 -5.381 0.18376E+05 -9.063 11 HCl,gas 5.19 -9.09 -14.28 -7.138 0.24376E+05 -12.577 16 albite-high 0.69 -2.04 -2.74 -0.211 0.46735E+04 17 albite -0.38 -2.04 -1.66 -0.128 0.28347E+04 21 analcite 3.32 0.95 -2.38 -0.264 0.40579E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57109E+04 25 anhydrite -5.32 -10.16 -4.84 -2.422 0.82709E+04 38 aragonite 0.97 -2.67 -3.64 -1.213 0.62139E+04 40 calcite 0.81 -2.67 -3.48 -1.162 0.59497E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63805E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94011E+03 69 diamond -3.10 -4.86 -1.76 -0.504 0.30096E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.86 -1.32 -0.377 0.22518E+04 94 heulandite -5.83 -10.67 -4.84 -0.220 0.82636E+04 98 jadeite 4.22 0.95 -3.27 -0.327 0.55832E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54968E+04 104 laumontite 2.88 -1.70 -4.58 -0.305 0.78232E+04 119 microcline -2.49 -4.20 -1.71 -0.132 0.29259E+04 123 muscovite 2.58 0.45 -2.14 -0.126 0.36476E+04 124 paragonite 4.24 2.60 -1.64 -0.096 0.27956E+04 125 nepheline 8.34 3.93 -4.40 -0.629 0.75208E+04 147 pyrrhotiteFe0.875 -6.02 -10.61 -4.59 -1.688 0.78384E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19392E+04 154 rhodochrosite -0.98 -4.57 -3.60 -1.199 0.61410E+04 156 sanidine -1.28 -4.20 -2.92 -0.225 0.49936E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61548E+04 166 stilbite -7.52 -10.67 -3.14 -0.150 0.53699E+04 172 sulfur -9.15 -10.64 -1.49 -0.458 0.25442E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50570E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.63 -2.99 -0.185 0.50994E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55188E+04 198 beidellite-K -1.52 -4.75 -3.23 -0.198 0.55173E+04 199 beidellite-Mg -1.79 -5.19 -3.40 -0.210 0.57979E+04 200 beidellite-Na -1.34 -4.04 -2.70 -0.165 0.46064E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.36 -3.04 -0.380 0.51974E+04 204 montmorillonite-Ca -2.29 -6.41 -4.12 -0.255 0.70266E+04 205 montmorillonite-K -2.24 -6.53 -4.29 -0.263 0.73226E+04 206 montmorillonite-Mg -2.48 -6.96 -4.48 -0.277 0.76482E+04 207 montmorillonite-Na -2.04 -5.81 -3.78 -0.231 0.64474E+04 214 topaz -16.55 -18.92 -2.37 -0.264 0.40530E+04 234 alabandite -0.98 -5.22 -4.24 -1.413 0.72405E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.78 -2.80 -0.215 0.47755E+04 248 an25ab75 2.65 -0.46 -3.11 -0.239 0.53076E+04 249 an30ab70 3.28 -0.15 -3.43 -0.264 0.58494E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3099900 MOLES New total amount of reactant added: 0.3199900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3199900 Water: Moles liquid = 0.5014E+02 kg liquid = 0.9033E+00 Moles total = 0.5011E+02 kg total = 0.9027E+00 Activity = 0.9997 Stoichiometric ionic strength = .3200947E-01 Osmotic coef. = 0.9034 True ionic strength = .2399584E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2026E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.60238E-06 -6.2201 0.50024E-06 -6.3008 0.83043E+00 -0.0807 2 H2O 0.99971E+00 -0.0001 0.99971E+00 -0.0001 3 Cl- 0.22315E-02 -2.6514 0.18403E-02 -2.7351 0.82469E+00 -0.0837 4 SO4-- 0.16723E-02 -2.7767 0.82707E-03 -3.0825 0.49456E+00 -0.3058 5 HCO3- 0.13545E-01 -1.8682 0.11189E-01 -1.9512 0.82608E+00 -0.0830 6 HS- 0.30432E-02 -2.5167 0.25101E-02 -2.6003 0.82483E+00 -0.0836 7 Al+++ 0.12757E-15 -15.8943 0.26357E-16 -16.5791 0.20661E+00 -0.6848 8 H4SiO4 0.10240E-02 -2.9897 0.10240E-02 -2.9897 0.10000E+01 0.0000 9 Ca++ 0.17542E-06 -6.7559 0.86022E-07 -7.0654 0.49037E+00 -0.3095 10 Mg++ 0.78440E-10 -10.1055 0.38262E-10 -10.4172 0.48778E+00 -0.3118 11 Fe++ 0.91309E-14 -14.0395 0.44595E-14 -14.3507 0.48840E+00 -0.3112 12 K+ 0.15436E-03 -3.8115 0.12754E-03 -3.8943 0.82630E+00 -0.0829 13 Na+ 0.22164E-01 -1.6544 0.18274E-01 -1.7382 0.82451E+00 -0.0838 14 Mn++ 0.22098E-08 -8.6557 0.10803E-08 -8.9665 0.48887E+00 -0.3108 15 F- 0.14091E-03 -3.8511 0.11593E-03 -3.9358 0.82274E+00 -0.0847 16 HPO4-- 0.70677E-08 -8.1507 0.34959E-08 -8.4564 0.49464E+00 -0.3057 18 HSiO3- 0.23185E-05 -5.6348 0.19120E-05 -5.7185 0.82469E+00 -0.0837 19 Ca(HSiO3)+ 0.45320E-11 -11.3437 0.37457E-11 -11.4265 0.82650E+00 -0.0828 20 Mg(HSiO3)+ 0.25087E-14 -14.6006 0.20734E-14 -14.6833 0.82650E+00 -0.0828 21 NaHSiO3,aq 0.56512E-06 -6.2479 0.56512E-06 -6.2479 0.10000E+01 0.0000 22 AlO+ 0.17332E-10 -10.7612 0.14325E-10 -10.8439 0.82650E+00 -0.0828 23 AlOH+2 0.72907E-13 -13.1372 0.35682E-13 -13.4476 0.48941E+00 -0.3103 24 HAlO2,aq 0.57012E-08 -8.2440 0.57012E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.30654E-07 -7.5135 0.25228E-07 -7.5981 0.82298E+00 -0.0846 26 CH4,aq 0.33291E-07 -7.4777 0.32977E-07 -7.4818 0.99055E+00 -0.0041 27 C2H6,aq 0.99270E-17 -17.0032 0.98331E-17 -17.0073 0.99055E+00 -0.0041 31 CO,aq 0.56834E-11 -11.2454 0.56834E-11 -11.2454 0.10000E+01 0.0000 32 CO2,aq 0.12077E-01 -1.9180 0.11963E-01 -1.9222 0.99055E+00 -0.0041 33 CO3-2 0.39600E-05 -5.4023 0.19537E-05 -5.7091 0.49335E+00 -0.3068 34 CaCO3,aq 0.21073E-08 -8.6763 0.21073E-08 -8.6763 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.29726E-07 -7.5269 0.24568E-07 -7.6096 0.82650E+00 -0.0828 36 CaCl+ 0.30996E-09 -9.5087 0.25619E-09 -9.5914 0.82650E+00 -0.0828 37 CaCl2,aq 0.11201E-12 -12.9508 0.11201E-12 -12.9508 0.10000E+01 0.0000 38 CaF+ 0.17617E-09 -9.7541 0.14560E-09 -9.8368 0.82650E+00 -0.0828 39 CaOH+ 0.14824E-10 -10.8290 0.12252E-10 -10.9118 0.82650E+00 -0.0828 40 CaSO4,aq 0.22592E-07 -7.6460 0.22592E-07 -7.6460 0.10000E+01 0.0000 41 HCl,aq 0.16869E-09 -9.7729 0.16869E-09 -9.7729 0.10000E+01 0.0000 45 HF,aq 0.39702E-06 -6.4012 0.39702E-06 -6.4012 0.10000E+01 0.0000 46 HF2- 0.18844E-10 -10.7248 0.15540E-10 -10.8085 0.82469E+00 -0.0837 48 FeCl+ 0.15717E-16 -16.8036 0.12990E-16 -16.8864 0.82650E+00 -0.0828 51 FeF+ 0.31966E-16 -16.4953 0.26420E-16 -16.5781 0.82650E+00 -0.0828 53 FeO,aq 0.69243E-18 -18.1596 0.69243E-18 -18.1596 0.10000E+01 0.0000 54 FeOH+ 0.35100E-15 -15.4547 0.29010E-15 -15.5374 0.82650E+00 -0.0828 55 HFeO2- 0.17557E-19 -19.7556 0.14479E-19 -19.8393 0.82469E+00 -0.0837 59 HFeO2,aq 0.26173E-18 -18.5821 0.26173E-18 -18.5821 0.10000E+01 0.0000 60 H2,aq 0.19087E-07 -7.7193 0.18906E-07 -7.7234 0.99055E+00 -0.0041 61 KCl,aq 0.42541E-08 -8.3712 0.42541E-08 -8.3712 0.10000E+01 0.0000 62 KHSO4,aq 0.14920E-12 -12.8262 0.14920E-12 -12.8262 0.10000E+01 0.0000 63 KOH,aq 0.10885E-09 -9.9632 0.10885E-09 -9.9632 0.10000E+01 0.0000 64 KSO4- 0.19849E-05 -5.7023 0.16369E-05 -5.7860 0.82469E+00 -0.0837 65 MgCO3,aq 0.23494E-12 -12.6290 0.23494E-12 -12.6290 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13510E-10 -10.8693 0.11166E-10 -10.9521 0.82650E+00 -0.0828 67 MgCl+ 0.12496E-12 -12.9032 0.10328E-12 -12.9860 0.82650E+00 -0.0828 68 MgF+ 0.29027E-12 -12.5372 0.23991E-12 -12.6200 0.82650E+00 -0.0828 69 MgOH+ 0.36486E-13 -13.4379 0.30156E-13 -13.5206 0.82650E+00 -0.0828 71 MnF+ 0.25523E-11 -11.5931 0.21095E-11 -11.6758 0.82650E+00 -0.0828 72 MnO,aq 0.44694E-14 -14.3498 0.44694E-14 -14.3498 0.10000E+01 0.0000 73 MnOH+ 0.78986E-11 -11.1024 0.65282E-11 -11.1852 0.82650E+00 -0.0828 75 HMnO2- 0.78747E-19 -19.1038 0.64942E-19 -19.1875 0.82469E+00 -0.0837 78 MnCl+ 0.14812E-10 -10.8294 0.12242E-10 -10.9121 0.82650E+00 -0.0828 79 MnSO4,aq 0.25794E-09 -9.5885 0.25794E-09 -9.5885 0.10000E+01 0.0000 80 NaCl,aq 0.11145E-04 -4.9529 0.11145E-04 -4.9529 0.10000E+01 0.0000 81 NaF,aq 0.49601E-06 -6.3045 0.49601E-06 -6.3045 0.10000E+01 0.0000 82 NaOH,aq 0.15691E-07 -7.8043 0.15691E-07 -7.8043 0.10000E+01 0.0000 84 OH- 0.14030E-05 -5.8529 0.11547E-05 -5.9375 0.82298E+00 -0.0846 89 HPO3-2 0.41762E-18 -18.3792 0.20603E-18 -18.6861 0.49335E+00 -0.3068 91 H2PO3- 0.25061E-18 -18.6010 0.20668E-18 -18.6847 0.82469E+00 -0.0837 92 H3PO4,aq 0.61185E-11 -11.2134 0.61185E-11 -11.2134 0.10000E+01 0.0000 93 H2PO4- 0.39076E-07 -7.4081 0.32261E-07 -7.4913 0.82559E+00 -0.0832 94 PO4-3 0.26081E-13 -13.5837 0.57019E-14 -14.2440 0.21862E+00 -0.6603 96 H3P2O7- 0.15279E-19 -19.8159 0.12600E-19 -19.8996 0.82469E+00 -0.0837 97 H2P2O7-2 0.16546E-15 -15.7813 0.81630E-16 -16.0882 0.49335E+00 -0.3068 98 HP2O7-3 0.15751E-15 -15.8027 0.32583E-16 -16.4870 0.20687E+00 -0.6843 99 P2O7-4 0.24500E-18 -18.6108 0.15561E-19 -19.8080 0.63513E-01 -1.1971 100 H2S,aq 0.39178E-02 -2.4070 0.38808E-02 -2.4111 0.99055E+00 -0.0041 101 S2-2 0.14968E-07 -7.8248 0.73846E-08 -8.1317 0.49335E+00 -0.3068 102 S3-2 0.41395E-08 -8.3831 0.20422E-08 -8.6899 0.49335E+00 -0.3068 103 S3- 0.60390E-08 -8.2190 0.49803E-08 -8.3027 0.82469E+00 -0.0837 104 S4-2 0.75620E-09 -9.1214 0.37307E-09 -9.4282 0.49335E+00 -0.3068 105 S5-2 0.92114E-10 -10.0357 0.45445E-10 -10.3425 0.49335E+00 -0.3068 106 SO2,aq 0.17485E-13 -13.7573 0.17485E-13 -13.7573 0.10000E+01 0.0000 107 SO3-2 0.40525E-11 -11.3923 0.20326E-11 -11.6920 0.50156E+00 -0.2997 108 HSO3- 0.77196E-10 -10.1124 0.63662E-10 -10.1961 0.82469E+00 -0.0837 109 HSO4- 0.48188E-06 -6.3171 0.39872E-06 -6.3993 0.82744E+00 -0.0823 111 S2O3-2 0.76446E-07 -7.1166 0.37715E-07 -7.4235 0.49335E+00 -0.3068 112 HS2O3- 0.40904E-11 -11.3882 0.33733E-11 -11.4719 0.82469E+00 -0.0837 113 H2S2O3,aq 0.27052E-16 -16.5678 0.27052E-16 -16.5678 0.10000E+01 0.0000 Charge balance for all species = -.6097E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6023841E-06 0.1598835E-01 0.1607595E+02 0.0000 2 H2O 0.1000000E+01 0.5549617E+02 0.9973388E+06 0.0000 3 Cl- 0.2231493E-02 0.2242643E-02 0.7931427E+02 3.5657 4 SO4-- 0.1672348E-02 0.1674886E-02 0.1604994E+03 9.5192 5 HCO3- 0.1354453E-01 0.2562584E-01 0.1559799E+04 4.3496 6 HS- 0.3043235E-02 0.6961248E-02 0.2296602E+03 3.7005 7 Al+++ 0.1275671E-15 0.3637306E-07 0.9790032E-03 2.3234 8 H4SiO4 0.1024035E-02 0.1026919E-02 0.9846167E+02 -2.9897 9 Ca++ 0.1754234E-06 0.2303540E-06 0.9209585E-02 5.5363 10 Mg++ 0.7844029E-10 0.9263964E-10 0.2246755E-05 2.1844 11 Fe++ 0.9130932E-14 0.9530597E-14 0.5309555E-09 -1.7491 12 K+ 0.1543555E-03 0.1563447E-03 0.6098464E+01 2.4065 13 Na+ 0.2216391E-01 0.2217613E-01 0.5085798E+03 4.5627 14 Mn++ 0.2209755E-08 0.2492957E-08 0.1366236E-03 3.6352 15 F- 0.1409125E-03 0.1418057E-03 0.2687447E+01 2.3650 16 HPO4-- 0.7067695E-08 0.4614995E-07 0.4418610E-02 4.1452 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1442838E-01 0.1444260E-01 -.1421934E-04 0.0000000E+00 2 H2O 0.5010838E+02 0.5013082E+02 -.2243894E-01 0.0000000E+00 3 Cl- 0.2025825E-02 0.2025825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1512967E-02 0.1512959E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2314835E-01 0.2314835E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.6288294E-02 0.6288237E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3285653E-07 0.4742495E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9276365E-03 0.1122538E-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 0.8609183E-14 0.3259226E-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- 0.1280960E-03 0.1280960E-03 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: 0.4632E-21 Mass of aqueous solution: 0.905532E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2371E-05 -5.625 0.6122E-03 -3.213 0.9072E-01 0.2355E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674752 g Volume = 0.254819 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: 0.3199900 moles log = -0.4949 Original solution: 1000.0103000 g Original solution / Rock added: 3125.13 (Water/Rock Ratio), log = 3.4949 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.4232 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4261E+00 0.9741 0.1006E+01 0.1032E+01 CO2,gas 0.5295E+00 0.9976 0.1280E+01 0.1283E+01 CH4,gas 0.1987E-04 1.0081 0.4854E-04 0.4815E-04 H2,gas 0.1023E-04 1.0013 0.2482E-04 0.2479E-04 H2S,gas 0.4444E-01 0.9906 0.1067E+00 0.1077E+00 S2,gas 0.2861E-12 1.0000 0.6934E-12 0.6934E-12 CO,gas 0.3495E-08 1.0000 0.8469E-08 0.8469E-08 SO3,gas 0.3230E-31 1.0000 0.7828E-31 0.7828E-31 SO2,gas 0.3120E-13 1.0000 0.7561E-13 0.7561E-13 HF,gas 0.4023E-09 1.0000 0.9748E-09 0.9748E-09 HCl,gas 0.1228E-12 1.0000 0.2977E-12 0.2977E-12 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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.25 -1.59 -0.531 0.27179E+04 0.107 3 CH4,gas 4.54 -1.47 -6.01 -1.503 0.10267E+05 -4.314 4 H2,gas 8.00 1.70 -6.30 -3.602 0.10764E+05 -4.605 5 H2S,gas -6.23 -8.90 -2.67 -1.335 0.45605E+04 -0.972 6 S2,gas -7.34 -21.19 -13.86 -2.132 0.23662E+05 -12.159 7 CO,gas 3.21 -6.56 -9.77 -3.006 0.16684E+05 -8.072 8 SO3,gas 17.12 -15.68 -32.81 -8.201 0.56014E+05 -31.106 9 SO2,gas 0.83 -13.99 -14.82 -3.952 0.25305E+05 -13.121 10 HF,gas 0.47 -10.24 -10.71 -5.355 0.18287E+05 -9.011 11 HCl,gas 5.19 -9.04 -14.23 -7.113 0.24289E+05 -12.526 16 albite-high 0.69 -2.08 -2.78 -0.214 0.47392E+04 17 albite -0.38 -2.08 -1.70 -0.131 0.29004E+04 21 analcite 3.32 0.91 -2.42 -0.268 0.41237E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57108E+04 25 anhydrite -5.32 -10.15 -4.83 -2.416 0.82489E+04 38 aragonite 0.97 -2.72 -3.68 -1.227 0.62874E+04 40 calcite 0.81 -2.72 -3.53 -1.176 0.60232E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63804E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94011E+03 69 diamond -3.10 -4.86 -1.76 -0.502 0.30018E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.86 -1.31 -0.375 0.22440E+04 94 heulandite -5.83 -10.74 -4.92 -0.224 0.83958E+04 98 jadeite 4.22 0.91 -3.31 -0.331 0.56490E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54967E+04 104 laumontite 2.88 -1.78 -4.66 -0.311 0.79554E+04 119 microcline -2.49 -4.24 -1.75 -0.135 0.29919E+04 123 muscovite 2.58 0.41 -2.17 -0.128 0.37136E+04 124 paragonite 4.24 2.56 -1.68 -0.099 0.28613E+04 125 nepheline 8.34 3.90 -4.44 -0.635 0.75865E+04 147 pyrrhotiteFe0.875 -6.02 -10.64 -4.62 -1.701 0.78968E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19392E+04 154 rhodochrosite -0.98 -4.62 -3.64 -1.214 0.62161E+04 156 sanidine -1.28 -4.24 -2.96 -0.228 0.50596E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61548E+04 166 stilbite -7.52 -10.74 -3.22 -0.153 0.55021E+04 172 sulfur -9.15 -10.60 -1.44 -0.444 0.24663E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50570E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.64 -3.00 -0.186 0.51212E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55188E+04 198 beidellite-K -1.52 -4.76 -3.24 -0.199 0.55390E+04 199 beidellite-Mg -1.79 -5.20 -3.41 -0.211 0.58193E+04 200 beidellite-Na -1.34 -4.05 -2.71 -0.166 0.46280E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.37 -3.05 -0.381 0.52045E+04 204 montmorillonite-Ca -2.29 -6.44 -4.15 -0.257 0.70914E+04 205 montmorillonite-K -2.24 -6.56 -4.33 -0.265 0.73874E+04 206 montmorillonite-Mg -2.48 -7.00 -4.52 -0.279 0.77128E+04 207 montmorillonite-Na -2.04 -5.85 -3.81 -0.234 0.65121E+04 214 topaz -16.55 -18.82 -2.27 -0.252 0.38758E+04 234 alabandite -0.98 -5.27 -4.29 -1.429 0.73218E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.83 -2.84 -0.219 0.48545E+04 248 an25ab75 2.65 -0.51 -3.16 -0.243 0.53900E+04 249 an30ab70 3.28 -0.20 -3.48 -0.267 0.59351E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3199900 MOLES New total amount of reactant added: 0.3299900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3299900 Water: Moles liquid = 0.5015E+02 kg liquid = 0.9035E+00 Moles total = 0.5012E+02 kg total = 0.9029E+00 Activity = 0.9997 Stoichiometric ionic strength = .3265312E-01 Osmotic coef. = 0.9028 True ionic strength = .2404361E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2085E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.65450E-06 -6.1841 0.54343E-06 -6.2649 0.83031E+00 -0.0808 2 H2O 0.99969E+00 -0.0001 0.99969E+00 -0.0001 3 Cl- 0.22961E-02 -2.6390 0.18932E-02 -2.7228 0.82456E+00 -0.0838 4 SO4-- 0.17248E-02 -2.7633 0.85251E-03 -3.0693 0.49428E+00 -0.3060 5 HCO3- 0.13419E-01 -1.8723 0.11083E-01 -1.9553 0.82595E+00 -0.0830 6 HS- 0.29917E-02 -2.5241 0.24673E-02 -2.6078 0.82470E+00 -0.0837 7 Al+++ 0.16377E-15 -15.7858 0.33793E-16 -16.4712 0.20635E+00 -0.6854 8 H4SiO4 0.10240E-02 -2.9897 0.10240E-02 -2.9897 0.10000E+01 0.0000 9 Ca++ 0.17523E-06 -6.7564 0.85876E-07 -7.0661 0.49008E+00 -0.3097 10 Mg++ 0.78549E-10 -10.1049 0.38292E-10 -10.4169 0.48750E+00 -0.3120 11 Fe++ 0.91532E-14 -14.0384 0.44678E-14 -14.3499 0.48811E+00 -0.3115 12 K+ 0.15427E-03 -3.8117 0.12745E-03 -3.8947 0.82617E+00 -0.0829 13 Na+ 0.22160E-01 -1.6544 0.18268E-01 -1.7383 0.82438E+00 -0.0839 14 Mn++ 0.22026E-08 -8.6571 0.10761E-08 -8.9681 0.48858E+00 -0.3111 15 F- 0.14525E-03 -3.8379 0.11948E-03 -3.9227 0.82261E+00 -0.0848 16 HPO4-- 0.65871E-08 -8.1813 0.32564E-08 -8.4873 0.49436E+00 -0.3060 18 HSiO3- 0.21345E-05 -5.6707 0.17600E-05 -5.7545 0.82456E+00 -0.0838 19 Ca(HSiO3)+ 0.41653E-11 -11.3804 0.34421E-11 -11.4632 0.82638E+00 -0.0828 20 Mg(HSiO3)+ 0.23114E-14 -14.6361 0.19101E-14 -14.7189 0.82638E+00 -0.0828 21 NaHSiO3,aq 0.52000E-06 -6.2840 0.52000E-06 -6.2840 0.10000E+01 0.0000 22 AlO+ 0.18832E-10 -10.7251 0.15562E-10 -10.8079 0.82638E+00 -0.0828 23 AlOH+2 0.86094E-13 -13.0650 0.42111E-13 -13.3756 0.48913E+00 -0.3106 24 HAlO2,aq 0.57012E-08 -8.2440 0.57012E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.28223E-07 -7.5494 0.23223E-07 -7.6341 0.82285E+00 -0.0847 26 CH4,aq 0.31452E-07 -7.5024 0.31149E-07 -7.5066 0.99037E+00 -0.0042 27 C2H6,aq 0.91521E-17 -17.0385 0.90640E-17 -17.0427 0.99037E+00 -0.0042 31 CO,aq 0.59199E-11 -11.2277 0.59199E-11 -11.2277 0.10000E+01 0.0000 32 CO2,aq 0.12999E-01 -1.8861 0.12874E-01 -1.8903 0.99037E+00 -0.0042 33 CO3-2 0.36129E-05 -5.4421 0.17814E-05 -5.7492 0.49307E+00 -0.3071 34 CaCO3,aq 0.19182E-08 -8.7171 0.19182E-08 -8.7171 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.29400E-07 -7.5317 0.24295E-07 -7.6145 0.82638E+00 -0.0828 36 CaCl+ 0.31840E-09 -9.4970 0.26311E-09 -9.5799 0.82638E+00 -0.0828 37 CaCl2,aq 0.11835E-12 -12.9268 0.11835E-12 -12.9268 0.10000E+01 0.0000 38 CaF+ 0.18129E-09 -9.7416 0.14981E-09 -9.8245 0.82638E+00 -0.0828 39 CaOH+ 0.13624E-10 -10.8657 0.11259E-10 -10.9485 0.82638E+00 -0.0828 40 CaSO4,aq 0.23248E-07 -7.6336 0.23248E-07 -7.6336 0.10000E+01 0.0000 41 HCl,aq 0.18853E-09 -9.7246 0.18853E-09 -9.7246 0.10000E+01 0.0000 45 HF,aq 0.44451E-06 -6.3521 0.44451E-06 -6.3521 0.10000E+01 0.0000 46 HF2- 0.21747E-10 -10.6626 0.17932E-10 -10.7464 0.82456E+00 -0.0838 48 FeCl+ 0.16202E-16 -16.7904 0.13389E-16 -16.8733 0.82638E+00 -0.0828 51 FeF+ 0.33011E-16 -16.4813 0.27280E-16 -16.5642 0.82638E+00 -0.0828 53 FeO,aq 0.58780E-18 -18.2308 0.58780E-18 -18.2308 0.10000E+01 0.0000 54 FeOH+ 0.32374E-15 -15.4898 0.26753E-15 -15.5726 0.82638E+00 -0.0828 55 HFeO2- 0.13721E-19 -19.8626 0.11314E-19 -19.9464 0.82456E+00 -0.0838 59 HFeO2,aq 0.22583E-18 -18.6462 0.22583E-18 -18.6462 0.10000E+01 0.0000 60 H2,aq 0.18478E-07 -7.7334 0.18300E-07 -7.7376 0.99037E+00 -0.0042 61 KCl,aq 0.43733E-08 -8.3592 0.43733E-08 -8.3592 0.10000E+01 0.0000 62 KHSO4,aq 0.16695E-12 -12.7774 0.16695E-12 -12.7774 0.10000E+01 0.0000 63 KOH,aq 0.10013E-09 -9.9995 0.10013E-09 -9.9995 0.10000E+01 0.0000 64 KSO4- 0.20448E-05 -5.6894 0.16860E-05 -5.7731 0.82456E+00 -0.0838 65 MgCO3,aq 0.21440E-12 -12.6688 0.21440E-12 -12.6688 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13395E-10 -10.8730 0.11070E-10 -10.9559 0.82638E+00 -0.0828 67 MgCl+ 0.12868E-12 -12.8905 0.10633E-12 -12.9733 0.82638E+00 -0.0828 68 MgF+ 0.29944E-12 -12.5237 0.24745E-12 -12.6065 0.82638E+00 -0.0828 69 MgOH+ 0.33617E-13 -13.4734 0.27780E-13 -13.5563 0.82638E+00 -0.0828 71 MnF+ 0.26208E-11 -11.5816 0.21658E-11 -11.6644 0.82638E+00 -0.0828 72 MnO,aq 0.37726E-14 -14.4234 0.37726E-14 -14.4234 0.10000E+01 0.0000 73 MnOH+ 0.72440E-11 -11.1400 0.59863E-11 -11.2228 0.82638E+00 -0.0828 75 HMnO2- 0.61195E-19 -19.2133 0.50459E-19 -19.2971 0.82456E+00 -0.0838 78 MnCl+ 0.15182E-10 -10.8187 0.12546E-10 -10.9015 0.82638E+00 -0.0828 79 MnSO4,aq 0.26485E-09 -9.5770 0.26485E-09 -9.5770 0.10000E+01 0.0000 80 NaCl,aq 0.11462E-04 -4.9407 0.11462E-04 -4.9407 0.10000E+01 0.0000 81 NaF,aq 0.51102E-06 -6.2916 0.51102E-06 -6.2916 0.10000E+01 0.0000 82 NaOH,aq 0.14438E-07 -7.8405 0.14438E-07 -7.8405 0.10000E+01 0.0000 84 OH- 0.12917E-05 -5.8888 0.10629E-05 -5.9735 0.82285E+00 -0.0847 89 HPO3-2 0.37675E-18 -18.4239 0.18576E-18 -18.7310 0.49307E+00 -0.3071 91 H2PO3- 0.24551E-18 -18.6099 0.20243E-18 -18.6937 0.82456E+00 -0.0838 92 H3PO4,aq 0.67260E-11 -11.1722 0.67260E-11 -11.1722 0.10000E+01 0.0000 93 H2PO4- 0.39548E-07 -7.4029 0.32645E-07 -7.4862 0.82546E+00 -0.0833 94 PO4-3 0.22389E-13 -13.6500 0.48890E-14 -14.3108 0.21836E+00 -0.6608 96 H3P2O7- 0.16999E-19 -19.7696 0.14017E-19 -19.8534 0.82456E+00 -0.0838 97 H2P2O7-2 0.16953E-15 -15.7708 0.83587E-16 -16.0779 0.49307E+00 -0.3071 98 HP2O7-3 0.14866E-15 -15.8278 0.30713E-16 -16.5127 0.20660E+00 -0.6849 99 P2O7-4 0.21305E-18 -18.6715 0.13502E-19 -19.8696 0.63373E-01 -1.1981 100 H2S,aq 0.41842E-02 -2.3784 0.41439E-02 -2.3826 0.99037E+00 -0.0042 101 S2-2 0.14949E-07 -7.8254 0.73709E-08 -8.1325 0.49307E+00 -0.3071 102 S3-2 0.45607E-08 -8.3410 0.22488E-08 -8.6481 0.49307E+00 -0.3071 103 S3- 0.73439E-08 -8.1341 0.60555E-08 -8.2179 0.82456E+00 -0.0838 104 S4-2 0.91913E-09 -9.0366 0.45319E-09 -9.3437 0.49307E+00 -0.3071 105 S5-2 0.12351E-09 -9.9083 0.60900E-10 -10.2154 0.49307E+00 -0.3071 106 SO2,aq 0.20588E-13 -13.6864 0.20588E-13 -13.6864 0.10000E+01 0.0000 107 SO3-2 0.40454E-11 -11.3930 0.20279E-11 -11.6929 0.50129E+00 -0.2999 108 HSO3- 0.83683E-10 -10.0774 0.69001E-10 -10.1611 0.82456E+00 -0.0838 109 HSO4- 0.53967E-06 -6.2679 0.44647E-06 -6.3502 0.82731E+00 -0.0823 111 S2O3-2 0.84189E-07 -7.0747 0.41511E-07 -7.3818 0.49307E+00 -0.3071 112 HS2O3- 0.48917E-11 -11.3105 0.40335E-11 -11.3943 0.82456E+00 -0.0838 113 H2S2O3,aq 0.35139E-16 -16.4542 0.35139E-16 -16.4542 0.10000E+01 0.0000 121 S4O6-2 0.11969E-19 -19.9220 0.59014E-20 -20.2290 0.49307E+00 -0.3071 Charge balance for all species = -.6096E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6544960E-06 0.1717726E-01 0.1727055E+02 0.0000 2 H2O 0.1000000E+01 0.5549525E+02 0.9972749E+06 0.0000 3 Cl- 0.2296076E-02 0.2307542E-02 0.8160566E+02 3.5421 4 SO4-- 0.1724769E-02 0.1727436E-02 0.1655272E+03 9.4604 5 HCO3- 0.1341882E-01 0.2642147E-01 0.1608151E+04 4.3095 6 HS- 0.2991726E-02 0.7176104E-02 0.2367373E+03 3.6571 7 Al+++ 0.1637659E-15 0.3394297E-07 0.9135526E-03 2.3234 8 H4SiO4 0.1023991E-02 0.1026646E-02 0.9843083E+02 -2.9897 9 Ca++ 0.1752290E-06 0.2303126E-06 0.9207492E-02 5.4636 10 Mg++ 0.7854907E-10 0.9262298E-10 0.2246244E-05 2.1128 11 Fe++ 0.9153227E-14 0.9527020E-14 0.5307311E-09 -1.8202 12 K+ 0.1542674E-03 0.1563166E-03 0.6097078E+01 2.3702 13 Na+ 0.2215963E-01 0.2217214E-01 0.5084642E+03 4.5265 14 Mn++ 0.2202604E-08 0.2492509E-08 0.1365926E-03 3.5616 15 F- 0.1452518E-03 0.1462075E-03 0.2770736E+01 2.3422 16 HPO4-- 0.6587148E-08 0.4614165E-07 0.4417605E-02 4.0424 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1550513E-01 0.1551936E-01 -.1422591E-04 0.0000000E+00 2 H2O 0.5011657E+02 0.5013901E+02 -.2243910E-01 0.0000000E+00 3 Cl- 0.2084825E-02 0.2084825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1560717E-02 0.1560709E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2387135E-01 0.2387135E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.6483544E-02 0.6483487E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3066690E-07 0.4744685E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9275568E-03 0.1122546E-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 0.8607500E-14 0.3259226E-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- 0.1320960E-03 0.1320960E-03 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: 0.1046E-20 Mass of aqueous solution: 0.905738E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3299900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2372E-05 -5.625 0.6124E-03 -3.213 0.9077E-01 0.2356E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674757 g Volume = 0.254821 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: 0.3299900 moles log = -0.4815 Original solution: 1000.0103000 g Original solution / Rock added: 3030.43 (Water/Rock Ratio), log = 3.4815 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.5296 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4084E+00 0.9734 0.1006E+01 0.1033E+01 CO2,gas 0.5461E+00 0.9971 0.1377E+01 0.1381E+01 CH4,gas 0.1798E-04 1.0080 0.4585E-04 0.4549E-04 H2,gas 0.9485E-05 1.0013 0.2403E-04 0.2399E-04 H2S,gas 0.4548E-01 0.9902 0.1139E+00 0.1150E+00 S2,gas 0.3336E-12 1.0000 0.8438E-12 0.8438E-12 CO,gas 0.3487E-08 1.0000 0.8822E-08 0.8822E-08 SO3,gas 0.3764E-31 1.0000 0.9522E-31 0.9522E-31 SO2,gas 0.3520E-13 1.0000 0.8903E-13 0.8903E-13 HF,gas 0.4315E-09 1.0000 0.1091E-08 0.1091E-08 HCl,gas 0.1315E-12 1.0000 0.3327E-12 0.3327E-12 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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.22 -1.56 -0.520 0.26635E+04 0.139 3 CH4,gas 4.54 -1.49 -6.04 -1.509 0.10309E+05 -4.339 4 H2,gas 8.00 1.68 -6.32 -3.610 0.10788E+05 -4.619 5 H2S,gas -6.23 -8.87 -2.64 -1.321 0.45118E+04 -0.943 6 S2,gas -7.34 -21.11 -13.77 -2.119 0.23517E+05 -12.074 7 CO,gas 3.21 -6.54 -9.75 -3.001 0.16654E+05 -8.054 8 SO3,gas 17.12 -15.60 -32.72 -8.180 0.55869E+05 -31.021 9 SO2,gas 0.83 -13.92 -14.75 -3.933 0.25184E+05 -13.050 10 HF,gas 0.47 -10.19 -10.66 -5.330 0.18203E+05 -8.962 11 HCl,gas 5.19 -8.99 -14.18 -7.088 0.24207E+05 -12.478 16 albite-high 0.69 -2.12 -2.81 -0.216 0.48009E+04 17 albite -0.38 -2.12 -1.73 -0.133 0.29621E+04 21 analcite 3.32 0.87 -2.45 -0.272 0.41854E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57108E+04 25 anhydrite -5.32 -10.14 -4.82 -2.409 0.82277E+04 38 aragonite 0.97 -2.76 -3.72 -1.241 0.63571E+04 40 calcite 0.81 -2.76 -3.57 -1.189 0.60929E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63804E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94010E+03 69 diamond -3.10 -4.86 -1.75 -0.501 0.29957E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.86 -1.31 -0.374 0.22380E+04 94 heulandite -5.83 -10.82 -4.99 -0.227 0.85199E+04 98 jadeite 4.22 0.87 -3.34 -0.334 0.57106E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54967E+04 104 laumontite 2.88 -1.85 -4.73 -0.315 0.80795E+04 119 microcline -2.49 -4.27 -1.79 -0.138 0.30538E+04 123 muscovite 2.58 0.37 -2.21 -0.130 0.37755E+04 124 paragonite 4.24 2.53 -1.71 -0.101 0.29229E+04 125 nepheline 8.34 3.86 -4.48 -0.640 0.76482E+04 147 pyrrhotiteFe0.875 -6.02 -10.67 -4.66 -1.713 0.79515E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19392E+04 154 rhodochrosite -0.98 -4.66 -3.68 -1.227 0.62874E+04 156 sanidine -1.28 -4.27 -3.00 -0.231 0.51216E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61547E+04 166 stilbite -7.52 -10.82 -3.30 -0.157 0.56263E+04 172 sulfur -9.15 -10.55 -1.40 -0.431 0.23935E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50570E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.66 -3.01 -0.186 0.51417E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55188E+04 198 beidellite-K -1.52 -4.78 -3.26 -0.199 0.55595E+04 199 beidellite-Mg -1.79 -5.21 -3.42 -0.212 0.58395E+04 200 beidellite-Na -1.34 -4.06 -2.72 -0.167 0.46484E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.37 -3.05 -0.382 0.52118E+04 204 montmorillonite-Ca -2.29 -6.48 -4.19 -0.259 0.71522E+04 205 montmorillonite-K -2.24 -6.60 -4.36 -0.267 0.74482E+04 206 montmorillonite-Mg -2.48 -7.03 -4.55 -0.282 0.77733E+04 207 montmorillonite-Na -2.04 -5.89 -3.85 -0.236 0.65728E+04 214 topaz -16.55 -18.72 -2.17 -0.241 0.37082E+04 234 alabandite -0.98 -5.31 -4.33 -1.444 0.73988E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.91 -4.98 -1.660 0.85045E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.87 -2.89 -0.222 0.49286E+04 248 an25ab75 2.65 -0.56 -3.20 -0.246 0.54672E+04 249 an30ab70 3.28 -0.24 -3.52 -0.271 0.60155E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3299900 MOLES New total amount of reactant added: 0.3399900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3399900 Water: Moles liquid = 0.5016E+02 kg liquid = 0.9036E+00 Moles total = 0.5012E+02 kg total = 0.9030E+00 Activity = 0.9997 Stoichiometric ionic strength = .3329657E-01 Osmotic coef. = 0.9021 True ionic strength = .2409140E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2144E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.70777E-06 -6.1501 0.58758E-06 -6.2309 0.83019E+00 -0.0808 2 H2O 0.99967E+00 -0.0001 0.99967E+00 -0.0001 3 Cl- 0.23606E-02 -2.6270 0.19462E-02 -2.7108 0.82443E+00 -0.0838 4 SO4-- 0.17772E-02 -2.7503 0.87791E-03 -3.0565 0.49400E+00 -0.3063 5 HCO3- 0.13291E-01 -1.8764 0.10976E-01 -1.9595 0.82582E+00 -0.0831 6 HS- 0.29419E-02 -2.5314 0.24258E-02 -2.6151 0.82457E+00 -0.0838 7 Al+++ 0.20728E-15 -15.6834 0.42717E-16 -16.3694 0.20609E+00 -0.6860 8 H4SiO4 0.10239E-02 -2.9897 0.10239E-02 -2.9897 0.10000E+01 0.0000 9 Ca++ 0.17502E-06 -6.7569 0.85724E-07 -7.0669 0.48980E+00 -0.3100 10 Mg++ 0.78657E-10 -10.1043 0.38322E-10 -10.4165 0.48721E+00 -0.3123 11 Fe++ 0.91842E-14 -14.0370 0.44803E-14 -14.3487 0.48783E+00 -0.3117 12 K+ 0.15418E-03 -3.8120 0.12736E-03 -3.8950 0.82604E+00 -0.0830 13 Na+ 0.22155E-01 -1.6545 0.18261E-01 -1.7385 0.82425E+00 -0.0839 14 Mn++ 0.21954E-08 -8.6585 0.10720E-08 -8.9698 0.48829E+00 -0.3113 15 F- 0.14959E-03 -3.8251 0.12303E-03 -3.9100 0.82247E+00 -0.0849 16 HPO4-- 0.61593E-08 -8.2105 0.30432E-08 -8.5167 0.49408E+00 -0.3062 18 HSiO3- 0.19744E-05 -5.7046 0.16277E-05 -5.7884 0.82443E+00 -0.0838 19 Ca(HSiO3)+ 0.38460E-11 -11.4150 0.31778E-11 -11.4979 0.82625E+00 -0.0829 20 Mg(HSiO3)+ 0.21397E-14 -14.6696 0.17680E-14 -14.7525 0.82625E+00 -0.0829 21 NaHSiO3,aq 0.48076E-06 -6.3181 0.48076E-06 -6.3181 0.10000E+01 0.0000 22 AlO+ 0.20366E-10 -10.6911 0.16827E-10 -10.7740 0.82625E+00 -0.0829 23 AlOH+2 0.10071E-12 -12.9969 0.49232E-13 -13.3078 0.48884E+00 -0.3108 24 HAlO2,aq 0.57013E-08 -8.2440 0.57013E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.26107E-07 -7.5832 0.21479E-07 -7.6680 0.82271E+00 -0.0848 26 CH4,aq 0.29743E-07 -7.5266 0.29451E-07 -7.5309 0.99019E+00 -0.0043 27 C2H6,aq 0.84420E-17 -17.0736 0.83591E-17 -17.0778 0.99019E+00 -0.0043 31 CO,aq 0.61450E-11 -11.2115 0.61450E-11 -11.2115 0.10000E+01 0.0000 32 CO2,aq 0.13922E-01 -1.8563 0.13785E-01 -1.8606 0.99019E+00 -0.0043 33 CO3-2 0.33111E-05 -5.4800 0.16317E-05 -5.7874 0.49279E+00 -0.3073 34 CaCO3,aq 0.17539E-08 -8.7560 0.17539E-08 -8.7560 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.29069E-07 -7.5366 0.24018E-07 -7.6195 0.82625E+00 -0.0829 36 CaCl+ 0.32677E-09 -9.4858 0.26999E-09 -9.5687 0.82625E+00 -0.0829 37 CaCl2,aq 0.12483E-12 -12.9037 0.12483E-12 -12.9037 0.10000E+01 0.0000 38 CaF+ 0.18636E-09 -9.7296 0.15398E-09 -9.8125 0.82625E+00 -0.0829 39 CaOH+ 0.12580E-10 -10.9003 0.10394E-10 -10.9832 0.82625E+00 -0.0829 40 CaSO4,aq 0.23898E-07 -7.6216 0.23898E-07 -7.6216 0.10000E+01 0.0000 41 HCl,aq 0.20955E-09 -9.6787 0.20955E-09 -9.6787 0.10000E+01 0.0000 45 HF,aq 0.49488E-06 -6.3055 0.49488E-06 -6.3055 0.10000E+01 0.0000 46 HF2- 0.24934E-10 -10.6032 0.20556E-10 -10.6871 0.82443E+00 -0.0838 48 FeCl+ 0.16704E-16 -16.7772 0.13801E-16 -16.8601 0.82625E+00 -0.0829 51 FeF+ 0.34091E-16 -16.4674 0.28168E-16 -16.5502 0.82625E+00 -0.0829 53 FeO,aq 0.50419E-18 -18.2974 0.50419E-18 -18.2974 0.10000E+01 0.0000 54 FeOH+ 0.30030E-15 -15.5224 0.24812E-15 -15.6053 0.82625E+00 -0.0829 55 HFeO2- 0.10887E-19 -19.9631 0.89753E-20 -20.0469 0.82443E+00 -0.0838 59 HFeO2,aq 0.19674E-18 -18.7061 0.19674E-18 -18.7061 0.10000E+01 0.0000 60 H2,aq 0.17915E-07 -7.7468 0.17739E-07 -7.7511 0.99019E+00 -0.0043 61 KCl,aq 0.44923E-08 -8.3475 0.44923E-08 -8.3475 0.10000E+01 0.0000 62 KHSO4,aq 0.18575E-12 -12.7311 0.18575E-12 -12.7311 0.10000E+01 0.0000 63 KOH,aq 0.92535E-10 -10.0337 0.92535E-10 -10.0337 0.10000E+01 0.0000 64 KSO4- 0.21045E-05 -5.6768 0.17350E-05 -5.7607 0.82443E+00 -0.0838 65 MgCO3,aq 0.19653E-12 -12.7066 0.19653E-12 -12.7066 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13279E-10 -10.8768 0.10971E-10 -10.9597 0.82625E+00 -0.0829 67 MgCl+ 0.13240E-12 -12.8781 0.10939E-12 -12.9610 0.82625E+00 -0.0829 68 MgF+ 0.30862E-12 -12.5106 0.25499E-12 -12.5935 0.82625E+00 -0.0829 69 MgOH+ 0.31120E-13 -13.5070 0.25713E-13 -13.5899 0.82625E+00 -0.0829 71 MnF+ 0.26887E-11 -11.5705 0.22215E-11 -11.6533 0.82625E+00 -0.0829 72 MnO,aq 0.32146E-14 -14.4929 0.32146E-14 -14.4929 0.10000E+01 0.0000 73 MnOH+ 0.66750E-11 -11.1756 0.55152E-11 -11.2584 0.82625E+00 -0.0829 75 HMnO2- 0.48233E-19 -19.3167 0.39764E-19 -19.4005 0.82443E+00 -0.0838 78 MnCl+ 0.15549E-10 -10.8083 0.12847E-10 -10.8912 0.82625E+00 -0.0829 79 MnSO4,aq 0.27170E-09 -9.5659 0.27170E-09 -9.5659 0.10000E+01 0.0000 80 NaCl,aq 0.11778E-04 -4.9289 0.11778E-04 -4.9289 0.10000E+01 0.0000 81 NaF,aq 0.52600E-06 -6.2790 0.52600E-06 -6.2790 0.10000E+01 0.0000 82 NaOH,aq 0.13349E-07 -7.8746 0.13349E-07 -7.8746 0.10000E+01 0.0000 84 OH- 0.11948E-05 -5.9227 0.98299E-06 -6.0075 0.82271E+00 -0.0848 89 HPO3-2 0.34149E-18 -18.4666 0.16828E-18 -18.7740 0.49279E+00 -0.3073 91 H2PO3- 0.24051E-18 -18.6189 0.19828E-18 -18.7027 0.82443E+00 -0.0838 92 H3PO4,aq 0.73482E-11 -11.1338 0.73482E-11 -11.1338 0.10000E+01 0.0000 93 H2PO4- 0.39967E-07 -7.3983 0.32986E-07 -7.4817 0.82533E+00 -0.0834 94 PO4-3 0.19375E-13 -13.7128 0.42257E-14 -14.3741 0.21810E+00 -0.6613 96 H3P2O7- 0.18769E-19 -19.7266 0.15473E-19 -19.8104 0.82443E+00 -0.0838 97 H2P2O7-2 0.17318E-15 -15.7615 0.85342E-16 -16.0688 0.49279E+00 -0.3073 98 HP2O7-3 0.14055E-15 -15.8522 0.29002E-16 -16.5376 0.20634E+00 -0.6854 99 P2O7-4 0.18648E-18 -18.7294 0.11792E-19 -19.9284 0.63233E-01 -1.1991 100 H2S,aq 0.44488E-02 -2.3518 0.44052E-02 -2.3560 0.99019E+00 -0.0043 101 S2-2 0.14916E-07 -7.8263 0.73504E-08 -8.1337 0.49279E+00 -0.3073 102 S3-2 0.49905E-08 -8.3019 0.24592E-08 -8.6092 0.49279E+00 -0.3073 103 S3- 0.88213E-08 -8.0545 0.72725E-08 -8.1383 0.82443E+00 -0.0838 104 S4-2 0.11029E-08 -8.9574 0.54351E-09 -9.2648 0.49279E+00 -0.3073 105 S5-2 0.16254E-09 -9.7890 0.80097E-10 -10.0964 0.49279E+00 -0.3073 106 SO2,aq 0.24027E-13 -13.6193 0.24027E-13 -13.6193 0.10000E+01 0.0000 107 SO3-2 0.40405E-11 -11.3936 0.20244E-11 -11.6937 0.50102E+00 -0.3001 108 HSO3- 0.90337E-10 -10.0441 0.74476E-10 -10.1280 0.82443E+00 -0.0838 109 HSO4- 0.60099E-06 -6.2211 0.49712E-06 -6.3035 0.82718E+00 -0.0824 111 S2O3-2 0.92219E-07 -7.0352 0.45444E-07 -7.3425 0.49279E+00 -0.3073 112 HS2O3- 0.57911E-11 -11.2372 0.47743E-11 -11.3211 0.82443E+00 -0.0838 113 H2S2O3,aq 0.44972E-16 -16.3471 0.44972E-16 -16.3471 0.10000E+01 0.0000 121 S4O6-2 0.17309E-19 -19.7617 0.85297E-20 -20.0691 0.49279E+00 -0.3073 Charge balance for all species = -.6095E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7077661E-06 0.1836574E-01 0.1846461E+02 0.0000 2 H2O 0.1000000E+01 0.5549433E+02 0.9972111E+06 0.0000 3 Cl- 0.2360635E-02 0.2372418E-02 0.8389601E+02 3.5201 4 SO4-- 0.1777166E-02 0.1779967E-02 0.1705528E+03 9.4053 5 HCO3- 0.1329138E-01 0.2721681E-01 0.1656481E+04 4.2714 6 HS- 0.2941882E-02 0.7390882E-02 0.2438113E+03 3.6158 7 Al+++ 0.2072794E-15 0.3182878E-07 0.8566100E-03 2.3234 8 H4SiO4 0.1023947E-02 0.1026403E-02 0.9840286E+02 -2.9897 9 Ca++ 0.1750203E-06 0.2302712E-06 0.9205399E-02 5.3950 10 Mg++ 0.7865688E-10 0.9260632E-10 0.2245734E-05 2.0453 11 Fe++ 0.9184222E-14 0.9536036E-14 0.5312082E-09 -1.8868 12 K+ 0.1541794E-03 0.1562885E-03 0.6095692E+01 2.3360 13 Na+ 0.2215535E-01 0.2216815E-01 0.5083487E+03 4.4925 14 Mn++ 0.2195445E-08 0.2492060E-08 0.1365615E-03 3.4921 15 F- 0.1495866E-03 0.1506077E-03 0.2853988E+01 2.3209 16 HPO4-- 0.6159323E-08 0.4613335E-07 0.4416601E-02 3.9452 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1658188E-01 0.1659611E-01 -.1423162E-04 0.0000000E+00 2 H2O 0.5012476E+02 0.5014720E+02 -.2243920E-01 0.0000000E+00 3 Cl- 0.2143825E-02 0.2143825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1608467E-02 0.1608459E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2459435E-01 0.2459435E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.6678794E-02 0.6678737E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2876194E-07 0.4746590E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9275040E-03 0.1122552E-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 0.8617196E-14 0.3259226E-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- 0.1360960E-03 0.1360960E-03 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: -.4500E-21 Mass of aqueous solution: 0.905943E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2373E-05 -5.625 0.6127E-03 -3.213 0.9080E-01 0.2357E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674760 g Volume = 0.254823 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: 0.3399900 moles log = -0.4685 Original solution: 1000.0103000 g Original solution / Rock added: 2941.29 (Water/Rock Ratio), log = 3.4685 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.6360 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3922E+00 0.9728 0.1006E+01 0.1034E+01 CO2,gas 0.5614E+00 0.9966 0.1475E+01 0.1480E+01 CH4,gas 0.1632E-04 1.0079 0.4335E-04 0.4301E-04 H2,gas 0.8822E-05 1.0014 0.2329E-04 0.2326E-04 H2S,gas 0.4641E-01 0.9898 0.1211E+00 0.1223E+00 S2,gas 0.3850E-12 1.0000 0.1015E-11 0.1015E-11 CO,gas 0.3474E-08 1.0000 0.9157E-08 0.9157E-08 SO3,gas 0.4349E-31 1.0000 0.1146E-30 0.1146E-30 SO2,gas 0.3942E-13 1.0000 0.1039E-12 0.1039E-12 HF,gas 0.4610E-09 1.0000 0.1215E-08 0.1215E-08 HCl,gas 0.1403E-12 1.0000 0.3697E-12 0.3697E-12 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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.19 -1.53 -0.510 0.26128E+04 0.169 3 CH4,gas 4.54 -1.52 -6.06 -1.515 0.10351E+05 -4.363 4 H2,gas 8.00 1.67 -6.33 -3.618 0.10811E+05 -4.633 5 H2S,gas -6.23 -8.85 -2.62 -1.308 0.44665E+04 -0.917 6 S2,gas -7.34 -21.03 -13.69 -2.107 0.23380E+05 -11.994 7 CO,gas 3.21 -6.52 -9.74 -2.996 0.16626E+05 -8.038 8 SO3,gas 17.12 -15.52 -32.64 -8.160 0.55731E+05 -30.941 9 SO2,gas 0.83 -13.85 -14.68 -3.915 0.25070E+05 -12.983 10 HF,gas 0.47 -10.14 -10.61 -5.307 0.18124E+05 -8.915 11 HCl,gas 5.19 -8.94 -14.13 -7.066 0.24128E+05 -12.432 16 albite-high 0.69 -2.15 -2.85 -0.219 0.48591E+04 17 albite -0.38 -2.15 -1.77 -0.136 0.30203E+04 21 analcite 3.32 0.84 -2.49 -0.276 0.42436E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57108E+04 25 anhydrite -5.32 -10.12 -4.81 -2.403 0.82072E+04 38 aragonite 0.97 -2.80 -3.76 -1.254 0.64236E+04 40 calcite 0.81 -2.80 -3.61 -1.202 0.61593E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63804E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94009E+03 69 diamond -3.10 -4.85 -1.75 -0.501 0.29911E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.31 -0.374 0.22334E+04 98 jadeite 4.22 0.84 -3.38 -0.338 0.57688E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54967E+04 104 laumontite 2.88 -1.92 -4.80 -0.320 0.81967E+04 119 microcline -2.49 -4.31 -1.82 -0.140 0.31123E+04 123 muscovite 2.58 0.34 -2.25 -0.132 0.38340E+04 124 paragonite 4.24 2.49 -1.75 -0.103 0.29811E+04 125 nepheline 8.34 3.83 -4.51 -0.645 0.77063E+04 147 pyrrhotiteFe0.875 -6.02 -10.70 -4.69 -1.724 0.80028E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19392E+04 154 rhodochrosite -0.98 -4.70 -3.72 -1.241 0.63554E+04 156 sanidine -1.28 -4.31 -3.03 -0.233 0.51800E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61547E+04 166 stilbite -7.52 -10.89 -3.36 -0.160 0.57436E+04 172 sulfur -9.15 -10.51 -1.36 -0.419 0.23250E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50570E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.67 -3.02 -0.187 0.51610E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55188E+04 198 beidellite-K -1.52 -4.79 -3.27 -0.200 0.55787E+04 199 beidellite-Mg -1.79 -5.22 -3.43 -0.212 0.58585E+04 200 beidellite-Na -1.34 -4.08 -2.73 -0.167 0.46676E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.37 -3.06 -0.382 0.52192E+04 204 montmorillonite-Ca -2.29 -6.51 -4.22 -0.261 0.72096E+04 205 montmorillonite-K -2.24 -6.63 -4.40 -0.269 0.75055E+04 206 montmorillonite-Mg -2.48 -7.07 -4.59 -0.284 0.78303E+04 207 montmorillonite-Na -2.04 -5.92 -3.88 -0.238 0.66300E+04 214 topaz -16.55 -18.62 -2.08 -0.231 0.35490E+04 234 alabandite -0.98 -5.35 -4.38 -1.459 0.74721E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.89 -4.96 -1.652 0.84625E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.91 -2.93 -0.225 0.49986E+04 248 an25ab75 2.65 -0.60 -3.24 -0.250 0.55401E+04 249 an30ab70 3.28 -0.29 -3.57 -0.274 0.60913E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3399900 MOLES New total amount of reactant added: 0.3499900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3499900 Water: Moles liquid = 0.5017E+02 kg liquid = 0.9038E+00 Moles total = 0.5013E+02 kg total = 0.9032E+00 Activity = 0.9996 Stoichiometric ionic strength = .3393980E-01 Osmotic coef. = 0.9014 True ionic strength = .2413920E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2203E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.76223E-06 -6.1179 0.63270E-06 -6.1988 0.83006E+00 -0.0809 2 H2O 0.99965E+00 -0.0002 0.99965E+00 -0.0002 3 Cl- 0.24252E-02 -2.6153 0.19991E-02 -2.6992 0.82429E+00 -0.0839 4 SO4-- 0.18295E-02 -2.7377 0.90327E-03 -3.0442 0.49372E+00 -0.3065 5 HCO3- 0.13162E-01 -1.8807 0.10868E-01 -1.9638 0.82569E+00 -0.0832 6 HS- 0.28935E-02 -2.5386 0.23855E-02 -2.6224 0.82443E+00 -0.0838 7 Al+++ 0.25914E-15 -15.5865 0.53336E-16 -16.2730 0.20582E+00 -0.6865 8 H4SiO4 0.10239E-02 -2.9897 0.10239E-02 -2.9897 0.10000E+01 0.0000 9 Ca++ 0.17480E-06 -6.7575 0.85567E-07 -7.0677 0.48951E+00 -0.3102 10 Mg++ 0.78764E-10 -10.1037 0.38352E-10 -10.4162 0.48692E+00 -0.3125 11 Fe++ 0.92231E-14 -14.0351 0.44966E-14 -14.3471 0.48754E+00 -0.3120 12 K+ 0.15409E-03 -3.8122 0.12727E-03 -3.8953 0.82591E+00 -0.0831 13 Na+ 0.22151E-01 -1.6546 0.18255E-01 -1.7386 0.82411E+00 -0.0840 14 Mn++ 0.21883E-08 -8.6599 0.10679E-08 -8.9715 0.48801E+00 -0.3116 15 F- 0.15392E-03 -3.8127 0.12657E-03 -3.8977 0.82234E+00 -0.0849 16 HPO4-- 0.57760E-08 -8.2384 0.28522E-08 -8.5448 0.49380E+00 -0.3065 18 HSiO3- 0.18338E-05 -5.7366 0.15116E-05 -5.8206 0.82429E+00 -0.0839 19 Ca(HSiO3)+ 0.35657E-11 -11.4479 0.29457E-11 -11.5308 0.82612E+00 -0.0830 20 Mg(HSiO3)+ 0.19889E-14 -14.7014 0.16431E-14 -14.7843 0.82612E+00 -0.0830 21 NaHSiO3,aq 0.44630E-06 -6.3504 0.44630E-06 -6.3504 0.10000E+01 0.0000 22 AlO+ 0.21934E-10 -10.6589 0.18120E-10 -10.7418 0.82612E+00 -0.0830 23 AlOH+2 0.11684E-12 -12.9324 0.57085E-13 -13.2435 0.48856E+00 -0.3111 24 HAlO2,aq 0.57014E-08 -8.2440 0.57014E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.24249E-07 -7.6153 0.19947E-07 -7.7001 0.82258E+00 -0.0848 26 CH4,aq 0.28153E-07 -7.5505 0.27871E-07 -7.5548 0.99001E+00 -0.0044 27 C2H6,aq 0.77908E-17 -17.1084 0.77130E-17 -17.1128 0.99001E+00 -0.0044 31 CO,aq 0.63594E-11 -11.1966 0.63594E-11 -11.1966 0.10000E+01 0.0000 32 CO2,aq 0.14846E-01 -1.8284 0.14698E-01 -1.8327 0.99001E+00 -0.0044 33 CO3-2 0.30464E-05 -5.5162 0.15004E-05 -5.8238 0.49250E+00 -0.3076 34 CaCO3,aq 0.16098E-08 -8.7932 0.16098E-08 -8.7932 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.28734E-07 -7.5416 0.23738E-07 -7.6246 0.82612E+00 -0.0830 36 CaCl+ 0.33508E-09 -9.4748 0.27682E-09 -9.5578 0.82612E+00 -0.0830 37 CaCl2,aq 0.13147E-12 -12.8812 0.13147E-12 -12.8812 0.10000E+01 0.0000 38 CaF+ 0.19141E-09 -9.7180 0.15812E-09 -9.8010 0.82612E+00 -0.0830 39 CaOH+ 0.11663E-10 -10.9332 0.96352E-11 -11.0161 0.82612E+00 -0.0830 40 CaSO4,aq 0.24543E-07 -7.6101 0.24543E-07 -7.6101 0.10000E+01 0.0000 41 HCl,aq 0.23177E-09 -9.6349 0.23177E-09 -9.6349 0.10000E+01 0.0000 45 HF,aq 0.54822E-06 -6.2610 0.54822E-06 -6.2610 0.10000E+01 0.0000 46 HF2- 0.28421E-10 -10.5464 0.23427E-10 -10.6303 0.82429E+00 -0.0839 48 FeCl+ 0.17223E-16 -16.7639 0.14228E-16 -16.8469 0.82612E+00 -0.0830 51 FeF+ 0.35206E-16 -16.4534 0.29084E-16 -16.5363 0.82612E+00 -0.0830 53 FeO,aq 0.43642E-18 -18.3601 0.43642E-18 -18.3601 0.10000E+01 0.0000 54 FeOH+ 0.27994E-15 -15.5529 0.23126E-15 -15.6359 0.82612E+00 -0.0830 59 HFeO2,aq 0.17285E-18 -18.7623 0.17285E-18 -18.7623 0.10000E+01 0.0000 60 H2,aq 0.17391E-07 -7.7597 0.17218E-07 -7.7640 0.99001E+00 -0.0044 61 KCl,aq 0.46110E-08 -8.3362 0.46110E-08 -8.3362 0.10000E+01 0.0000 62 KHSO4,aq 0.20564E-12 -12.6869 0.20564E-12 -12.6869 0.10000E+01 0.0000 63 KOH,aq 0.85871E-10 -10.0662 0.85871E-10 -10.0662 0.10000E+01 0.0000 64 KSO4- 0.21641E-05 -5.6647 0.17838E-05 -5.7486 0.82429E+00 -0.0839 65 MgCO3,aq 0.18085E-12 -12.7427 0.18085E-12 -12.7427 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13160E-10 -10.8807 0.10872E-10 -10.9637 0.82612E+00 -0.0830 67 MgCl+ 0.13612E-12 -12.8661 0.11245E-12 -12.9490 0.82612E+00 -0.0830 68 MgF+ 0.31779E-12 -12.4979 0.26254E-12 -12.5808 0.82612E+00 -0.0830 69 MgOH+ 0.28927E-13 -13.5387 0.23897E-13 -13.6217 0.82612E+00 -0.0830 71 MnF+ 0.27559E-11 -11.5597 0.22767E-11 -11.6427 0.82612E+00 -0.0830 72 MnO,aq 0.27617E-14 -14.5588 0.27617E-14 -14.5588 0.10000E+01 0.0000 73 MnOH+ 0.61760E-11 -11.2093 0.51021E-11 -11.2923 0.82612E+00 -0.0830 75 HMnO2- 0.38488E-19 -19.4147 0.31726E-19 -19.4986 0.82429E+00 -0.0839 78 MnCl+ 0.15913E-10 -10.7983 0.13146E-10 -10.8812 0.82612E+00 -0.0830 79 MnSO4,aq 0.27847E-09 -9.5552 0.27847E-09 -9.5552 0.10000E+01 0.0000 80 NaCl,aq 0.12094E-04 -4.9174 0.12094E-04 -4.9174 0.10000E+01 0.0000 81 NaF,aq 0.54095E-06 -6.2668 0.54095E-06 -6.2668 0.10000E+01 0.0000 82 NaOH,aq 0.12392E-07 -7.9069 0.12392E-07 -7.9069 0.10000E+01 0.0000 84 OH- 0.11098E-05 -5.9548 0.91287E-06 -6.0396 0.82258E+00 -0.0848 89 HPO3-2 0.31084E-18 -18.5075 0.15309E-18 -18.8151 0.49250E+00 -0.3076 91 H2PO3- 0.23564E-18 -18.6278 0.19423E-18 -18.7117 0.82429E+00 -0.0839 92 H3PO4,aq 0.79853E-11 -11.0977 0.79853E-11 -11.0977 0.10000E+01 0.0000 93 H2PO4- 0.40341E-07 -7.3943 0.33289E-07 -7.4777 0.82520E+00 -0.0834 94 PO4-3 0.16884E-13 -13.7725 0.36780E-14 -14.4344 0.21784E+00 -0.6619 96 H3P2O7- 0.20588E-19 -19.6864 0.16970E-19 -19.7703 0.82429E+00 -0.0839 97 H2P2O7-2 0.17649E-15 -15.7533 0.86923E-16 -16.0609 0.49250E+00 -0.3076 98 HP2O7-3 0.13312E-15 -15.8758 0.27433E-16 -16.5617 0.20608E+00 -0.6860 99 P2O7-4 0.16417E-18 -18.7847 0.10358E-19 -19.9847 0.63094E-01 -1.2000 100 H2S,aq 0.47118E-02 -2.3268 0.46648E-02 -2.3312 0.99001E+00 -0.0044 101 S2-2 0.14870E-07 -7.8277 0.73237E-08 -8.1353 0.49250E+00 -0.3076 102 S3-2 0.54279E-08 -8.2654 0.26732E-08 -8.5730 0.49250E+00 -0.3076 103 S3- 0.10482E-07 -7.9796 0.86403E-08 -8.0635 0.82429E+00 -0.0839 104 S4-2 0.13087E-08 -8.8831 0.64456E-09 -9.1907 0.49250E+00 -0.3076 105 S5-2 0.21042E-09 -9.6769 0.10363E-09 -9.9845 0.49250E+00 -0.3076 106 SO2,aq 0.27823E-13 -13.5556 0.27823E-13 -13.5556 0.10000E+01 0.0000 107 SO3-2 0.40374E-11 -11.3939 0.20217E-11 -11.6943 0.50074E+00 -0.3004 108 HSO3- 0.97161E-10 -10.0125 0.80090E-10 -10.0964 0.82429E+00 -0.0839 109 HSO4- 0.66593E-06 -6.1766 0.55076E-06 -6.2590 0.82705E+00 -0.0825 111 S2O3-2 0.10053E-06 -6.9977 0.49513E-07 -7.3053 0.49250E+00 -0.3076 112 HS2O3- 0.67953E-11 -11.1678 0.56013E-11 -11.2517 0.82429E+00 -0.0839 113 H2S2O3,aq 0.56814E-16 -16.2455 0.56814E-16 -16.2455 0.10000E+01 0.0000 121 S4O6-2 0.24560E-19 -19.6098 0.12096E-19 -19.9174 0.49250E+00 -0.3076 Charge balance for all species = -.6094E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7622297E-06 0.1955379E-01 0.1965812E+02 0.0000 2 H2O 0.1000000E+01 0.5549340E+02 0.9971473E+06 0.0000 3 Cl- 0.2425172E-02 0.2437271E-02 0.8618531E+02 3.4996 4 SO4-- 0.1829542E-02 0.1832479E-02 0.1755760E+03 9.3534 5 HCO3- 0.1316240E-01 0.2801186E-01 0.1704789E+04 4.2350 6 HS- 0.2893544E-02 0.7605583E-02 0.2508819E+03 3.5764 7 Al+++ 0.2591362E-15 0.2997280E-07 0.8066215E-03 2.3234 8 H4SiO4 0.1023904E-02 0.1026184E-02 0.9837722E+02 -2.9897 9 Ca++ 0.1748005E-06 0.2302297E-06 0.9203307E-02 5.3299 10 Mg++ 0.7876404E-10 0.9258966E-10 0.2245224E-05 1.9814 11 Fe++ 0.9223056E-14 0.9556046E-14 0.5322976E-09 -1.9495 12 K+ 0.1540916E-03 0.1562604E-03 0.6094307E+01 2.3035 13 Na+ 0.2215107E-01 0.2216416E-01 0.5082331E+03 4.4602 14 Mn++ 0.2188290E-08 0.2491612E-08 0.1365305E-03 3.4261 15 F- 0.1539169E-03 0.1550064E-03 0.2937202E+01 2.3011 16 HPO4-- 0.5776014E-08 0.4612505E-07 0.4415598E-02 3.8528 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1765863E-01 0.1767287E-01 -.1423664E-04 0.0000000E+00 2 H2O 0.5013295E+02 0.5015538E+02 -.2243926E-01 0.0000000E+00 3 Cl- 0.2202825E-02 0.2202825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1656217E-02 0.1656209E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2531735E-01 0.2531735E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.6874044E-02 0.6873987E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2708966E-07 0.4748262E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9274732E-03 0.1122555E-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 0.8636832E-14 0.3259226E-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- 0.1400960E-03 0.1400960E-03 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: 0.5426E-21 Mass of aqueous solution: 0.906149E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3499900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2374E-05 -5.624 0.6129E-03 -3.213 0.9083E-01 0.2358E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674762 g Volume = 0.254823 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: 0.3499900 moles log = -0.4559 Original solution: 1000.0103000 g Original solution / Rock added: 2857.25 (Water/Rock Ratio), log = 3.4559 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.7426 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3771E+00 0.9722 0.1006E+01 0.1034E+01 CO2,gas 0.5756E+00 0.9961 0.1573E+01 0.1579E+01 CH4,gas 0.1484E-04 1.0078 0.4102E-04 0.4071E-04 H2,gas 0.8230E-05 1.0015 0.2260E-04 0.2257E-04 H2S,gas 0.4726E-01 0.9894 0.1282E+00 0.1296E+00 S2,gas 0.4404E-12 1.0000 0.1208E-11 0.1208E-11 CO,gas 0.3455E-08 1.0000 0.9477E-08 0.9477E-08 SO3,gas 0.4987E-31 1.0000 0.1368E-30 0.1368E-30 SO2,gas 0.4387E-13 1.0000 0.1203E-12 0.1203E-12 HF,gas 0.4908E-09 1.0000 0.1346E-08 0.1346E-08 HCl,gas 0.1491E-12 1.0000 0.4090E-12 0.4090E-12 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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.16 -1.50 -0.501 0.25653E+04 0.197 3 CH4,gas 4.54 -1.54 -6.09 -1.521 0.10392E+05 -4.387 4 H2,gas 8.00 1.65 -6.34 -3.626 0.10834E+05 -4.646 5 H2S,gas -6.23 -8.82 -2.59 -1.295 0.44240E+04 -0.892 6 S2,gas -7.34 -20.95 -13.62 -2.095 0.23251E+05 -11.918 7 CO,gas 3.21 -6.51 -9.72 -2.991 0.16601E+05 -8.023 8 SO3,gas 17.12 -15.44 -32.56 -8.141 0.55600E+05 -30.864 9 SO2,gas 0.83 -13.79 -14.62 -3.898 0.24961E+05 -12.920 10 HF,gas 0.47 -10.10 -10.57 -5.285 0.18048E+05 -8.871 11 HCl,gas 5.19 -8.90 -14.09 -7.044 0.24054E+05 -12.388 16 albite-high 0.69 -2.18 -2.88 -0.221 0.49142E+04 17 albite -0.38 -2.18 -1.80 -0.139 0.30754E+04 21 analcite 3.32 0.80 -2.52 -0.280 0.42987E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57107E+04 25 anhydrite -5.32 -10.11 -4.80 -2.398 0.81875E+04 38 aragonite 0.97 -2.83 -3.80 -1.266 0.64871E+04 40 calcite 0.81 -2.83 -3.64 -1.215 0.62229E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63803E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94008E+03 69 diamond -3.10 -4.85 -1.75 -0.500 0.29878E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.31 -0.373 0.22300E+04 98 jadeite 4.22 0.80 -3.41 -0.341 0.58239E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54966E+04 104 laumontite 2.88 -1.98 -4.87 -0.324 0.83079E+04 119 microcline -2.49 -4.34 -1.86 -0.143 0.31676E+04 123 muscovite 2.58 0.30 -2.28 -0.134 0.38893E+04 124 paragonite 4.24 2.46 -1.78 -0.105 0.30362E+04 125 nepheline 8.34 3.79 -4.55 -0.649 0.77614E+04 147 pyrrhotiteFe0.875 -6.02 -10.73 -4.72 -1.734 0.80513E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19392E+04 154 rhodochrosite -0.98 -4.74 -3.76 -1.253 0.64204E+04 156 sanidine -1.28 -4.34 -3.07 -0.236 0.52354E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61547E+04 166 stilbite -7.52 -10.95 -3.43 -0.163 0.58547E+04 172 sulfur -9.15 -10.48 -1.32 -0.407 0.22605E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50570E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.68 -3.03 -0.188 0.51793E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55187E+04 198 beidellite-K -1.52 -4.80 -3.28 -0.201 0.55970E+04 199 beidellite-Mg -1.79 -5.23 -3.44 -0.213 0.58765E+04 200 beidellite-Na -1.34 -4.09 -2.74 -0.168 0.46857E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.38 -3.06 -0.383 0.52268E+04 204 montmorillonite-Ca -2.29 -6.54 -4.25 -0.263 0.72639E+04 205 montmorillonite-K -2.24 -6.66 -4.43 -0.271 0.75598E+04 206 montmorillonite-Mg -2.48 -7.10 -4.62 -0.286 0.78843E+04 207 montmorillonite-Na -2.04 -5.95 -3.91 -0.240 0.66842E+04 214 topaz -16.55 -18.54 -1.99 -0.221 0.33971E+04 234 alabandite -0.98 -5.40 -4.42 -1.472 0.75423E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.86 -4.93 -1.644 0.84218E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.95 -2.97 -0.228 0.50649E+04 248 an25ab75 2.65 -0.64 -3.29 -0.253 0.56093E+04 249 an30ab70 3.28 -0.33 -3.61 -0.278 0.61632E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3499900 MOLES New total amount of reactant added: 0.3599900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3599900 Water: Moles liquid = 0.5018E+02 kg liquid = 0.9040E+00 Moles total = 0.5014E+02 kg total = 0.9033E+00 Activity = 0.9996 Stoichiometric ionic strength = .3458283E-01 Osmotic coef. = 0.9008 True ionic strength = .2418701E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2262E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.81792E-06 -6.0873 0.67883E-06 -6.1682 0.82994E+00 -0.0810 2 H2O 0.99963E+00 -0.0002 0.99963E+00 -0.0002 3 Cl- 0.24897E-02 -2.6039 0.20519E-02 -2.6878 0.82416E+00 -0.0840 4 SO4-- 0.18819E-02 -2.7254 0.92859E-03 -3.0322 0.49344E+00 -0.3068 5 HCO3- 0.13032E-01 -1.8850 0.10759E-01 -1.9682 0.82556E+00 -0.0833 6 HS- 0.28466E-02 -2.5457 0.23464E-02 -2.6296 0.82430E+00 -0.0839 7 Al+++ 0.32047E-15 -15.4942 0.65877E-16 -16.1813 0.20556E+00 -0.6871 8 H4SiO4 0.10239E-02 -2.9898 0.10239E-02 -2.9898 0.10000E+01 0.0000 9 Ca++ 0.17457E-06 -6.7580 0.85406E-07 -7.0685 0.48923E+00 -0.3105 10 Mg++ 0.78871E-10 -10.1031 0.38381E-10 -10.4159 0.48664E+00 -0.3128 11 Fe++ 0.92691E-14 -14.0330 0.45164E-14 -14.3452 0.48725E+00 -0.3122 12 K+ 0.15400E-03 -3.8125 0.12717E-03 -3.8956 0.82578E+00 -0.0831 13 Na+ 0.22147E-01 -1.6547 0.18249E-01 -1.7388 0.82398E+00 -0.0841 14 Mn++ 0.21812E-08 -8.6613 0.10638E-08 -8.9731 0.48772E+00 -0.3118 15 F- 0.15824E-03 -3.8007 0.13011E-03 -3.8857 0.82220E+00 -0.0850 16 HPO4-- 0.54306E-08 -8.2651 0.26801E-08 -8.5718 0.49352E+00 -0.3067 18 HSiO3- 0.17095E-05 -5.7671 0.14089E-05 -5.8511 0.82416E+00 -0.0840 19 Ca(HSiO3)+ 0.33176E-11 -11.4792 0.27403E-11 -11.5622 0.82599E+00 -0.0830 20 Mg(HSiO3)+ 0.18555E-14 -14.7315 0.15326E-14 -14.8146 0.82599E+00 -0.0830 21 NaHSiO3,aq 0.41582E-06 -6.3811 0.41582E-06 -6.3811 0.10000E+01 0.0000 22 AlO+ 0.23537E-10 -10.6282 0.19441E-10 -10.7113 0.82599E+00 -0.0830 23 AlOH+2 0.13459E-12 -12.8710 0.65715E-13 -13.1823 0.48827E+00 -0.3113 24 HAlO2,aq 0.57014E-08 -8.2440 0.57014E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.22605E-07 -7.6458 0.18592E-07 -7.7307 0.82245E+00 -0.0849 26 CH4,aq 0.26669E-07 -7.5740 0.26398E-07 -7.5784 0.98983E+00 -0.0044 27 C2H6,aq 0.71935E-17 -17.1431 0.71203E-17 -17.1475 0.98983E+00 -0.0044 31 CO,aq 0.65639E-11 -11.1828 0.65639E-11 -11.1828 0.10000E+01 0.0000 32 CO2,aq 0.15772E-01 -1.8021 0.15611E-01 -1.8066 0.98983E+00 -0.0044 33 CO3-2 0.28124E-05 -5.5509 0.13843E-05 -5.8588 0.49222E+00 -0.3078 34 CaCO3,aq 0.14825E-08 -8.8290 0.14825E-08 -8.8290 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.28396E-07 -7.5467 0.23455E-07 -7.6298 0.82599E+00 -0.0830 36 CaCl+ 0.34335E-09 -9.4643 0.28360E-09 -9.5473 0.82599E+00 -0.0830 37 CaCl2,aq 0.13825E-12 -12.8593 0.13825E-12 -12.8593 0.10000E+01 0.0000 38 CaF+ 0.19641E-09 -9.7068 0.16224E-09 -9.7899 0.82599E+00 -0.0830 39 CaOH+ 0.10852E-10 -10.9645 0.89633E-11 -11.0475 0.82599E+00 -0.0830 40 CaSO4,aq 0.25184E-07 -7.5989 0.25184E-07 -7.5989 0.10000E+01 0.0000 41 HCl,aq 0.25524E-09 -9.5930 0.25524E-09 -9.5930 0.10000E+01 0.0000 45 HF,aq 0.60462E-06 -6.2185 0.60462E-06 -6.2185 0.10000E+01 0.0000 46 HF2- 0.32226E-10 -10.4918 0.26559E-10 -10.5758 0.82416E+00 -0.0840 48 FeCl+ 0.17759E-16 -16.7506 0.14668E-16 -16.8336 0.82599E+00 -0.0830 51 FeF+ 0.36354E-16 -16.4394 0.30028E-16 -16.5225 0.82599E+00 -0.0830 53 FeO,aq 0.38078E-18 -18.4193 0.38078E-18 -18.4193 0.10000E+01 0.0000 54 FeOH+ 0.26210E-15 -15.5815 0.21649E-15 -15.6646 0.82599E+00 -0.0830 59 HFeO2,aq 0.15299E-18 -18.8153 0.15299E-18 -18.8153 0.10000E+01 0.0000 60 H2,aq 0.16903E-07 -7.7720 0.16731E-07 -7.7765 0.98983E+00 -0.0044 61 KCl,aq 0.47295E-08 -8.3252 0.47295E-08 -8.3252 0.10000E+01 0.0000 62 KHSO4,aq 0.22666E-12 -12.6446 0.22666E-12 -12.6446 0.10000E+01 0.0000 63 KOH,aq 0.79976E-10 -10.0970 0.79976E-10 -10.0970 0.10000E+01 0.0000 64 KSO4- 0.22235E-05 -5.6530 0.18325E-05 -5.7370 0.82416E+00 -0.0840 65 MgCO3,aq 0.16700E-12 -12.7773 0.16700E-12 -12.7773 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.13040E-10 -10.8847 0.10771E-10 -10.9678 0.82599E+00 -0.0830 67 MgCl+ 0.13985E-12 -12.8543 0.11551E-12 -12.9374 0.82599E+00 -0.0830 68 MgF+ 0.32697E-12 -12.4855 0.27008E-12 -12.5685 0.82599E+00 -0.0830 69 MgOH+ 0.26985E-13 -13.5689 0.22290E-13 -13.6519 0.82599E+00 -0.0830 71 MnF+ 0.28224E-11 -11.5494 0.23313E-11 -11.6324 0.82599E+00 -0.0830 72 MnO,aq 0.23899E-14 -14.6216 0.23899E-14 -14.6216 0.10000E+01 0.0000 73 MnOH+ 0.57349E-11 -11.2415 0.47370E-11 -11.3245 0.82599E+00 -0.0830 75 HMnO2- 0.31047E-19 -19.5080 0.25588E-19 -19.5920 0.82416E+00 -0.0840 78 MnCl+ 0.16273E-10 -10.7885 0.13442E-10 -10.8715 0.82599E+00 -0.0830 79 MnSO4,aq 0.28518E-09 -9.5449 0.28518E-09 -9.5449 0.10000E+01 0.0000 80 NaCl,aq 0.12409E-04 -4.9063 0.12409E-04 -4.9063 0.10000E+01 0.0000 81 NaF,aq 0.55586E-06 -6.2550 0.55586E-06 -6.2550 0.10000E+01 0.0000 82 NaOH,aq 0.11546E-07 -7.9376 0.11546E-07 -7.9376 0.10000E+01 0.0000 84 OH- 0.10345E-05 -5.9853 0.85082E-06 -6.0702 0.82245E+00 -0.0849 89 HPO3-2 0.28400E-18 -18.5467 0.13979E-18 -18.8545 0.49222E+00 -0.3078 91 H2PO3- 0.23089E-18 -18.6366 0.19029E-18 -18.7206 0.82416E+00 -0.0840 92 H3PO4,aq 0.86376E-11 -11.0636 0.86376E-11 -11.0636 0.10000E+01 0.0000 93 H2PO4- 0.40677E-07 -7.3906 0.33562E-07 -7.4742 0.82507E+00 -0.0835 94 PO4-3 0.14805E-13 -13.8296 0.32213E-14 -14.4920 0.21759E+00 -0.6624 96 H3P2O7- 0.22456E-19 -19.6487 0.18507E-19 -19.7327 0.82416E+00 -0.0840 97 H2P2O7-2 0.17950E-15 -15.7459 0.88353E-16 -16.0538 0.49222E+00 -0.3078 98 HP2O7-3 0.12627E-15 -15.8987 0.25989E-16 -16.5852 0.20582E+00 -0.6865 99 P2O7-4 0.14528E-18 -18.8378 0.91462E-20 -20.0388 0.62956E-01 -1.2010 100 H2S,aq 0.49734E-02 -2.3033 0.49228E-02 -2.3078 0.98983E+00 -0.0044 101 S2-2 0.14814E-07 -7.8293 0.72916E-08 -8.1372 0.49222E+00 -0.3078 102 S3-2 0.58722E-08 -8.2312 0.28904E-08 -8.5390 0.49222E+00 -0.3078 103 S3- 0.12337E-07 -7.9088 0.10168E-07 -7.9928 0.82416E+00 -0.0840 104 S4-2 0.15377E-08 -8.8131 0.75687E-09 -9.1210 0.49222E+00 -0.3078 105 S5-2 0.26848E-09 -9.5711 0.13215E-09 -9.8789 0.49222E+00 -0.3078 106 SO2,aq 0.31997E-13 -13.4949 0.31997E-13 -13.4949 0.10000E+01 0.0000 107 SO3-2 0.40356E-11 -11.3941 0.20197E-11 -11.6947 0.50047E+00 -0.3006 108 HSO3- 0.10416E-09 -9.9823 0.85844E-10 -10.0663 0.82416E+00 -0.0840 109 HSO4- 0.73463E-06 -6.1339 0.60748E-06 -6.2165 0.82693E+00 -0.0825 111 S2O3-2 0.10913E-06 -6.9620 0.53718E-07 -7.2699 0.49222E+00 -0.3078 112 HS2O3- 0.79112E-11 -11.1018 0.65201E-11 -11.1857 0.82416E+00 -0.0840 113 H2S2O3,aq 0.70954E-16 -16.1490 0.70954E-16 -16.1490 0.10000E+01 0.0000 121 S4O6-2 0.34265E-19 -19.4652 0.16866E-19 -19.7730 0.49222E+00 -0.3078 Charge balance for all species = -.6093E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.8179237E-06 0.2074141E-01 0.2085109E+02 0.0000 2 H2O 0.1000000E+01 0.5549248E+02 0.9970835E+06 0.0000 3 Cl- 0.2489686E-02 0.2502100E-02 0.8847358E+02 3.4804 4 SO4-- 0.1881894E-02 0.1884972E-02 0.1805970E+03 9.3043 5 HCO3- 0.1303203E-01 0.2880663E-01 0.1753075E+04 4.2000 6 HS- 0.2846574E-02 0.7820206E-02 0.2579494E+03 3.5387 7 Al+++ 0.3204735E-15 0.2833055E-07 0.7623896E-03 2.3235 8 H4SiO4 0.1023860E-02 0.1025985E-02 0.9835353E+02 -2.9898 9 Ca++ 0.1745720E-06 0.2301883E-06 0.9201216E-02 5.2680 10 Mg++ 0.7887077E-10 0.9257300E-10 0.2244714E-05 1.9206 11 Fe++ 0.9269073E-14 0.9585831E-14 0.5339315E-09 -2.0087 12 K+ 0.1540040E-03 0.1562323E-03 0.6092922E+01 2.2726 13 Na+ 0.2214678E-01 0.2216018E-01 0.5081177E+03 4.4295 14 Mn++ 0.2181150E-08 0.2491164E-08 0.1364995E-03 3.3633 15 F- 0.1582427E-03 0.1594034E-03 0.3020378E+01 2.2825 16 HPO4-- 0.5430628E-08 0.4611675E-07 0.4414595E-02 3.7646 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1873538E-01 0.1874962E-01 -.1424108E-04 0.0000000E+00 2 H2O 0.5014113E+02 0.5016357E+02 -.2243928E-01 0.0000000E+00 3 Cl- 0.2261825E-02 0.2261825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1703967E-02 0.1703959E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2604035E-01 0.2604035E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.7069294E-02 0.7069237E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2560999E-07 0.4749742E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9274605E-03 0.1122556E-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 0.8665310E-14 0.3259226E-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- 0.1440960E-03 0.1440960E-03 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: 0.3441E-21 Mass of aqueous solution: 0.906355E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2375E-05 -5.624 0.6131E-03 -3.212 0.9086E-01 0.2359E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674763 g Volume = 0.254824 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: 0.3599900 moles log = -0.4437 Original solution: 1000.0103000 g Original solution / Rock added: 2777.88 (Water/Rock Ratio), log = 3.4437 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.8493 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3632E+00 0.9716 0.1006E+01 0.1035E+01 CO2,gas 0.5887E+00 0.9957 0.1670E+01 0.1677E+01 CH4,gas 0.1353E-04 1.0077 0.3886E-04 0.3856E-04 H2,gas 0.7698E-05 1.0015 0.2197E-04 0.2193E-04 H2S,gas 0.4802E-01 0.9890 0.1353E+00 0.1368E+00 S2,gas 0.5000E-12 1.0000 0.1425E-11 0.1425E-11 CO,gas 0.3433E-08 1.0000 0.9781E-08 0.9781E-08 SO3,gas 0.5680E-31 1.0000 0.1619E-30 0.1619E-30 SO2,gas 0.4856E-13 1.0000 0.1384E-12 0.1384E-12 HF,gas 0.5210E-09 1.0000 0.1485E-08 0.1485E-08 HCl,gas 0.1581E-12 1.0000 0.4504E-12 0.4504E-12 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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.14 -1.48 -0.492 0.25206E+04 0.223 3 CH4,gas 4.54 -1.57 -6.11 -1.527 0.10432E+05 -4.411 4 H2,gas 8.00 1.64 -6.36 -3.633 0.10855E+05 -4.658 5 H2S,gas -6.23 -8.80 -2.57 -1.284 0.43841E+04 -0.869 6 S2,gas -7.34 -20.88 -13.55 -2.084 0.23128E+05 -11.846 7 CO,gas 3.21 -6.49 -9.71 -2.987 0.16577E+05 -8.010 8 SO3,gas 17.12 -15.37 -32.49 -8.122 0.55476E+05 -30.791 9 SO2,gas 0.83 -13.73 -14.56 -3.882 0.24857E+05 -12.859 10 HF,gas 0.47 -10.05 -10.53 -5.264 0.17975E+05 -8.828 11 HCl,gas 5.19 -8.86 -14.05 -7.023 0.23982E+05 -12.346 16 albite-high 0.69 -2.22 -2.91 -0.224 0.49666E+04 17 albite -0.38 -2.22 -1.83 -0.141 0.31278E+04 21 analcite 3.32 0.77 -2.55 -0.283 0.43511E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57107E+04 25 anhydrite -5.32 -10.10 -4.78 -2.392 0.81684E+04 38 aragonite 0.97 -2.87 -3.84 -1.278 0.65482E+04 40 calcite 0.81 -2.87 -3.68 -1.227 0.62840E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63803E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94008E+03 69 diamond -3.10 -4.85 -1.75 -0.500 0.29855E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.30 -0.373 0.22278E+04 98 jadeite 4.22 0.77 -3.44 -0.344 0.58763E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54966E+04 104 laumontite 2.88 -2.04 -4.93 -0.329 0.84137E+04 119 microcline -2.49 -4.37 -1.89 -0.145 0.32204E+04 123 muscovite 2.58 0.27 -2.31 -0.136 0.39420E+04 124 paragonite 4.24 2.43 -1.81 -0.106 0.30886E+04 125 nepheline 8.34 3.76 -4.58 -0.654 0.78139E+04 147 pyrrhotiteFe0.875 -6.02 -10.76 -4.74 -1.744 0.80972E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19391E+04 154 rhodochrosite -0.98 -4.77 -3.80 -1.266 0.64830E+04 156 sanidine -1.28 -4.37 -3.10 -0.238 0.52881E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61546E+04 166 stilbite -7.52 -11.01 -3.49 -0.166 0.59606E+04 172 sulfur -9.15 -10.44 -1.29 -0.396 0.21993E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50570E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.69 -3.04 -0.188 0.51967E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55187E+04 198 beidellite-K -1.52 -4.81 -3.29 -0.201 0.56144E+04 199 beidellite-Mg -1.79 -5.24 -3.45 -0.214 0.58936E+04 200 beidellite-Na -1.34 -4.10 -2.75 -0.169 0.47030E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.38 -3.07 -0.383 0.52346E+04 204 montmorillonite-Ca -2.29 -6.58 -4.28 -0.265 0.73156E+04 205 montmorillonite-K -2.24 -6.69 -4.46 -0.273 0.76115E+04 206 montmorillonite-Mg -2.48 -7.13 -4.65 -0.288 0.79357E+04 207 montmorillonite-Na -2.04 -5.98 -3.94 -0.242 0.67358E+04 214 topaz -16.55 -18.45 -1.90 -0.212 0.32518E+04 234 alabandite -0.98 -5.43 -4.46 -1.486 0.76096E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.84 -4.91 -1.636 0.83823E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -0.99 -3.00 -0.231 0.51280E+04 248 an25ab75 2.65 -0.68 -3.32 -0.256 0.56750E+04 249 an30ab70 3.28 -0.37 -3.65 -0.281 0.62316E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3599900 MOLES New total amount of reactant added: 0.3699900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3699900 Water: Moles liquid = 0.5019E+02 kg liquid = 0.9041E+00 Moles total = 0.5015E+02 kg total = 0.9035E+00 Activity = 0.9996 Stoichiometric ionic strength = .3522565E-01 Osmotic coef. = 0.9002 True ionic strength = .2423482E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2321E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.87489E-06 -6.0580 0.72600E-06 -6.1391 0.82982E+00 -0.0810 2 H2O 0.99961E+00 -0.0002 0.99961E+00 -0.0002 3 Cl- 0.25542E-02 -2.5927 0.21047E-02 -2.6768 0.82403E+00 -0.0841 4 SO4-- 0.19342E-02 -2.7135 0.95388E-03 -3.0205 0.49316E+00 -0.3070 5 HCO3- 0.12900E-01 -1.8894 0.10648E-01 -1.9727 0.82543E+00 -0.0833 6 HS- 0.28008E-02 -2.5527 0.23084E-02 -2.6367 0.82417E+00 -0.0840 7 Al+++ 0.39255E-15 -15.4061 0.80590E-16 -16.0937 0.20530E+00 -0.6876 8 H4SiO4 0.10238E-02 -2.9898 0.10238E-02 -2.9898 0.10000E+01 0.0000 9 Ca++ 0.17434E-06 -6.7586 0.85241E-07 -7.0693 0.48895E+00 -0.3107 10 Mg++ 0.78977E-10 -10.1025 0.38411E-10 -10.4155 0.48635E+00 -0.3130 11 Fe++ 0.93218E-14 -14.0305 0.45394E-14 -14.3430 0.48697E+00 -0.3125 12 K+ 0.15392E-03 -3.8127 0.12708E-03 -3.8959 0.82565E+00 -0.0832 13 Na+ 0.22142E-01 -1.6548 0.18242E-01 -1.7389 0.82385E+00 -0.0842 14 Mn++ 0.21740E-08 -8.6627 0.10597E-08 -8.9748 0.48744E+00 -0.3121 15 F- 0.16256E-03 -3.7890 0.13364E-03 -3.8741 0.82207E+00 -0.0851 16 HPO4-- 0.51178E-08 -8.2909 0.25243E-08 -8.5979 0.49324E+00 -0.3069 18 HSiO3- 0.15986E-05 -5.7963 0.13173E-05 -5.8803 0.82403E+00 -0.0841 19 Ca(HSiO3)+ 0.30965E-11 -11.5091 0.25572E-11 -11.5922 0.82586E+00 -0.0831 20 Mg(HSiO3)+ 0.17365E-14 -14.7603 0.14341E-14 -14.8434 0.82586E+00 -0.0831 21 NaHSiO3,aq 0.38866E-06 -6.4104 0.38866E-06 -6.4104 0.10000E+01 0.0000 22 AlO+ 0.25177E-10 -10.5990 0.20793E-10 -10.6821 0.82586E+00 -0.0831 23 AlOH+2 0.15403E-12 -12.8124 0.75167E-13 -13.1240 0.48799E+00 -0.3116 24 HAlO2,aq 0.57015E-08 -8.2440 0.57015E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.21140E-07 -7.6749 0.17384E-07 -7.7598 0.82231E+00 -0.0850 26 CH4,aq 0.25283E-07 -7.5972 0.25022E-07 -7.6017 0.98965E+00 -0.0045 27 C2H6,aq 0.66452E-17 -17.1775 0.65764E-17 -17.1820 0.98965E+00 -0.0045 31 CO,aq 0.67590E-11 -11.1701 0.67590E-11 -11.1701 0.10000E+01 0.0000 32 CO2,aq 0.16698E-01 -1.7773 0.16525E-01 -1.7819 0.98965E+00 -0.0045 33 CO3-2 0.26042E-05 -5.5843 0.12811E-05 -5.8924 0.49194E+00 -0.3081 34 CaCO3,aq 0.13693E-08 -8.8635 0.13693E-08 -8.8635 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.28055E-07 -7.5520 0.23170E-07 -7.6351 0.82586E+00 -0.0831 36 CaCl+ 0.35156E-09 -9.4540 0.29034E-09 -9.5371 0.82586E+00 -0.0831 37 CaCl2,aq 0.14518E-12 -12.8381 0.14518E-12 -12.8381 0.10000E+01 0.0000 38 CaF+ 0.20139E-09 -9.6960 0.16632E-09 -9.7791 0.82586E+00 -0.0831 39 CaOH+ 0.10128E-10 -10.9945 0.83647E-11 -11.0776 0.82586E+00 -0.0831 40 CaSO4,aq 0.25820E-07 -7.5881 0.25820E-07 -7.5881 0.10000E+01 0.0000 41 HCl,aq 0.28000E-09 -9.5528 0.28000E-09 -9.5528 0.10000E+01 0.0000 45 HF,aq 0.66418E-06 -6.1777 0.66418E-06 -6.1777 0.10000E+01 0.0000 46 HF2- 0.36367E-10 -10.4393 0.29968E-10 -10.5233 0.82403E+00 -0.0841 48 FeCl+ 0.18312E-16 -16.7373 0.15123E-16 -16.8204 0.82586E+00 -0.0831 51 FeF+ 0.37537E-16 -16.4255 0.31000E-16 -16.5086 0.82586E+00 -0.0831 53 FeO,aq 0.33460E-18 -18.4755 0.33460E-18 -18.4755 0.10000E+01 0.0000 54 FeOH+ 0.24635E-15 -15.6084 0.20345E-15 -15.6915 0.82586E+00 -0.0831 59 HFeO2,aq 0.13630E-18 -18.8655 0.13630E-18 -18.8655 0.10000E+01 0.0000 60 H2,aq 0.16446E-07 -7.7839 0.16275E-07 -7.7885 0.98965E+00 -0.0045 61 KCl,aq 0.48477E-08 -8.3145 0.48477E-08 -8.3145 0.10000E+01 0.0000 62 KHSO4,aq 0.24882E-12 -12.6041 0.24882E-12 -12.6041 0.10000E+01 0.0000 63 KOH,aq 0.74725E-10 -10.1265 0.74725E-10 -10.1265 0.10000E+01 0.0000 64 KSO4- 0.22827E-05 -5.6415 0.18810E-05 -5.7256 0.82403E+00 -0.0841 65 MgCO3,aq 0.15466E-12 -12.8106 0.15466E-12 -12.8106 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12918E-10 -10.8888 0.10668E-10 -10.9719 0.82586E+00 -0.0831 67 MgCl+ 0.14358E-12 -12.8429 0.11858E-12 -12.9260 0.82586E+00 -0.0831 68 MgF+ 0.33616E-12 -12.4735 0.27762E-12 -12.5566 0.82586E+00 -0.0831 69 MgOH+ 0.25255E-13 -13.5977 0.20857E-13 -13.6807 0.82586E+00 -0.0831 71 MnF+ 0.28883E-11 -11.5394 0.23854E-11 -11.6224 0.82586E+00 -0.0831 72 MnO,aq 0.20813E-14 -14.6817 0.20813E-14 -14.6817 0.10000E+01 0.0000 73 MnOH+ 0.53424E-11 -11.2723 0.44121E-11 -11.3554 0.82586E+00 -0.0831 75 HMnO2- 0.25285E-19 -19.5971 0.20836E-19 -19.6812 0.82403E+00 -0.0841 78 MnCl+ 0.16631E-10 -10.7791 0.13735E-10 -10.8622 0.82586E+00 -0.0831 79 MnSO4,aq 0.29182E-09 -9.5349 0.29182E-09 -9.5349 0.10000E+01 0.0000 80 NaCl,aq 0.12724E-04 -4.8954 0.12724E-04 -4.8954 0.10000E+01 0.0000 81 NaF,aq 0.57075E-06 -6.2436 0.57075E-06 -6.2436 0.10000E+01 0.0000 82 NaOH,aq 0.10792E-07 -7.9669 0.10792E-07 -7.9669 0.10000E+01 0.0000 84 OH- 0.96742E-06 -6.0144 0.79552E-06 -6.0993 0.82231E+00 -0.0850 89 HPO3-2 0.26036E-18 -18.5844 0.12808E-18 -18.8925 0.49194E+00 -0.3081 91 H2PO3- 0.22629E-18 -18.6453 0.18647E-18 -18.7294 0.82403E+00 -0.0841 92 H3PO4,aq 0.93053E-11 -11.0313 0.93053E-11 -11.0313 0.10000E+01 0.0000 93 H2PO4- 0.40981E-07 -7.3874 0.33807E-07 -7.4710 0.82494E+00 -0.0836 94 PO4-3 0.13053E-13 -13.8843 0.28369E-14 -14.5472 0.21733E+00 -0.6629 96 H3P2O7- 0.24373E-19 -19.6131 0.20084E-19 -19.6972 0.82403E+00 -0.0841 97 H2P2O7-2 0.18224E-15 -15.7394 0.89652E-16 -16.0474 0.49194E+00 -0.3081 98 HP2O7-3 0.11996E-15 -15.9210 0.24658E-16 -16.6080 0.20555E+00 -0.6871 99 P2O7-4 0.12917E-18 -18.8889 0.81139E-20 -20.0908 0.62818E-01 -1.2019 100 H2S,aq 0.52337E-02 -2.2812 0.51795E-02 -2.2857 0.98965E+00 -0.0045 101 S2-2 0.14747E-07 -7.8313 0.72546E-08 -8.1394 0.49194E+00 -0.3081 102 S3-2 0.63228E-08 -8.1991 0.31104E-08 -8.5072 0.49194E+00 -0.3081 103 S3- 0.14399E-07 -7.8417 0.11865E-07 -7.9257 0.82403E+00 -0.0841 104 S4-2 0.17907E-08 -8.7470 0.88095E-09 -9.0550 0.49194E+00 -0.3081 105 S5-2 0.33819E-09 -9.4708 0.16637E-09 -9.7789 0.49194E+00 -0.3081 106 SO2,aq 0.36572E-13 -13.4368 0.36572E-13 -13.4368 0.10000E+01 0.0000 107 SO3-2 0.40348E-11 -11.3942 0.20182E-11 -11.6950 0.50020E+00 -0.3009 108 HSO3- 0.11133E-09 -9.9534 0.91741E-10 -10.0374 0.82403E+00 -0.0841 109 HSO4- 0.80719E-06 -6.0930 0.66738E-06 -6.1756 0.82680E+00 -0.0826 111 S2O3-2 0.11802E-06 -6.9280 0.58059E-07 -7.2361 0.49194E+00 -0.3081 112 HS2O3- 0.91460E-11 -11.0388 0.75366E-11 -11.1228 0.82403E+00 -0.0841 113 H2S2O3,aq 0.87716E-16 -16.0569 0.87716E-16 -16.0569 0.10000E+01 0.0000 121 S4O6-2 0.47091E-19 -19.3271 0.23166E-19 -19.6351 0.49194E+00 -0.3081 Charge balance for all species = -.6092E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.8748871E-06 0.2192860E-01 0.2204352E+02 0.0000 2 H2O 0.1000000E+01 0.5549155E+02 0.9970197E+06 0.0000 3 Cl- 0.2554176E-02 0.2566906E-02 0.9076080E+02 3.4623 4 SO4-- 0.1934223E-02 0.1937446E-02 0.1856157E+03 9.2576 5 HCO3- 0.1290041E-01 0.2960111E-01 0.1801340E+04 4.1664 6 HS- 0.2800849E-02 0.8034753E-02 0.2650137E+03 3.5024 7 Al+++ 0.3925478E-15 0.2686722E-07 0.7229765E-03 2.3235 8 H4SiO4 0.1023816E-02 0.1025803E-02 0.9833146E+02 -2.9898 9 Ca++ 0.1743367E-06 0.2301469E-06 0.9199127E-02 5.2088 10 Mg++ 0.7897725E-10 0.9255635E-10 0.2244204E-05 1.8626 11 Fe++ 0.9321773E-14 0.9624455E-14 0.5360575E-09 -2.0649 12 K+ 0.1539165E-03 0.1562042E-03 0.6091539E+01 2.2431 13 Na+ 0.2214250E-01 0.2215619E-01 0.5080023E+03 4.4001 14 Mn++ 0.2174034E-08 0.2490716E-08 0.1364685E-03 3.3033 15 F- 0.1625637E-03 0.1637989E-03 0.3103517E+01 2.2650 16 HPO4-- 0.5117813E-08 0.4610846E-07 0.4413592E-02 3.6803 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1981213E-01 0.1982638E-01 -.1424503E-04 0.0000000E+00 2 H2O 0.5014932E+02 0.5017176E+02 -.2243927E-01 0.0000000E+00 3 Cl- 0.2320825E-02 0.2320825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1751717E-02 0.1751709E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2676335E-01 0.2676335E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.7264544E-02 0.7264487E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2429155E-07 0.4751060E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9274630E-03 0.1122556E-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 0.8701790E-14 0.3259226E-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- 0.1480960E-03 0.1480960E-03 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: -.1707E-20 Mass of aqueous solution: 0.906561E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3699900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2376E-05 -5.624 0.6133E-03 -3.212 0.9089E-01 0.2360E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674763 g Volume = 0.254824 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: 0.3699900 moles log = -0.4318 Original solution: 1000.0103000 g Original solution / Rock added: 2702.80 (Water/Rock Ratio), log = 3.4318 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 2.9561 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3503E+00 0.9711 0.1006E+01 0.1036E+01 CO2,gas 0.6010E+00 0.9952 0.1768E+01 0.1776E+01 CH4,gas 0.1236E-04 1.0077 0.3683E-04 0.3655E-04 H2,gas 0.7217E-05 1.0016 0.2137E-04 0.2133E-04 H2S,gas 0.4872E-01 0.9886 0.1424E+00 0.1440E+00 S2,gas 0.5638E-12 1.0000 0.1667E-11 0.1667E-11 CO,gas 0.3407E-08 1.0000 0.1007E-07 0.1007E-07 SO3,gas 0.6433E-31 1.0000 0.1902E-30 0.1902E-30 SO2,gas 0.5350E-13 1.0000 0.1582E-12 0.1582E-12 HF,gas 0.5517E-09 1.0000 0.1631E-08 0.1631E-08 HCl,gas 0.1671E-12 1.0000 0.4941E-12 0.4941E-12 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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.11 -1.45 -0.484 0.24784E+04 0.247 3 CH4,gas 4.54 -1.59 -6.13 -1.533 0.10472E+05 -4.434 4 H2,gas 8.00 1.63 -6.37 -3.640 0.10875E+05 -4.670 5 H2S,gas -6.23 -8.78 -2.55 -1.273 0.43464E+04 -0.847 6 S2,gas -7.34 -20.81 -13.48 -2.073 0.23012E+05 -11.778 7 CO,gas 3.21 -6.48 -9.70 -2.983 0.16555E+05 -7.997 8 SO3,gas 17.12 -15.30 -32.42 -8.105 0.55356E+05 -30.721 9 SO2,gas 0.83 -13.67 -14.50 -3.867 0.24758E+05 -12.801 10 HF,gas 0.47 -10.01 -10.49 -5.243 0.17906E+05 -8.788 11 HCl,gas 5.19 -8.82 -14.01 -7.003 0.23913E+05 -12.306 16 albite-high 0.69 -2.25 -2.94 -0.226 0.50167E+04 17 albite -0.38 -2.25 -1.86 -0.143 0.31779E+04 21 analcite 3.32 0.74 -2.58 -0.286 0.44012E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57107E+04 25 anhydrite -5.32 -10.09 -4.77 -2.387 0.81499E+04 38 aragonite 0.97 -2.90 -3.87 -1.290 0.66071E+04 40 calcite 0.81 -2.90 -3.71 -1.238 0.63429E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63803E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94007E+03 69 diamond -3.10 -4.85 -1.75 -0.499 0.29843E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.30 -0.373 0.22265E+04 98 jadeite 4.22 0.74 -3.47 -0.347 0.59264E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54966E+04 104 laumontite 2.88 -2.10 -4.99 -0.332 0.85148E+04 119 microcline -2.49 -4.40 -1.92 -0.147 0.32707E+04 123 muscovite 2.58 0.24 -2.34 -0.138 0.39924E+04 124 paragonite 4.24 2.40 -1.84 -0.108 0.31387E+04 125 nepheline 8.34 3.73 -4.61 -0.658 0.78640E+04 147 pyrrhotiteFe0.875 -6.02 -10.78 -4.77 -1.753 0.81408E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19391E+04 154 rhodochrosite -0.98 -4.81 -3.83 -1.277 0.65433E+04 156 sanidine -1.28 -4.40 -3.13 -0.241 0.53385E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61546E+04 166 stilbite -7.52 -11.07 -3.55 -0.169 0.60618E+04 172 sulfur -9.15 -10.41 -1.25 -0.386 0.21411E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50569E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.70 -3.05 -0.189 0.52134E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55187E+04 198 beidellite-K -1.52 -4.82 -3.30 -0.202 0.56310E+04 199 beidellite-Mg -1.79 -5.25 -3.46 -0.214 0.59099E+04 200 beidellite-Na -1.34 -4.11 -2.76 -0.169 0.47195E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.39 -3.07 -0.384 0.52425E+04 204 montmorillonite-Ca -2.29 -6.60 -4.31 -0.267 0.73650E+04 205 montmorillonite-K -2.24 -6.72 -4.49 -0.275 0.76608E+04 206 montmorillonite-Mg -2.48 -7.16 -4.68 -0.289 0.79848E+04 207 montmorillonite-Na -2.04 -6.01 -3.97 -0.243 0.67850E+04 214 topaz -16.55 -18.37 -1.82 -0.203 0.31124E+04 234 alabandite -0.98 -5.47 -4.49 -1.498 0.76744E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.82 -4.89 -1.629 0.83440E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -1.02 -3.04 -0.234 0.51883E+04 248 an25ab75 2.65 -0.71 -3.36 -0.258 0.57378E+04 249 an30ab70 3.28 -0.41 -3.69 -0.284 0.62970E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3699900 MOLES New total amount of reactant added: 0.3799900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3799900 Water: Moles liquid = 0.5020E+02 kg liquid = 0.9043E+00 Moles total = 0.5016E+02 kg total = 0.9036E+00 Activity = 0.9996 Stoichiometric ionic strength = .3586826E-01 Osmotic coef. = 0.8995 True ionic strength = .2428263E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2380E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.93316E-06 -6.0300 0.77424E-06 -6.1111 0.82969E+00 -0.0811 2 H2O 0.99958E+00 -0.0002 0.99958E+00 -0.0002 3 Cl- 0.26186E-02 -2.5819 0.21575E-02 -2.6660 0.82390E+00 -0.0841 4 SO4-- 0.19865E-02 -2.7019 0.97912E-03 -3.0092 0.49288E+00 -0.3073 5 HCO3- 0.12768E-01 -1.8939 0.10537E-01 -1.9773 0.82530E+00 -0.0834 6 HS- 0.27563E-02 -2.5597 0.22713E-02 -2.6437 0.82404E+00 -0.0841 7 Al+++ 0.47675E-15 -15.3217 0.97751E-16 -16.0099 0.20504E+00 -0.6882 8 H4SiO4 0.10238E-02 -2.9898 0.10238E-02 -2.9898 0.10000E+01 0.0000 9 Ca++ 0.17410E-06 -6.7592 0.85074E-07 -7.0702 0.48866E+00 -0.3110 10 Mg++ 0.79084E-10 -10.1019 0.38440E-10 -10.4152 0.48607E+00 -0.3133 11 Fe++ 0.93808E-14 -14.0278 0.45655E-14 -14.3405 0.48669E+00 -0.3128 12 K+ 0.15383E-03 -3.8130 0.12699E-03 -3.8962 0.82553E+00 -0.0833 13 Na+ 0.22138E-01 -1.6549 0.18236E-01 -1.7391 0.82372E+00 -0.0842 14 Mn++ 0.21669E-08 -8.6642 0.10556E-08 -8.9765 0.48715E+00 -0.3123 15 F- 0.16688E-03 -3.7776 0.13716E-03 -3.8628 0.82194E+00 -0.0852 16 HPO4-- 0.48332E-08 -8.3158 0.23826E-08 -8.6230 0.49296E+00 -0.3072 18 HSiO3- 0.14992E-05 -5.8241 0.12352E-05 -5.9083 0.82390E+00 -0.0841 19 Ca(HSiO3)+ 0.28982E-11 -11.5379 0.23932E-11 -11.6210 0.82573E+00 -0.0832 20 Mg(HSiO3)+ 0.16297E-14 -14.7879 0.13457E-14 -14.8710 0.82573E+00 -0.0832 21 NaHSiO3,aq 0.36431E-06 -6.4385 0.36431E-06 -6.4385 0.10000E+01 0.0000 22 AlO+ 0.26855E-10 -10.5710 0.22175E-10 -10.6541 0.82573E+00 -0.0832 23 AlOH+2 0.17529E-12 -12.7562 0.85491E-13 -13.0681 0.48771E+00 -0.3118 24 HAlO2,aq 0.57015E-08 -8.2440 0.57015E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.19827E-07 -7.7028 0.16301E-07 -7.7878 0.82218E+00 -0.0850 26 CH4,aq 0.23986E-07 -7.6200 0.23734E-07 -7.6246 0.98947E+00 -0.0046 27 C2H6,aq 0.61415E-17 -17.2117 0.60768E-17 -17.2163 0.98947E+00 -0.0046 31 CO,aq 0.69453E-11 -11.1583 0.69453E-11 -11.1583 0.10000E+01 0.0000 32 CO2,aq 0.17625E-01 -1.7539 0.17440E-01 -1.7585 0.98947E+00 -0.0046 33 CO3-2 0.24178E-05 -5.6166 0.11888E-05 -5.9249 0.49166E+00 -0.3083 34 CaCO3,aq 0.12681E-08 -8.8968 0.12681E-08 -8.8968 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.27712E-07 -7.5573 0.22883E-07 -7.6405 0.82573E+00 -0.0832 36 CaCl+ 0.35973E-09 -9.4440 0.29704E-09 -9.5272 0.82573E+00 -0.0832 37 CaCl2,aq 0.15226E-12 -12.8174 0.15226E-12 -12.8174 0.10000E+01 0.0000 38 CaF+ 0.20633E-09 -9.6854 0.17037E-09 -9.7686 0.82573E+00 -0.0832 39 CaOH+ 0.94800E-11 -11.0232 0.78279E-11 -11.1064 0.82573E+00 -0.0832 40 CaSO4,aq 0.26451E-07 -7.5776 0.26451E-07 -7.5776 0.10000E+01 0.0000 41 HCl,aq 0.30610E-09 -9.5141 0.30610E-09 -9.5141 0.10000E+01 0.0000 45 HF,aq 0.72700E-06 -6.1385 0.72700E-06 -6.1385 0.10000E+01 0.0000 46 HF2- 0.40864E-10 -10.3887 0.33668E-10 -10.4728 0.82390E+00 -0.0841 48 FeCl+ 0.18881E-16 -16.7240 0.15591E-16 -16.8071 0.82573E+00 -0.0832 51 FeF+ 0.38755E-16 -16.4117 0.32001E-16 -16.4948 0.82573E+00 -0.0832 53 FeO,aq 0.29588E-18 -18.5289 0.29588E-18 -18.5289 0.10000E+01 0.0000 54 FeOH+ 0.23236E-15 -15.6338 0.19187E-15 -15.7170 0.82573E+00 -0.0832 59 HFeO2,aq 0.12215E-18 -18.9131 0.12215E-18 -18.9131 0.10000E+01 0.0000 60 H2,aq 0.16015E-07 -7.7955 0.15847E-07 -7.8001 0.98947E+00 -0.0046 61 KCl,aq 0.49657E-08 -8.3040 0.49657E-08 -8.3040 0.10000E+01 0.0000 62 KHSO4,aq 0.27218E-12 -12.5651 0.27218E-12 -12.5651 0.10000E+01 0.0000 63 KOH,aq 0.70016E-10 -10.1548 0.70016E-10 -10.1548 0.10000E+01 0.0000 64 KSO4- 0.23418E-05 -5.6304 0.19294E-05 -5.7146 0.82390E+00 -0.0841 65 MgCO3,aq 0.14362E-12 -12.8428 0.14362E-12 -12.8428 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12794E-10 -10.8930 0.10565E-10 -10.9761 0.82573E+00 -0.0832 67 MgCl+ 0.14732E-12 -12.8317 0.12164E-12 -12.9149 0.82573E+00 -0.0832 68 MgF+ 0.34534E-12 -12.4618 0.28516E-12 -12.5449 0.82573E+00 -0.0832 69 MgOH+ 0.23702E-13 -13.6252 0.19572E-13 -13.7084 0.82573E+00 -0.0832 71 MnF+ 0.29536E-11 -11.5296 0.24389E-11 -11.6128 0.82573E+00 -0.0832 72 MnO,aq 0.18230E-14 -14.7392 0.18230E-14 -14.7392 0.10000E+01 0.0000 73 MnOH+ 0.49910E-11 -11.3018 0.41212E-11 -11.3850 0.82573E+00 -0.0832 75 HMnO2- 0.20770E-19 -19.6826 0.17112E-19 -19.7667 0.82390E+00 -0.0841 78 MnCl+ 0.16985E-10 -10.7699 0.14025E-10 -10.8531 0.82573E+00 -0.0832 79 MnSO4,aq 0.29839E-09 -9.5252 0.29839E-09 -9.5252 0.10000E+01 0.0000 80 NaCl,aq 0.13039E-04 -4.8848 0.13039E-04 -4.8848 0.10000E+01 0.0000 81 NaF,aq 0.58560E-06 -6.2324 0.58560E-06 -6.2324 0.10000E+01 0.0000 82 NaOH,aq 0.10115E-07 -7.9950 0.10115E-07 -7.9950 0.10000E+01 0.0000 84 OH- 0.90727E-06 -6.0423 0.74594E-06 -6.1273 0.82218E+00 -0.0850 89 HPO3-2 0.23941E-18 -18.6209 0.11771E-18 -18.9292 0.49166E+00 -0.3083 91 H2PO3- 0.22181E-18 -18.6540 0.18275E-18 -18.7381 0.82390E+00 -0.0841 92 H3PO4,aq 0.99889E-11 -11.0005 0.99889E-11 -11.0005 0.10000E+01 0.0000 93 H2PO4- 0.41257E-07 -7.3845 0.34029E-07 -7.4681 0.82481E+00 -0.0836 94 PO4-3 0.11566E-13 -13.9368 0.25107E-14 -14.6002 0.21707E+00 -0.6634 96 H3P2O7- 0.26340E-19 -19.5794 0.21701E-19 -19.6635 0.82390E+00 -0.0841 97 H2P2O7-2 0.18475E-15 -15.7334 0.90835E-16 -16.0417 0.49166E+00 -0.3083 98 HP2O7-3 0.11411E-15 -15.9427 0.23427E-16 -16.6303 0.20529E+00 -0.6876 99 P2O7-4 0.11532E-18 -18.9381 0.72284E-20 -20.1410 0.62680E-01 -1.2029 100 H2S,aq 0.54927E-02 -2.2602 0.54349E-02 -2.2648 0.98947E+00 -0.0046 101 S2-2 0.14671E-07 -7.8335 0.72132E-08 -8.1419 0.49166E+00 -0.3083 102 S3-2 0.67789E-08 -8.1688 0.33329E-08 -8.4772 0.49166E+00 -0.3083 103 S3- 0.16678E-07 -7.7779 0.13741E-07 -7.8620 0.82390E+00 -0.0841 104 S4-2 0.20691E-08 -8.6842 0.10173E-08 -8.9926 0.49166E+00 -0.3083 105 S5-2 0.42111E-09 -9.3756 0.20705E-09 -9.6839 0.49166E+00 -0.3083 106 SO2,aq 0.41572E-13 -13.3812 0.41572E-13 -13.3812 0.10000E+01 0.0000 107 SO3-2 0.40348E-11 -11.3942 0.20171E-11 -11.6953 0.49993E+00 -0.3011 108 HSO3- 0.11868E-09 -9.9256 0.97784E-10 -10.0097 0.82390E+00 -0.0841 109 HSO4- 0.88374E-06 -6.0537 0.73056E-06 -6.1363 0.82667E+00 -0.0827 111 S2O3-2 0.12719E-06 -6.8955 0.62535E-07 -7.2039 0.49166E+00 -0.3083 112 HS2O3- 0.10507E-10 -10.9785 0.86571E-11 -11.0626 0.82390E+00 -0.0841 113 H2S2O3,aq 0.10745E-15 -15.9688 0.10745E-15 -15.9688 0.10000E+01 0.0000 121 S4O6-2 0.63850E-19 -19.1948 0.31393E-19 -19.5032 0.49166E+00 -0.3083 Charge balance for all species = -.6090E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9331609E-06 0.2311537E-01 0.2323541E+02 0.0000 2 H2O 0.1000000E+01 0.5549062E+02 0.9969559E+06 0.0000 3 Cl- 0.2618644E-02 0.2631688E-02 0.9304699E+02 3.4451 4 SO4-- 0.1986530E-02 0.1989901E-02 0.1906321E+03 9.2131 5 HCO3- 0.1276766E-01 0.3039530E-01 0.1849582E+04 4.1339 6 HS- 0.2756261E-02 0.8249221E-02 0.2720748E+03 3.4674 7 Al+++ 0.4767476E-15 0.2555516E-07 0.6876374E-03 2.3235 8 H4SiO4 0.1023772E-02 0.1025636E-02 0.9831076E+02 -2.9898 9 Ca++ 0.1740959E-06 0.2301055E-06 0.9197038E-02 5.1521 10 Mg++ 0.7908360E-10 0.9253971E-10 0.2243694E-05 1.8070 11 Fe++ 0.9380773E-14 0.9671196E-14 0.5386354E-09 -2.1183 12 K+ 0.1538292E-03 0.1561761E-03 0.6090155E+01 2.2149 13 Na+ 0.2213821E-01 0.2215221E-01 0.5078869E+03 4.3720 14 Mn++ 0.2166946E-08 0.2490268E-08 0.1364375E-03 3.2458 15 F- 0.1668798E-03 0.1681927E-03 0.3186618E+01 2.2484 16 HPO4-- 0.4833175E-08 0.4610016E-07 0.4412590E-02 3.5993 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2088888E-01 0.2090313E-01 -.1424858E-04 0.0000000E+00 2 H2O 0.5015751E+02 0.5017995E+02 -.2243924E-01 0.0000000E+00 3 Cl- 0.2379825E-02 0.2379825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1799467E-02 0.1799459E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2748635E-01 0.2748635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.7459794E-02 0.7459737E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2310943E-07 0.4752243E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9274783E-03 0.1122554E-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 0.8745624E-14 0.3259226E-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- 0.1520960E-03 0.1520960E-03 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: 0.7412E-21 Mass of aqueous solution: 0.906767E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2376E-05 -5.624 0.6134E-03 -3.212 0.9091E-01 0.2360E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674762 g Volume = 0.254823 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: 0.3799900 moles log = -0.4202 Original solution: 1000.0103000 g Original solution / Rock added: 2631.68 (Water/Rock Ratio), log = 3.4202 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 3.0630 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3383E+00 0.9705 0.1006E+01 0.1036E+01 CO2,gas 0.6123E+00 0.9948 0.1866E+01 0.1876E+01 CH4,gas 0.1132E-04 1.0076 0.3493E-04 0.3467E-04 H2,gas 0.6781E-05 1.0016 0.2081E-04 0.2077E-04 H2S,gas 0.4936E-01 0.9882 0.1494E+00 0.1512E+00 S2,gas 0.6319E-12 1.0000 0.1936E-11 0.1936E-11 CO,gas 0.3379E-08 1.0000 0.1035E-07 0.1035E-07 SO3,gas 0.7248E-31 1.0000 0.2220E-30 0.2220E-30 SO2,gas 0.5869E-13 1.0000 0.1798E-12 0.1798E-12 HF,gas 0.5828E-09 1.0000 0.1785E-08 0.1785E-08 HCl,gas 0.1763E-12 1.0000 0.5401E-12 0.5401E-12 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 0.17819E-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 -1.697 0.28968E+04 0.002 2 CO2,gas -6.66 -8.09 -1.43 -0.476 0.24384E+04 0.271 3 CH4,gas 4.54 -1.61 -6.16 -1.539 0.10511E+05 -4.457 4 H2,gas 8.00 1.62 -6.38 -3.646 0.10895E+05 -4.682 5 H2S,gas -6.23 -8.75 -2.52 -1.262 0.43107E+04 -0.826 6 S2,gas -7.34 -20.75 -13.41 -2.063 0.22901E+05 -11.713 7 CO,gas 3.21 -6.47 -9.68 -2.980 0.16535E+05 -7.985 8 SO3,gas 17.12 -15.23 -32.35 -8.088 0.55241E+05 -30.654 9 SO2,gas 0.83 -13.61 -14.44 -3.852 0.24663E+05 -12.745 10 HF,gas 0.47 -9.97 -10.45 -5.224 0.17839E+05 -8.748 11 HCl,gas 5.19 -8.78 -13.97 -6.983 0.23847E+05 -12.268 16 albite-high 0.69 -2.27 -2.97 -0.228 0.50647E+04 17 albite -0.38 -2.27 -1.89 -0.145 0.32258E+04 21 analcite 3.32 0.72 -2.61 -0.290 0.44492E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57106E+04 25 anhydrite -5.32 -10.08 -4.76 -2.381 0.81319E+04 38 aragonite 0.97 -2.94 -3.90 -1.301 0.66640E+04 40 calcite 0.81 -2.94 -3.75 -1.249 0.63998E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63802E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94006E+03 69 diamond -3.10 -4.85 -1.75 -0.499 0.29839E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.30 -0.373 0.22261E+04 98 jadeite 4.22 0.72 -3.50 -0.350 0.59744E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54965E+04 119 microcline -2.49 -4.43 -1.94 -0.150 0.33189E+04 123 muscovite 2.58 0.22 -2.37 -0.139 0.40406E+04 124 paragonite 4.24 2.37 -1.87 -0.110 0.31866E+04 125 nepheline 8.34 3.71 -4.63 -0.662 0.79119E+04 147 pyrrhotiteFe0.875 -6.02 -10.81 -4.79 -1.762 0.81824E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19391E+04 154 rhodochrosite -0.98 -4.84 -3.87 -1.289 0.66016E+04 156 sanidine -1.28 -4.43 -3.15 -0.243 0.53867E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61546E+04 166 stilbite -7.52 -11.13 -3.61 -0.172 0.61587E+04 172 sulfur -9.15 -10.37 -1.22 -0.376 0.20856E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50569E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.71 -3.06 -0.189 0.52293E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55187E+04 198 beidellite-K -1.52 -4.83 -3.31 -0.203 0.56469E+04 199 beidellite-Mg -1.79 -5.26 -3.47 -0.215 0.59256E+04 200 beidellite-Na -1.34 -4.12 -2.77 -0.170 0.47353E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.39 -3.08 -0.384 0.52505E+04 204 montmorillonite-Ca -2.29 -6.63 -4.34 -0.269 0.74123E+04 205 montmorillonite-K -2.24 -6.75 -4.51 -0.276 0.77080E+04 206 montmorillonite-Mg -2.48 -7.18 -4.70 -0.291 0.80317E+04 207 montmorillonite-Na -2.04 -6.04 -4.00 -0.245 0.68321E+04 214 topaz -16.55 -18.29 -1.74 -0.194 0.29784E+04 234 alabandite -0.98 -5.51 -4.53 -1.510 0.77369E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.80 -4.86 -1.622 0.83068E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -1.05 -3.07 -0.236 0.52460E+04 248 an25ab75 2.65 -0.75 -3.40 -0.261 0.57980E+04 249 an30ab70 3.28 -0.45 -3.72 -0.287 0.63596E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3799900 MOLES New total amount of reactant added: 0.3899900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3899900 Water: Moles liquid = 0.5020E+02 kg liquid = 0.9045E+00 Moles total = 0.5017E+02 kg total = 0.9038E+00 Activity = 0.9996 Stoichiometric ionic strength = .3651066E-01 Osmotic coef. = 0.8989 True ionic strength = .2433044E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2439E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.99279E-06 -6.0031 0.82359E-06 -6.0843 0.82957E+00 -0.0811 2 H2O 0.99956E+00 -0.0002 0.99956E+00 -0.0002 3 Cl- 0.26831E-02 -2.5714 0.22103E-02 -2.6556 0.82377E+00 -0.0842 4 SO4-- 0.20388E-02 -2.6906 0.10043E-02 -2.9981 0.49260E+00 -0.3075 5 HCO3- 0.12634E-01 -1.8985 0.10425E-01 -1.9819 0.82517E+00 -0.0835 6 HS- 0.27127E-02 -2.5666 0.22350E-02 -2.6507 0.82391E+00 -0.0841 7 Al+++ 0.57461E-15 -15.2406 0.11767E-15 -15.9293 0.20478E+00 -0.6887 8 H4SiO4 0.10237E-02 -2.9898 0.10237E-02 -2.9898 0.10000E+01 0.0000 9 Ca++ 0.17385E-06 -6.7598 0.84906E-07 -7.0711 0.48838E+00 -0.3112 10 Mg++ 0.79190E-10 -10.1013 0.38469E-10 -10.4149 0.48578E+00 -0.3136 11 Fe++ 0.94458E-14 -14.0248 0.45944E-14 -14.3378 0.48640E+00 -0.3130 12 K+ 0.15374E-03 -3.8132 0.12690E-03 -3.8965 0.82540E+00 -0.0833 13 Na+ 0.22134E-01 -1.6549 0.18229E-01 -1.7392 0.82359E+00 -0.0843 14 Mn++ 0.21599E-08 -8.6656 0.10516E-08 -8.9782 0.48687E+00 -0.3126 15 F- 0.17119E-03 -3.7665 0.14069E-03 -3.8518 0.82180E+00 -0.0852 16 HPO4-- 0.45731E-08 -8.3398 0.22531E-08 -8.6472 0.49268E+00 -0.3074 18 HSiO3- 0.14096E-05 -5.8509 0.11612E-05 -5.9351 0.82377E+00 -0.0842 19 Ca(HSiO3)+ 0.27195E-11 -11.5655 0.22452E-11 -11.6487 0.82560E+00 -0.0832 20 Mg(HSiO3)+ 0.15334E-14 -14.8143 0.12660E-14 -14.8976 0.82560E+00 -0.0832 21 NaHSiO3,aq 0.34235E-06 -6.4655 0.34235E-06 -6.4655 0.10000E+01 0.0000 22 AlO+ 0.28573E-10 -10.5441 0.23590E-10 -10.6273 0.82560E+00 -0.0832 23 AlOH+2 0.19847E-12 -12.7023 0.96740E-13 -13.0144 0.48742E+00 -0.3121 24 HAlO2,aq 0.57016E-08 -8.2440 0.57016E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.18642E-07 -7.7295 0.15324E-07 -7.8146 0.82205E+00 -0.0851 26 CH4,aq 0.22770E-07 -7.6426 0.22527E-07 -7.6473 0.98929E+00 -0.0047 27 C2H6,aq 0.56784E-17 -17.2458 0.56176E-17 -17.2504 0.98929E+00 -0.0047 31 CO,aq 0.71233E-11 -11.1473 0.71233E-11 -11.1473 0.10000E+01 0.0000 32 CO2,aq 0.18553E-01 -1.7316 0.18354E-01 -1.7363 0.98929E+00 -0.0047 33 CO3-2 0.22501E-05 -5.6478 0.11056E-05 -5.9564 0.49139E+00 -0.3086 34 CaCO3,aq 0.11771E-08 -8.9292 0.11771E-08 -8.9292 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.27367E-07 -7.5628 0.22594E-07 -7.6460 0.82560E+00 -0.0832 36 CaCl+ 0.36785E-09 -9.4343 0.30370E-09 -9.5176 0.82560E+00 -0.0832 37 CaCl2,aq 0.15947E-12 -12.7973 0.15947E-12 -12.7973 0.10000E+01 0.0000 38 CaF+ 0.21124E-09 -9.6752 0.17440E-09 -9.7585 0.82560E+00 -0.0832 39 CaOH+ 0.88955E-11 -11.0508 0.73441E-11 -11.1341 0.82560E+00 -0.0832 40 CaSO4,aq 0.27078E-07 -7.5674 0.27078E-07 -7.5674 0.10000E+01 0.0000 41 HCl,aq 0.33357E-09 -9.4768 0.33357E-09 -9.4768 0.10000E+01 0.0000 45 HF,aq 0.79319E-06 -6.1006 0.79319E-06 -6.1006 0.10000E+01 0.0000 46 HF2- 0.45736E-10 -10.3397 0.37676E-10 -10.4239 0.82377E+00 -0.0842 48 FeCl+ 0.19469E-16 -16.7107 0.16073E-16 -16.7939 0.82560E+00 -0.0832 51 FeF+ 0.40008E-16 -16.3979 0.33031E-16 -16.4811 0.82560E+00 -0.0832 53 FeO,aq 0.26314E-18 -18.5798 0.26314E-18 -18.5798 0.10000E+01 0.0000 54 FeOH+ 0.21985E-15 -15.6579 0.18151E-15 -15.7411 0.82560E+00 -0.0832 59 HFeO2,aq 0.11004E-18 -18.9585 0.11004E-18 -18.9585 0.10000E+01 0.0000 60 H2,aq 0.15610E-07 -7.8066 0.15443E-07 -7.8113 0.98929E+00 -0.0047 61 KCl,aq 0.50834E-08 -8.2938 0.50834E-08 -8.2938 0.10000E+01 0.0000 62 KHSO4,aq 0.29677E-12 -12.5276 0.29677E-12 -12.5276 0.10000E+01 0.0000 63 KOH,aq 0.65772E-10 -10.1820 0.65772E-10 -10.1820 0.10000E+01 0.0000 64 KSO4- 0.24007E-05 -5.6197 0.19777E-05 -5.7038 0.82377E+00 -0.0842 65 MgCO3,aq 0.13368E-12 -12.8739 0.13368E-12 -12.8739 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12670E-10 -10.8972 0.10460E-10 -10.9805 0.82560E+00 -0.0832 67 MgCl+ 0.15106E-12 -12.8209 0.12471E-12 -12.9041 0.82560E+00 -0.0832 68 MgF+ 0.35453E-12 -12.4503 0.29270E-12 -12.5336 0.82560E+00 -0.0832 69 MgOH+ 0.22302E-13 -13.6517 0.18413E-13 -13.7349 0.82560E+00 -0.0832 71 MnF+ 0.30183E-11 -11.5202 0.24919E-11 -11.6035 0.82560E+00 -0.0832 72 MnO,aq 0.16048E-14 -14.7946 0.16048E-14 -14.7946 0.10000E+01 0.0000 73 MnOH+ 0.46745E-11 -11.3303 0.38593E-11 -11.4135 0.82560E+00 -0.0832 75 HMnO2- 0.17191E-19 -19.7647 0.14162E-19 -19.8489 0.82377E+00 -0.0842 78 MnCl+ 0.17336E-10 -10.7610 0.14313E-10 -10.8443 0.82560E+00 -0.0832 79 MnSO4,aq 0.30490E-09 -9.5158 0.30490E-09 -9.5158 0.10000E+01 0.0000 80 NaCl,aq 0.13353E-04 -4.8744 0.13353E-04 -4.8744 0.10000E+01 0.0000 81 NaF,aq 0.60042E-06 -6.2215 0.60042E-06 -6.2215 0.10000E+01 0.0000 82 NaOH,aq 0.95057E-08 -8.0220 0.95057E-08 -8.0220 0.10000E+01 0.0000 84 OH- 0.85302E-06 -6.0690 0.70123E-06 -6.1541 0.82205E+00 -0.0851 89 HPO3-2 0.22075E-18 -18.6561 0.10847E-18 -18.9647 0.49139E+00 -0.3086 91 H2PO3- 0.21748E-18 -18.6626 0.17915E-18 -18.7468 0.82377E+00 -0.0842 92 H3PO4,aq 0.10689E-10 -10.9711 0.10689E-10 -10.9711 0.10000E+01 0.0000 93 H2PO4- 0.41508E-07 -7.3819 0.34231E-07 -7.4656 0.82468E+00 -0.0837 94 PO4-3 0.10295E-13 -13.9874 0.22320E-14 -14.6513 0.21681E+00 -0.6639 96 H3P2O7- 0.28357E-19 -19.5473 0.23360E-19 -19.6315 0.82377E+00 -0.0842 97 H2P2O7-2 0.18706E-15 -15.7280 0.91918E-16 -16.0366 0.49139E+00 -0.3086 98 HP2O7-3 0.10869E-15 -15.9638 0.22285E-16 -16.6520 0.20503E+00 -0.6882 99 P2O7-4 0.10336E-18 -18.9857 0.64642E-20 -20.1895 0.62543E-01 -1.2038 100 H2S,aq 0.57506E-02 -2.2403 0.56891E-02 -2.2450 0.98929E+00 -0.0047 101 S2-2 0.14587E-07 -7.8360 0.71677E-08 -8.1446 0.49139E+00 -0.3086 102 S3-2 0.72399E-08 -8.1403 0.35576E-08 -8.4488 0.49139E+00 -0.3086 103 S3- 0.19186E-07 -7.7170 0.15805E-07 -7.8012 0.82377E+00 -0.0842 104 S4-2 0.23737E-08 -8.6246 0.11664E-08 -8.9331 0.49139E+00 -0.3086 105 S5-2 0.51895E-09 -9.2849 0.25500E-09 -9.5935 0.49139E+00 -0.3086 106 SO2,aq 0.47023E-13 -13.3277 0.47023E-13 -13.3277 0.10000E+01 0.0000 107 SO3-2 0.40354E-11 -11.3941 0.20163E-11 -11.6954 0.49966E+00 -0.3013 108 HSO3- 0.12622E-09 -9.8989 0.10397E-09 -9.9831 0.82377E+00 -0.0842 109 HSO4- 0.96442E-06 -6.0157 0.79714E-06 -6.0985 0.82655E+00 -0.0827 111 S2O3-2 0.13665E-06 -6.8644 0.67147E-07 -7.1730 0.49139E+00 -0.3086 112 HS2O3- 0.12003E-10 -10.9207 0.98880E-11 -11.0049 0.82377E+00 -0.0842 113 H2S2O3,aq 0.13055E-15 -15.8842 0.13055E-15 -15.8842 0.10000E+01 0.0000 121 S4O6-2 0.85527E-19 -19.0679 0.42026E-19 -19.3765 0.49139E+00 -0.3086 Charge balance for all species = -.6089E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9927883E-06 0.2430170E-01 0.2442675E+02 0.0000 2 H2O 0.1000000E+01 0.5548970E+02 0.9968922E+06 0.0000 3 Cl- 0.2683089E-02 0.2696448E-02 0.9533214E+02 3.4287 4 SO4-- 0.2038813E-02 0.2042337E-02 0.1956463E+03 9.1705 5 HCO3- 0.1263388E-01 0.3118921E-01 0.1897802E+04 4.1024 6 HS- 0.2712713E-02 0.8463613E-02 0.2791326E+03 3.4336 7 Al+++ 0.5746066E-15 0.2437213E-07 0.6557735E-03 2.3235 8 H4SiO4 0.1023729E-02 0.1025481E-02 0.9829123E+02 -2.9898 9 Ca++ 0.1738510E-06 0.2300642E-06 0.9194950E-02 5.0975 10 Mg++ 0.7918993E-10 0.9252306E-10 0.2243185E-05 1.7537 11 Fe++ 0.9445788E-14 0.9725497E-14 0.5416341E-09 -2.1692 12 K+ 0.1537421E-03 0.1561480E-03 0.6088773E+01 2.1877 13 Na+ 0.2213392E-01 0.2214822E-01 0.5077716E+03 4.3451 14 Mn++ 0.2159892E-08 0.2489820E-08 0.1364065E-03 3.1904 15 F- 0.1711911E-03 0.1725850E-03 0.3269681E+01 2.2325 16 HPO4-- 0.4573078E-08 0.4609187E-07 0.4411588E-02 3.5214 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2196563E-01 0.2197989E-01 -.1425178E-04 0.0000000E+00 2 H2O 0.5016569E+02 0.5018813E+02 -.2243918E-01 0.0000000E+00 3 Cl- 0.2438825E-02 0.2438825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1847217E-02 0.1847209E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2820935E-01 0.2820935E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.7655044E-02 0.7654987E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2204358E-07 0.4753308E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9275047E-03 0.1122552E-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 0.8796310E-14 0.3259226E-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- 0.1560960E-03 0.1560960E-03 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: 0.2647E-21 Mass of aqueous solution: 0.906973E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3899900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2377E-05 -5.624 0.6136E-03 -3.212 0.9093E-01 0.2361E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674761 g Volume = 0.254823 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: 0.3899900 moles log = -0.4089 Original solution: 1000.0103000 g Original solution / Rock added: 2564.19 (Water/Rock Ratio), log = 3.4090 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 3.1699 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3270E+00 0.9699 0.1006E+01 0.1037E+01 CO2,gas 0.6230E+00 0.9944 0.1964E+01 0.1975E+01 CH4,gas 0.1038E-04 1.0075 0.3316E-04 0.3291E-04 H2,gas 0.6385E-05 1.0017 0.2027E-04 0.2024E-04 H2S,gas 0.4995E-01 0.9878 0.1564E+00 0.1583E+00 S2,gas 0.7046E-12 1.0000 0.2233E-11 0.2233E-11 CO,gas 0.3349E-08 1.0000 0.1062E-07 0.1062E-07 SO3,gas 0.8129E-31 1.0000 0.2577E-30 0.2577E-30 SO2,gas 0.6415E-13 1.0000 0.2033E-12 0.2033E-12 HF,gas 0.6144E-09 1.0000 0.1948E-08 0.1948E-08 HCl,gas 0.1857E-12 1.0000 0.5886E-12 0.5886E-12 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 -1.697 0.28969E+04 0.002 2 CO2,gas -6.66 -8.07 -1.41 -0.469 0.24005E+04 0.293 3 CH4,gas 4.54 -1.63 -6.18 -1.545 0.10549E+05 -4.479 4 H2,gas 8.00 1.61 -6.39 -3.653 0.10914E+05 -4.693 5 H2S,gas -6.23 -8.74 -2.50 -1.252 0.42768E+04 -0.806 6 S2,gas -7.34 -20.69 -13.35 -2.054 0.22795E+05 -11.651 7 CO,gas 3.21 -6.46 -9.67 -2.976 0.16516E+05 -7.974 8 SO3,gas 17.12 -15.17 -32.29 -8.072 0.55131E+05 -30.589 9 SO2,gas 0.83 -13.56 -14.39 -3.838 0.24572E+05 -12.692 10 HF,gas 0.47 -9.94 -10.41 -5.205 0.17774E+05 -8.711 11 HCl,gas 5.19 -8.74 -13.93 -6.965 0.23784E+05 -12.230 16 albite-high 0.69 -2.30 -2.99 -0.230 0.51107E+04 17 albite -0.38 -2.30 -1.92 -0.147 0.32719E+04 21 analcite 3.32 0.69 -2.63 -0.293 0.44953E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57106E+04 25 anhydrite -5.32 -10.07 -4.75 -2.376 0.81146E+04 38 aragonite 0.97 -2.97 -3.94 -1.312 0.67193E+04 40 calcite 0.81 -2.97 -3.78 -1.260 0.64550E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63802E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94005E+03 69 diamond -3.10 -4.85 -1.75 -0.499 0.29843E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.30 -0.373 0.22265E+04 98 jadeite 4.22 0.69 -3.53 -0.353 0.60205E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54965E+04 119 microcline -2.49 -4.46 -1.97 -0.152 0.33653E+04 123 muscovite 2.58 0.19 -2.39 -0.141 0.40869E+04 124 paragonite 4.24 2.35 -1.89 -0.111 0.32327E+04 125 nepheline 8.34 3.68 -4.66 -0.666 0.79580E+04 147 pyrrhotiteFe0.875 -6.02 -10.83 -4.82 -1.771 0.82223E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19391E+04 154 rhodochrosite -0.98 -4.88 -3.90 -1.300 0.66582E+04 156 sanidine -1.28 -4.46 -3.18 -0.245 0.54330E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61545E+04 166 stilbite -7.52 -11.18 -3.66 -0.174 0.62519E+04 172 sulfur -9.15 -10.34 -1.19 -0.366 0.20326E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50569E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.72 -3.07 -0.190 0.52447E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55187E+04 198 beidellite-K -1.52 -4.84 -3.32 -0.203 0.56622E+04 199 beidellite-Mg -1.79 -5.27 -3.48 -0.215 0.59406E+04 200 beidellite-Na -1.34 -4.12 -2.78 -0.170 0.47505E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.40 -3.08 -0.385 0.52587E+04 204 montmorillonite-Ca -2.29 -6.66 -4.37 -0.270 0.74577E+04 205 montmorillonite-K -2.24 -6.78 -4.54 -0.278 0.77533E+04 206 montmorillonite-Mg -2.48 -7.21 -4.73 -0.293 0.80768E+04 207 montmorillonite-Na -2.04 -6.07 -4.03 -0.247 0.68774E+04 214 topaz -16.55 -18.21 -1.67 -0.185 0.28491E+04 234 alabandite -0.98 -5.54 -4.57 -1.522 0.77975E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.77 -4.84 -1.615 0.82707E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -1.09 -3.10 -0.239 0.53015E+04 248 an25ab75 2.65 -0.78 -3.43 -0.264 0.58558E+04 249 an30ab70 3.28 -0.48 -3.76 -0.289 0.64198E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3899900 MOLES New total amount of reactant added: 0.3999900 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 = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.3999900 Water: Moles liquid = 0.5021E+02 kg liquid = 0.9046E+00 Moles total = 0.5017E+02 kg total = 0.9039E+00 Activity = 0.9995 Stoichiometric ionic strength = .3715285E-01 Osmotic coef. = 0.8983 True ionic strength = .2437824E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2498E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.10538E-05 -5.9772 0.87408E-06 -6.0584 0.82945E+00 -0.0812 2 H2O 0.99954E+00 -0.0002 0.99954E+00 -0.0002 3 Cl- 0.27475E-02 -2.5611 0.22630E-02 -2.6453 0.82364E+00 -0.0843 4 SO4-- 0.20911E-02 -2.6796 0.10295E-02 -2.9874 0.49232E+00 -0.3077 5 HCO3- 0.12499E-01 -1.9031 0.10312E-01 -1.9866 0.82505E+00 -0.0835 6 HS- 0.26701E-02 -2.5735 0.21996E-02 -2.6577 0.82378E+00 -0.0842 7 Al+++ 0.68782E-15 -15.1625 0.14067E-15 -15.8518 0.20452E+00 -0.6893 8 H4SiO4 0.10237E-02 -2.9898 0.10237E-02 -2.9898 0.10000E+01 0.0000 9 Ca++ 0.17360E-06 -6.7604 0.84736E-07 -7.0719 0.48810E+00 -0.3115 10 Mg++ 0.79296E-10 -10.1007 0.38498E-10 -10.4146 0.48550E+00 -0.3138 11 Fe++ 0.95166E-14 -14.0215 0.46262E-14 -14.3348 0.48612E+00 -0.3133 12 K+ 0.15366E-03 -3.8135 0.12681E-03 -3.8969 0.82527E+00 -0.0834 13 Na+ 0.22130E-01 -1.6550 0.18223E-01 -1.7394 0.82346E+00 -0.0844 14 Mn++ 0.21529E-08 -8.6670 0.10476E-08 -8.9798 0.48659E+00 -0.3128 15 F- 0.17550E-03 -3.7557 0.14420E-03 -3.8410 0.82167E+00 -0.0853 16 HPO4-- 0.43345E-08 -8.3631 0.21343E-08 -8.6707 0.49241E+00 -0.3077 18 HSiO3- 0.13283E-05 -5.8767 0.10941E-05 -5.9610 0.82364E+00 -0.0843 19 Ca(HSiO3)+ 0.25576E-11 -11.5922 0.21113E-11 -11.6755 0.82548E+00 -0.0833 20 Mg(HSiO3)+ 0.14461E-14 -14.8398 0.11938E-14 -14.9231 0.82548E+00 -0.0833 21 NaHSiO3,aq 0.32245E-06 -6.4915 0.32245E-06 -6.4915 0.10000E+01 0.0000 22 AlO+ 0.30330E-10 -10.5181 0.25037E-10 -10.6014 0.82548E+00 -0.0833 23 AlOH+2 0.22369E-12 -12.6503 0.10897E-12 -12.9627 0.48714E+00 -0.3123 24 HAlO2,aq 0.57017E-08 -8.2440 0.57017E-08 -8.2440 0.10000E+01 0.0000 25 AlO2- 0.17568E-07 -7.7553 0.14439E-07 -7.8405 0.82191E+00 -0.0852 26 CH4,aq 0.21628E-07 -7.6650 0.21393E-07 -7.6697 0.98911E+00 -0.0048 27 C2H6,aq 0.52524E-17 -17.2796 0.51952E-17 -17.2844 0.98911E+00 -0.0048 31 CO,aq 0.72934E-11 -11.1371 0.72934E-11 -11.1371 0.10000E+01 0.0000 32 CO2,aq 0.19482E-01 -1.7104 0.19269E-01 -1.7151 0.98911E+00 -0.0048 33 CO3-2 0.20983E-05 -5.6781 0.10305E-05 -5.9870 0.49111E+00 -0.3088 34 CaCO3,aq 0.10949E-08 -8.9606 0.10949E-08 -8.9606 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.27021E-07 -7.5683 0.22305E-07 -7.6516 0.82548E+00 -0.0833 36 CaCl+ 0.37593E-09 -9.4249 0.31032E-09 -9.5082 0.82548E+00 -0.0833 37 CaCl2,aq 0.16684E-12 -12.7777 0.16684E-12 -12.7777 0.10000E+01 0.0000 38 CaF+ 0.21612E-09 -9.6653 0.17840E-09 -9.7486 0.82548E+00 -0.0833 39 CaOH+ 0.83659E-11 -11.0775 0.69058E-11 -11.1608 0.82548E+00 -0.0833 40 CaSO4,aq 0.27701E-07 -7.5575 0.27701E-07 -7.5575 0.10000E+01 0.0000 41 HCl,aq 0.36246E-09 -9.4407 0.36246E-09 -9.4407 0.10000E+01 0.0000 45 HF,aq 0.86286E-06 -6.0641 0.86286E-06 -6.0641 0.10000E+01 0.0000 46 HF2- 0.51004E-10 -10.2924 0.42009E-10 -10.3767 0.82364E+00 -0.0843 48 FeCl+ 0.20074E-16 -16.6974 0.16571E-16 -16.7807 0.82548E+00 -0.0833 51 FeF+ 0.41297E-16 -16.3841 0.34090E-16 -16.4674 0.82548E+00 -0.0833 53 FeO,aq 0.23522E-18 -18.6285 0.23522E-18 -18.6285 0.10000E+01 0.0000 54 FeOH+ 0.20861E-15 -15.6807 0.17220E-15 -15.7640 0.82548E+00 -0.0833 59 HFeO2,aq 0.99605E-19 -19.0017 0.99605E-19 -19.0017 0.10000E+01 0.0000 60 H2,aq 0.15226E-07 -7.8174 0.15060E-07 -7.8222 0.98911E+00 -0.0048 61 KCl,aq 0.52009E-08 -8.2839 0.52009E-08 -8.2839 0.10000E+01 0.0000 62 KHSO4,aq 0.32263E-12 -12.4913 0.32263E-12 -12.4913 0.10000E+01 0.0000 63 KOH,aq 0.61926E-10 -10.2081 0.61926E-10 -10.2081 0.10000E+01 0.0000 64 KSO4- 0.24595E-05 -5.6092 0.20258E-05 -5.6934 0.82364E+00 -0.0843 65 MgCO3,aq 0.12469E-12 -12.9042 0.12469E-12 -12.9042 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.12544E-10 -10.9015 0.10355E-10 -10.9848 0.82548E+00 -0.0833 67 MgCl+ 0.15480E-12 -12.8102 0.12778E-12 -12.8935 0.82548E+00 -0.0833 68 MgF+ 0.36372E-12 -12.4392 0.30024E-12 -12.5225 0.82548E+00 -0.0833 69 MgOH+ 0.21032E-13 -13.6771 0.17362E-13 -13.7604 0.82548E+00 -0.0833 71 MnF+ 0.30823E-11 -11.5111 0.25444E-11 -11.5944 0.82548E+00 -0.0833 72 MnO,aq 0.14193E-14 -14.8479 0.14193E-14 -14.8479 0.10000E+01 0.0000 73 MnOH+ 0.43882E-11 -11.3577 0.36224E-11 -11.4410 0.82548E+00 -0.0833 75 HMnO2- 0.14327E-19 -19.8438 0.11800E-19 -19.9281 0.82364E+00 -0.0843 78 MnCl+ 0.17684E-10 -10.7524 0.14598E-10 -10.8357 0.82548E+00 -0.0833 79 MnSO4,aq 0.31134E-09 -9.5068 0.31134E-09 -9.5068 0.10000E+01 0.0000 80 NaCl,aq 0.13666E-04 -4.8644 0.13666E-04 -4.8644 0.10000E+01 0.0000 81 NaF,aq 0.61521E-06 -6.2110 0.61521E-06 -6.2110 0.10000E+01 0.0000 82 NaOH,aq 0.89532E-08 -8.0480 0.89532E-08 -8.0480 0.10000E+01 0.0000 84 OH- 0.80386E-06 -6.0948 0.66070E-06 -6.1800 0.82191E+00 -0.0852 89 HPO3-2 0.20406E-18 -18.6902 0.10021E-18 -18.9991 0.49111E+00 -0.3088 91 H2PO3- 0.21327E-18 -18.6711 0.17566E-18 -18.7553 0.82364E+00 -0.0843 92 H3PO4,aq 0.11405E-10 -10.9429 0.11405E-10 -10.9429 0.10000E+01 0.0000 93 H2PO4- 0.41738E-07 -7.3795 0.34415E-07 -7.4633 0.82455E+00 -0.0838 94 PO4-3 0.91995E-14 -14.0362 0.19922E-14 -14.7007 0.21656E+00 -0.6644 96 H3P2O7- 0.30425E-19 -19.5168 0.25060E-19 -19.6010 0.82364E+00 -0.0843 97 H2P2O7-2 0.18919E-15 -15.7231 0.92910E-16 -16.0319 0.49111E+00 -0.3088 98 HP2O7-3 0.10365E-15 -15.9844 0.21224E-16 -16.6732 0.20478E+00 -0.6887 99 P2O7-4 0.92953E-19 -19.0317 0.58009E-20 -20.2365 0.62407E-01 -1.2048 100 H2S,aq 0.60075E-02 -2.2213 0.59421E-02 -2.2261 0.98911E+00 -0.0048 101 S2-2 0.14495E-07 -7.8388 0.71185E-08 -8.1476 0.49111E+00 -0.3088 102 S3-2 0.77052E-08 -8.1132 0.37841E-08 -8.4220 0.49111E+00 -0.3088 103 S3- 0.21935E-07 -7.6589 0.18067E-07 -7.7431 0.82364E+00 -0.0843 104 S4-2 0.27057E-08 -8.5677 0.13288E-08 -8.8766 0.49111E+00 -0.3088 105 S5-2 0.63352E-09 -9.1982 0.31113E-09 -9.5071 0.49111E+00 -0.3088 106 SO2,aq 0.52950E-13 -13.2761 0.52950E-13 -13.2761 0.10000E+01 0.0000 107 SO3-2 0.40363E-11 -11.3940 0.20157E-11 -11.6956 0.49939E+00 -0.3016 108 HSO3- 0.13394E-09 -9.8731 0.11031E-09 -9.9574 0.82364E+00 -0.0843 109 HSO4- 0.10494E-05 -5.9791 0.86721E-06 -6.0619 0.82642E+00 -0.0828 111 S2O3-2 0.14639E-06 -6.8345 0.71892E-07 -7.1433 0.49111E+00 -0.3088 112 HS2O3- 0.13642E-10 -10.8651 0.11236E-10 -10.9494 0.82364E+00 -0.0843 113 H2S2O3,aq 0.15744E-15 -15.8029 0.15744E-15 -15.8029 0.10000E+01 0.0000 121 S4O6-2 0.11330E-18 -18.9458 0.55644E-19 -19.2546 0.49111E+00 -0.3088 Charge balance for all species = -.6088E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1053814E-05 0.2548761E-01 0.2561756E+02 0.0000 2 H2O 0.1000000E+01 0.5548877E+02 0.9968285E+06 0.0000 3 Cl- 0.2747511E-02 0.2761183E-02 0.9761625E+02 3.4131 4 SO4-- 0.2091072E-02 0.2094754E-02 0.2006581E+03 9.1295 5 HCO3- 0.1249918E-01 0.3198283E-01 0.1946001E+04 4.0718 6 HS- 0.2670120E-02 0.8677927E-02 0.2861873E+03 3.4008 7 Al+++ 0.6878193E-15 0.2330004E-07 0.6268976E-03 2.3235 8 H4SiO4 0.1023685E-02 0.1025336E-02 0.9827271E+02 -2.9898 9 Ca++ 0.1736027E-06 0.2300228E-06 0.9192863E-02 5.0450 10 Mg++ 0.7929629E-10 0.9250643E-10 0.2242676E-05 1.7023 11 Fe++ 0.9516603E-14 0.9786926E-14 0.5450296E-09 -2.2179 12 K+ 0.1536551E-03 0.1561199E-03 0.6087391E+01 2.1616 13 Na+ 0.2212963E-01 0.2214424E-01 0.5076564E+03 4.3191 14 Mn++ 0.2152875E-08 0.2489372E-08 0.1363756E-03 3.1371 15 F- 0.1754973E-03 0.1769757E-03 0.3352706E+01 2.2174 16 HPO4-- 0.4334481E-08 0.4608358E-07 0.4410587E-02 3.4462 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2304238E-01 0.2305664E-01 -.1425467E-04 0.0000000E+00 2 H2O 0.5017388E+02 0.5019632E+02 -.2243911E-01 0.0000000E+00 3 Cl- 0.2497825E-02 0.2497825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1894967E-02 0.1894959E-02 0.8148065E-08 0.0000000E+00 5 HCO3- 0.2893235E-01 0.2893235E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.7850294E-02 0.7850237E-02 0.5703646E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2107771E-07 0.4754274E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9275405E-03 0.1122548E-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 0.8853462E-14 0.3259226E-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- 0.1600960E-03 0.1600960E-03 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: 0.9529E-21 Mass of aqueous solution: 0.907179E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) kaolinite 0.2377E-05 -5.624 0.6137E-03 -3.212 0.9095E-01 0.2361E-03 pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5795E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.91 0.2546 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 = 0.674759 g Volume = 0.254822 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: 0.3999900 moles log = -0.3980 Original solution: 1000.0103000 g Original solution / Rock added: 2500.09 (Water/Rock Ratio), log = 3.3980 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 3.2769 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3165E+00 0.9694 0.1006E+01 0.1037E+01 CO2,gas 0.6330E+00 0.9940 0.2062E+01 0.2074E+01 CH4,gas 0.9538E-05 1.0075 0.3149E-04 0.3125E-04 H2,gas 0.6023E-05 1.0017 0.1977E-04 0.1974E-04 H2S,gas 0.5049E-01 0.9873 0.1633E+00 0.1654E+00 S2,gas 0.7818E-12 1.0000 0.2562E-11 0.2562E-11 CO,gas 0.3317E-08 1.0000 0.1087E-07 0.1087E-07 SO3,gas 0.9080E-31 1.0000 0.2975E-30 0.2975E-30 SO2,gas 0.6988E-13 1.0000 0.2290E-12 0.2290E-12 HF,gas 0.6465E-09 1.0000 0.2119E-08 0.2119E-08 HCl,gas 0.1952E-12 1.0000 0.6396E-12 0.6396E-12 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 -1.697 0.28969E+04 0.002 2 CO2,gas -6.66 -8.04 -1.38 -0.462 0.23644E+04 0.314 3 CH4,gas 4.54 -1.66 -6.20 -1.550 0.10588E+05 -4.502 4 H2,gas 8.00 1.60 -6.40 -3.659 0.10933E+05 -4.704 5 H2S,gas -6.23 -8.72 -2.49 -1.243 0.42445E+04 -0.787 6 S2,gas -7.34 -20.63 -13.29 -2.045 0.22693E+05 -11.591 7 CO,gas 3.21 -6.45 -9.66 -2.973 0.16499E+05 -7.964 8 SO3,gas 17.12 -15.10 -32.23 -8.056 0.55024E+05 -30.526 9 SO2,gas 0.83 -13.51 -14.34 -3.824 0.24484E+05 -12.640 10 HF,gas 0.47 -9.90 -10.37 -5.186 0.17711E+05 -8.674 11 HCl,gas 5.19 -8.70 -13.89 -6.947 0.23722E+05 -12.194 16 albite-high 0.69 -2.33 -3.02 -0.232 0.51551E+04 17 albite -0.38 -2.33 -1.94 -0.149 0.33163E+04 21 analcite 3.32 0.66 -2.66 -0.295 0.45397E+04 22 andalusite 5.00 1.66 -3.34 -0.334 0.57106E+04 25 anhydrite -5.32 -10.06 -4.74 -2.371 0.80977E+04 38 aragonite 0.97 -3.00 -3.97 -1.322 0.67729E+04 40 calcite 0.81 -3.00 -3.81 -1.271 0.65087E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.65 -3.74 -0.340 0.63802E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.32 -0.55 -0.092 0.94004E+03 69 diamond -3.10 -4.85 -1.75 -0.500 0.29854E+04 86 gibbsite 4.08 2.32 -1.76 -0.251 0.29989E+04 89 graphite -3.55 -4.85 -1.30 -0.373 0.22276E+04 98 jadeite 4.22 0.66 -3.55 -0.355 0.60648E+04 102 kyanite 4.88 1.66 -3.22 -0.322 0.54965E+04 119 microcline -2.49 -4.48 -2.00 -0.154 0.34099E+04 123 muscovite 2.58 0.16 -2.42 -0.142 0.41316E+04 124 paragonite 4.24 2.32 -1.92 -0.113 0.32770E+04 125 nepheline 8.34 3.65 -4.69 -0.670 0.80024E+04 147 pyrrhotiteFe0.875 -6.02 -10.85 -4.84 -1.779 0.82604E+04 149 pyrophyllite -6.18 -7.31 -1.14 -0.071 0.19391E+04 154 rhodochrosite -0.98 -4.91 -3.93 -1.311 0.67133E+04 156 sanidine -1.28 -4.48 -3.21 -0.247 0.54777E+04 159 sillimanite 5.26 1.66 -3.60 -0.360 0.61545E+04 166 stilbite -7.52 -11.24 -3.71 -0.177 0.63418E+04 172 sulfur -9.15 -10.31 -1.16 -0.357 0.19817E+04 180 topaz-H 4.62 1.66 -2.96 -0.269 0.50569E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -4.73 -3.08 -0.191 0.52595E+04 197 beidellite-H -2.33 -5.56 -3.23 -0.206 0.55186E+04 198 beidellite-K -1.52 -4.84 -3.32 -0.204 0.56769E+04 199 beidellite-Mg -1.79 -5.28 -3.49 -0.216 0.59550E+04 200 beidellite-Na -1.34 -4.13 -2.79 -0.171 0.47652E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.40 -3.08 -0.386 0.52670E+04 204 montmorillonite-Ca -2.29 -6.68 -4.39 -0.272 0.75014E+04 205 montmorillonite-K -2.24 -6.80 -4.57 -0.280 0.77970E+04 206 montmorillonite-Mg -2.48 -7.24 -4.76 -0.294 0.81202E+04 207 montmorillonite-Na -2.04 -6.09 -4.05 -0.248 0.69210E+04 214 topaz -16.55 -18.14 -1.60 -0.177 0.27242E+04 234 alabandite -0.98 -5.58 -4.60 -1.534 0.78564E+04 237 boehmite 4.41 2.32 -2.08 -0.347 0.35570E+04 240 fluorite -9.93 -14.75 -4.82 -1.608 0.82356E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -1.12 -3.14 -0.241 0.53549E+04 248 an25ab75 2.65 -0.82 -3.46 -0.266 0.59116E+04 249 an30ab70 3.28 -0.51 -3.79 -0.292 0.64778E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0100000 MOLES Current total amount of reactant added: 0.3999900 MOLES New total amount of reactant added: 0.4099900 MOLES Mixing fraction reached given limit of 0.4000E+00 TOTMIX = 0.4100E+00 Execution stopped.