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. 0.66112E-01 0.56470E-05 0.8247 0.00000000E+00 H2O 2 0. 0.50501E+02 0.10000E+01 0.9987 0.00000000E+00 Cl- 3 -1. 0.48578E-02 0.53057E-02 0.8186 0.00000000E+00 SO4-- 4 -2. 0.38050E-02 0.41592E-02 0.4817 0.00000000E+00 HCO3- 5 -1. 0.57852E-01 0.68138E-02 0.8201 0.00000000E+00 HS- 6 -1. 0.15660E-01 0.13223E-02 0.8188 0.00000000E+00 Al+++ 7 3. 0.47754E-05 0.67673E-13 0.1947 0.00000000E+00 H4SiO4 8 0. 0.12153E-01 0.10220E-02 1.0000 0.00000000E+00 Ca++ 9 2. 0.20808E-06 0.16386E-06 0.4773 0.00000000E+00 Mg++ 10 2. 0.83683E-10 0.83740E-10 0.4746 0.00000000E+00 Fe++ 11 2. 0.32592E-07 0.18738E-13 0.4753 0.00000000E+00 K+ 12 1. 0.14123E-03 0.15031E-03 0.8203 0.00000000E+00 Na+ 13 1. 0.20032E-01 0.21959E-01 0.8184 0.00000000E+00 Mn++ 14 2. 0.22519E-08 0.19104E-08 0.4758 0.00000000E+00 F- 15 -1. 0.32010E-03 0.33617E-03 0.8165 0.00000000E+00 HPO4-- 16 -2. 0.41688E-07 0.88706E-09 0.4818 0.00000000E+00 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4858E-06 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 50.0000 SLIM = 0.200000E+01 TEMP = 100.0000 SINC = 0.4000E-01 TEMPC = 0.0000 TOTMIX = 0.799990E+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 0.1122E-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 0.2385E-05 greenalite 90 16.140 0.0000E+00 alite 215 57.999 0.0000E+00 grunerite 91 31.215 0.0000E+00 belite 216 30.433 0.0000E+00 halite 92 1.575 0.0000E+00 ettringite 217 43.232 0.0000E+00 hematite 93 12.566 0.0000E+00 gypsum 218 -4.955 0.0000E+00 heulandite 94 -5.827 0.0000E+00 hemicarboaluminate 219 70.954 0.0000E+00 hercynite 95 17.279 0.0000E+00 hydrogarnet 220 60.662 0.0000E+00 hollandite 96 25.673 0.0000E+00 hydrogarnet-Si 221 50.586 0.0000E+00 iron 97 19.086 0.0000E+00 jennite 222 24.367 0.0000E+00 jadeite 98 4.215 0.0000E+00 monosulfoaluminate 223 53.400 0.0000E+00 julgoldite 99 70.427 0.0000E+00 monocarboaluminate 224 61.898 0.0000E+00 kalsilite 100 7.584 0.0000E+00 portlandite 225 18.272 0.0000E+00 kaolinite 101 -1.333 0.0000E+00 stratlingite 226 36.502 0.0000E+00 kyanite 102 4.876 0.0000E+00 tricarboaluminate 227 70.370 0.0000E+00 larnite-bredigite 103 30.686 0.0000E+00 tobermorite 228 9.823 0.0000E+00 laumontite 104 2.883 0.0000E+00 C4AH13 229 81.816 0.0000E+00 lawsonite 105 9.616 0.0000E+00 C2AH8 230 45.203 0.0000E+00 leucite 106 4.119 0.0000E+00 C3A 231 86.953 0.0000E+00 lime 107 25.998 0.0000E+00 C4AF 232 117.416 0.0000E+00 lizardite 108 23.244 0.0000E+00 CAH10 233 28.335 0.0000E+00 magnesite 109 0.691 0.0000E+00 alabandite 234 -0.978 0.0000E+00 magnetite 110 20.087 0.0000E+00 alunite 235 -10.435 0.0000E+00 minnesotaite 111 10.388 0.0000E+00 artinite 236 15.121 0.0000E+00 minnesotaite-Mg 112 20.602 0.0000E+00 boehmite 237 4.406 0.0000E+00 magnesioferrite 113 26.212 0.0000E+00 dolomite,disordered 238 1.247 0.0000E+00 majorite 114 53.251 0.0000E+00 ferrous-oxide 239 9.812 0.0000E+00 manganosite 115 14.058 0.0000E+00 fluorite 240 -9.931 0.0000E+00 margarite 116 17.324 0.0000E+00 huntite 241 3.770 0.0000E+00 meionite 117 44.874 0.0000E+00 hydromagnesite 242 19.995 0.0000E+00 merwinite 118 55.930 0.0000E+00 nesquehonite 243 4.723 0.0000E+00 microcline 119 -2.486 0.0000E+00 potassium-oxide 244 69.038 0.0000E+00 monticellite 120 24.339 0.0000E+00 silica-amorphous 245 -2.091 0.0000E+00 mullite-Al 121 363.148 0.0000E+00 sodium-oxide 246 55.169 0.0000E+00 mullite-Si 122 7.264 0.0000E+00 an20ab80 247 2.018 0.0000E+00 muscovite 123 2.582 0.0000E+00 an25ab75 248 2.646 0.0000E+00 paragonite 124 4.239 0.0000E+00 an30ab70 249 3.279 0.0000E+00 nepheline 125 8.339 0.0000E+00 tr.625ac.25prg.125 250 45.165 0.0000E+00 Initial composition of reactant (mole%): H2O 88.87 HCl 0.5900 CO2 7.070 CO 0.1600 H2 1.540 S2 0.8000E-01 SO2 1.150 HF 0.4000E-01 H2S 1.120 0.000 Sum of wt% of reactants: 100.6200 Reactant consumed: 0.7999900 moles log = -0.0969 Original solution: 1000.0103000 g Original solution / Rock added: 1250.03 (Water/Rock Ratio), log = 3.0969 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 = 0.7999900 Water: Moles liquid = 0.5058E+02 kg liquid = 0.9111E+00 Moles total = 0.5050E+02 kg total = 0.9098E+00 Activity = 0.9987 Stoichiometric ionic strength = .6266731E-01 Osmotic coef. = 0.8802 True ionic strength = .2627568E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4858E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.56470E-05 -5.2482 0.46572E-05 -5.3319 0.82472E+00 -0.0837 2 H2O 0.99869E+00 -0.0006 0.99869E+00 -0.0006 3 Cl- 0.53057E-02 -2.2753 0.43433E-02 -2.3622 0.81861E+00 -0.0869 4 SO4-- 0.41592E-02 -2.3810 0.20036E-02 -2.6982 0.48172E+00 -0.3172 5 HCO3- 0.68138E-02 -2.1666 0.55879E-02 -2.2528 0.82009E+00 -0.0861 6 HS- 0.13223E-02 -2.8787 0.10826E-02 -2.9655 0.81876E+00 -0.0868 7 Al+++ 0.67673E-13 -13.1696 0.13179E-13 -13.8801 0.19474E+00 -0.7105 8 H4SiO4 0.10220E-02 -2.9906 0.10220E-02 -2.9906 0.10000E+01 0.0000 9 Ca++ 0.16386E-06 -6.7855 0.78217E-07 -7.1067 0.47734E+00 -0.3212 10 Mg++ 0.83740E-10 -10.0771 0.39747E-10 -10.4007 0.47465E+00 -0.3236 11 Fe++ 0.18738E-13 -13.7273 0.89061E-14 -14.0503 0.47529E+00 -0.3230 12 K+ 0.15031E-03 -3.8230 0.12330E-03 -3.9090 0.82032E+00 -0.0860 13 Na+ 0.21959E-01 -1.6584 0.17971E-01 -1.7454 0.81842E+00 -0.0870 14 Mn++ 0.19104E-08 -8.7189 0.90891E-09 -9.0415 0.47578E+00 -0.3226 15 F- 0.33617E-03 -3.4734 0.27450E-03 -3.5615 0.81654E+00 -0.0880 16 HPO4-- 0.88706E-09 -9.0520 0.42739E-09 -9.3692 0.48181E+00 -0.3171 18 HSiO3- 0.25062E-06 -6.6010 0.20516E-06 -6.6879 0.81861E+00 -0.0869 19 Ca(HSiO3)+ 0.44539E-12 -12.3513 0.36546E-12 -12.4372 0.82054E+00 -0.0859 20 Mg(HSiO3)+ 0.28167E-15 -15.5503 0.23112E-15 -15.6362 0.82054E+00 -0.0859 21 NaHSiO3,aq 0.59633E-07 -7.2245 0.59633E-07 -7.2245 0.10000E+01 0.0000 22 AlO+ 0.10061E-09 -9.9974 0.82552E-10 -10.0833 0.82054E+00 -0.0859 23 AlOH+2 0.40189E-11 -11.3959 0.19144E-11 -11.7180 0.47635E+00 -0.3221 24 HAlO2,aq 0.35254E-08 -8.4528 0.35254E-08 -8.4528 0.10000E+01 0.0000 25 AlO2- 0.20515E-08 -8.6879 0.16756E-08 -8.7758 0.81680E+00 -0.0879 26 CH4,aq 0.29818E-08 -8.5255 0.29291E-08 -8.5333 0.98234E+00 -0.0077 27 C2H6,aq 0.21259E-18 -18.6725 0.20883E-18 -18.6802 0.98234E+00 -0.0077 31 CO,aq 0.98367E-11 -11.0072 0.98367E-11 -11.0072 0.10000E+01 0.0000 32 CO2,aq 0.56681E-01 -1.2466 0.55680E-01 -1.2543 0.98234E+00 -0.0077 33 CO3-2 0.21812E-06 -6.6613 0.10480E-06 -6.9796 0.48046E+00 -0.3183 34 CaCO3,aq 0.10278E-09 -9.9881 0.10278E-09 -9.9881 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.13597E-07 -7.8666 0.11157E-07 -7.9525 0.82054E+00 -0.0859 36 CaCl+ 0.67002E-09 -9.1739 0.54978E-09 -9.2598 0.82054E+00 -0.0859 37 CaCl2,aq 0.56731E-12 -12.2462 0.56731E-12 -12.2462 0.10000E+01 0.0000 38 CaF+ 0.38203E-09 -9.4179 0.31347E-09 -9.5038 0.82054E+00 -0.0859 39 CaOH+ 0.14568E-11 -11.8366 0.11954E-11 -11.9225 0.82054E+00 -0.0859 40 CaSO4,aq 0.49765E-07 -7.3031 0.49765E-07 -7.3031 0.10000E+01 0.0000 41 HCl,aq 0.37067E-08 -8.4310 0.37067E-08 -8.4310 0.10000E+01 0.0000 45 HF,aq 0.87515E-05 -5.0579 0.87515E-05 -5.0579 0.10000E+01 0.0000 46 HF2- 0.99079E-09 -9.0040 0.81107E-09 -9.0909 0.81861E+00 -0.0869 48 FeCl+ 0.74618E-16 -16.1272 0.61227E-16 -16.2131 0.82054E+00 -0.0859 51 FeF+ 0.15225E-15 -15.8174 0.12493E-15 -15.9033 0.82054E+00 -0.0859 53 FeO,aq 0.15938E-19 -19.7976 0.15938E-19 -19.7976 0.10000E+01 0.0000 54 FeOH+ 0.75763E-16 -16.1205 0.62167E-16 -16.2064 0.82054E+00 -0.0859 60 H2,aq 0.71497E-08 -8.1457 0.70235E-08 -8.1534 0.98234E+00 -0.0077 61 KCl,aq 0.97064E-08 -8.0129 0.97064E-08 -8.0129 0.10000E+01 0.0000 62 KHSO4,aq 0.32531E-11 -11.4877 0.32531E-11 -11.4877 0.10000E+01 0.0000 63 KOH,aq 0.11292E-10 -10.9472 0.11292E-10 -10.9472 0.10000E+01 0.0000 64 KSO4- 0.46831E-05 -5.3295 0.38336E-05 -5.4164 0.81861E+00 -0.0869 65 MgCO3,aq 0.13092E-13 -13.8830 0.13092E-13 -13.8830 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.70601E-11 -11.1512 0.57931E-11 -11.2371 0.82054E+00 -0.0859 67 MgCl+ 0.30859E-12 -12.5106 0.25321E-12 -12.5965 0.82054E+00 -0.0859 68 MgF+ 0.71913E-12 -12.1432 0.59008E-12 -12.2291 0.82054E+00 -0.0859 69 MgOH+ 0.40965E-14 -14.3876 0.33614E-14 -14.4735 0.82054E+00 -0.0859 71 MnF+ 0.51215E-11 -11.2906 0.42024E-11 -11.3765 0.82054E+00 -0.0859 72 MnO,aq 0.43341E-16 -16.3631 0.43341E-16 -16.3631 0.10000E+01 0.0000 73 MnOH+ 0.71828E-12 -12.1437 0.58938E-12 -12.2296 0.82054E+00 -0.0859 78 MnCl+ 0.29627E-10 -10.5283 0.24310E-10 -10.6142 0.82054E+00 -0.0859 79 MnSO4,aq 0.52573E-09 -9.2792 0.52573E-09 -9.2792 0.10000E+01 0.0000 80 NaCl,aq 0.25868E-04 -4.5872 0.25868E-04 -4.5872 0.10000E+01 0.0000 81 NaF,aq 0.11549E-05 -5.9374 0.11549E-05 -5.9374 0.10000E+01 0.0000 82 NaOH,aq 0.16558E-08 -8.7810 0.16558E-08 -8.7810 0.10000E+01 0.0000 84 OH- 0.15169E-06 -6.8190 0.12390E-06 -6.9069 0.81680E+00 -0.0879 89 HPO3-2 0.19495E-19 -19.7101 0.93668E-20 -20.0284 0.48046E+00 -0.3183 91 H2PO3- 0.10686E-18 -18.9712 0.87477E-19 -19.0581 0.81861E+00 -0.0869 92 H3PO4,aq 0.64834E-10 -10.1882 0.64834E-10 -10.1882 0.10000E+01 0.0000 93 H2PO4- 0.44802E-07 -7.3487 0.36719E-07 -7.4351 0.81957E+00 -0.0864 94 PO4-3 0.36188E-15 -15.4414 0.74874E-16 -16.1257 0.20690E+00 -0.6842 96 H3P2O7- 0.18583E-18 -18.7309 0.15212E-18 -18.8178 0.81861E+00 -0.0869 97 H2P2O7-2 0.22032E-15 -15.6570 0.10585E-15 -15.9753 0.48046E+00 -0.3183 98 HP2O7-3 0.23273E-16 -16.6331 0.45385E-17 -17.3431 0.19501E+00 -0.7099 100 H2S,aq 0.15863E-01 -1.7996 0.15583E-01 -1.8074 0.98234E+00 -0.0077 101 S2-2 0.76960E-08 -8.1137 0.36977E-08 -8.4321 0.48046E+00 -0.3183 102 S3-2 0.23005E-07 -7.6382 0.11053E-07 -7.9565 0.48046E+00 -0.3183 103 S3- 0.50296E-06 -6.2985 0.41173E-06 -6.3854 0.81861E+00 -0.0869 104 S4-2 0.45424E-07 -7.3427 0.21824E-07 -7.6611 0.48046E+00 -0.3183 105 S5-2 0.59807E-07 -7.2233 0.28735E-07 -7.5416 0.48046E+00 -0.3183 106 SO2,aq 0.13667E-11 -11.8643 0.13667E-11 -11.8643 0.10000E+01 0.0000 107 SO3-2 0.37442E-11 -11.4266 0.18311E-11 -11.7373 0.48904E+00 -0.3107 108 HSO3- 0.65224E-09 -9.1856 0.53393E-09 -9.2725 0.81861E+00 -0.0869 109 HSO4- 0.10946E-04 -4.9607 0.89926E-05 -5.0461 0.82154E+00 -0.0854 111 S2O3-2 0.76433E-06 -6.1167 0.36723E-06 -6.4351 0.48046E+00 -0.3183 112 HS2O3- 0.37356E-09 -9.4276 0.30580E-09 -9.5146 0.81861E+00 -0.0869 113 H2S2O3,aq 0.22831E-13 -13.6415 0.22831E-13 -13.6415 0.10000E+01 0.0000 121 S4O6-2 0.18395E-15 -15.7353 0.88381E-16 -16.0536 0.48046E+00 -0.3183 Charge balance for all species = -.6045E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5647011E-05 0.7257102E-01 0.7280513E+02 0.0000 2 H2O 0.1000000E+01 0.5545157E+02 0.9943044E+06 0.0000 3 Cl- 0.5305744E-02 0.5331626E-02 0.1881381E+03 2.9697 4 SO4-- 0.4159209E-02 0.4176070E-02 0.3992838E+03 7.9656 5 HCO3- 0.6813765E-02 0.6349489E-01 0.3856161E+04 3.0791 6 HS- 0.1322263E-02 0.1718764E-01 0.5657710E+03 2.3663 7 Al+++ 0.6767279E-13 0.5681600E-08 0.1525811E-03 2.1155 8 H4SiO4 0.1021952E-02 0.1022263E-02 0.9779564E+02 -2.9906 9 Ca++ 0.1638600E-06 0.2283786E-06 0.9110150E-02 3.5571 10 Mg++ 0.8373995E-10 0.9184521E-10 0.2222497E-05 0.2631 11 Fe++ 0.1873822E-13 0.1904088E-13 0.1058403E-08 -3.3866 12 K+ 0.1503112E-03 0.1550040E-03 0.6032620E+01 1.4228 13 Na+ 0.2195887E-01 0.2198596E-01 0.5030888E+03 3.5865 14 Mn++ 0.1910378E-08 0.2471579E-08 0.1351485E-03 1.6223 15 F- 0.3361719E-03 0.3460807E-03 0.6544090E+01 1.7704 16 HPO4-- 0.8870590E-09 0.4575419E-07 0.4370902E-02 1.2946 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6611238E-01 0.6612192E-01 -.9532203E-05 0.0000000E+00 2 H2O 0.5050136E+02 0.5052380E+02 -.2243847E-01 0.0000000E+00 3 Cl- 0.4857825E-02 0.4857825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.3804967E-02 0.3804959E-02 0.8148063E-08 0.0000000E+00 5 HCO3- 0.5785235E-01 0.5785235E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.1566029E-01 0.1566024E-01 0.5703644E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5176698E-08 0.4770175E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9314181E-03 0.1122160E-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 0.1734879E-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- 0.3200960E-03 0.3153258E-03 0.4770175E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.915415E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5798E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6741 -0.171 99.93 0.2546 topaz 0.2385E-05 -5.622 0.4390E-03 -3.358 0.6508E-01 0.1229E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674493 g Volume = 0.254674 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: 0.7999900 moles log = -0.0969 Original solution: 1000.0103000 g Original solution / Rock added: 1250.03 (Water/Rock Ratio), log = 3.0969 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 7.5792 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1396E+00 0.9497 0.1005E+01 0.1058E+01 CO2,gas 0.8022E+00 0.9798 0.5957E+01 0.6080E+01 CH4,gas 0.5641E-06 1.0085 0.4311E-05 0.4275E-05 H2,gas 0.1212E-05 1.0040 0.9221E-05 0.9184E-05 H2S,gas 0.5820E-01 0.9711 0.4284E+00 0.4411E+00 S2,gas 0.1069E-10 1.0000 0.8101E-10 0.8101E-10 CO,gas 0.1934E-08 1.0000 0.1466E-07 0.1466E-07 SO3,gas 0.2171E-29 1.0000 0.1645E-28 0.1645E-28 SO2,gas 0.7798E-12 1.0000 0.5910E-11 0.5910E-11 HF,gas 0.2835E-08 1.0000 0.2149E-07 0.2149E-07 HCl,gas 0.8630E-12 1.0000 0.6541E-11 0.6541E-11 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 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+00 214 topaz -16.55 -16.55 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 0.28975E+04 0.002 2 CO2,gas -6.66 -7.58 -0.92 -0.308 0.15776E+04 0.775 3 CH4,gas 4.54 -2.52 -7.06 -1.766 0.12062E+05 -5.365 4 H2,gas 8.00 1.27 -6.73 -3.848 0.11498E+05 -5.035 5 H2S,gas -6.23 -8.30 -2.07 -1.034 0.35296E+04 -0.368 6 S2,gas -7.34 -19.13 -11.79 -1.814 0.20132E+05 -10.091 7 CO,gas 3.21 -6.32 -9.53 -2.933 0.16277E+05 -7.834 8 SO3,gas 17.12 -13.36 -30.48 -7.621 0.52048E+05 -28.784 9 SO2,gas 0.83 -12.10 -12.93 -3.447 0.22073E+05 -11.228 10 HF,gas 0.47 -8.89 -9.37 -4.683 0.15994E+05 -7.668 11 HCl,gas 5.19 -7.69 -12.88 -6.442 0.21998E+05 -11.184 16 albite-high 0.69 -3.27 -3.96 -0.305 0.67625E+04 17 albite -0.38 -3.27 -2.88 -0.222 0.49237E+04 21 analcite 3.32 -0.28 -3.60 -0.400 0.61477E+04 22 andalusite 5.00 1.24 -3.76 -0.376 0.64230E+04 25 anhydrite -5.32 -9.80 -4.49 -2.244 0.76633E+04 38 aragonite 0.97 -4.03 -4.99 -1.665 0.85273E+04 40 calcite 0.81 -4.03 -4.84 -1.613 0.82631E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.23 -4.15 -0.378 0.70926E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.11 -0.76 -0.127 0.12965E+04 69 diamond -3.10 -5.05 -1.95 -0.557 0.33285E+04 86 gibbsite 4.08 2.11 -1.97 -0.281 0.33561E+04 89 graphite -3.55 -5.05 -1.51 -0.430 0.25708E+04 98 jadeite 4.22 -0.28 -4.49 -0.449 0.76722E+04 101 kaolinite -1.33 -1.75 -0.42 -0.038 0.71364E+03 102 kyanite 4.88 1.24 -3.64 -0.364 0.62089E+04 119 microcline -2.49 -5.43 -2.94 -0.227 0.50278E+04 123 muscovite 2.58 -1.20 -3.78 -0.223 0.64625E+04 124 paragonite 4.24 0.96 -3.28 -0.193 0.55974E+04 149 pyrophyllite -6.18 -7.73 -1.55 -0.097 0.26521E+04 154 rhodochrosite -0.98 -5.96 -4.99 -1.662 0.85135E+04 156 sanidine -1.28 -5.43 -4.16 -0.320 0.70956E+04 159 sillimanite 5.26 1.24 -4.02 -0.402 0.68669E+04 172 sulfur -9.15 -9.56 -0.41 -0.126 0.70114E+03 180 topaz-H 4.62 1.24 -3.38 -0.307 0.57699E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -5.46 -3.81 -0.236 0.65093E+04 197 beidellite-H -2.33 -6.04 -3.72 -0.237 0.63493E+04 198 beidellite-K -1.52 -5.58 -4.05 -0.248 0.69238E+04 199 beidellite-Mg -1.79 -6.00 -4.21 -0.261 0.71912E+04 200 beidellite-Na -1.34 -4.86 -3.52 -0.215 0.60086E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -1.88 -3.57 -0.446 0.60882E+04 218 gypsum -4.96 -9.81 -4.85 -1.213 0.82828E+04 237 boehmite 4.41 2.11 -2.29 -0.382 0.39135E+04 240 fluorite -9.93 -14.23 -4.30 -1.433 0.73402E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -2.25 -4.27 -0.328 0.72916E+04 248 an25ab75 2.65 -2.00 -4.64 -0.357 0.79305E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 0.7999900 MOLES New total amount of reactant added: 0.8399900 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 = 0.8399900 Water: Moles liquid = 0.5061E+02 kg liquid = 0.9118E+00 Moles total = 0.5053E+02 kg total = 0.9104E+00 Activity = 0.9986 Stoichiometric ionic strength = .6520085E-01 Osmotic coef. = 0.8788 True ionic strength = .2646311E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5094E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.65766E-05 -5.1820 0.54208E-05 -5.2659 0.82427E+00 -0.0839 2 H2O 0.99861E+00 -0.0006 0.99861E+00 -0.0006 3 Cl- 0.55596E-02 -2.2550 0.45484E-02 -2.3421 0.81813E+00 -0.0872 4 SO4-- 0.43629E-02 -2.3602 0.20973E-02 -2.6783 0.48072E+00 -0.3181 5 HCO3- 0.62355E-02 -2.2051 0.51107E-02 -2.2915 0.81961E+00 -0.0864 6 HS- 0.12048E-02 -2.9191 0.98583E-03 -3.0062 0.81828E+00 -0.0871 7 Al+++ 0.88154E-13 -13.0548 0.17087E-13 -13.7673 0.19383E+00 -0.7126 8 H4SiO4 0.10218E-02 -2.9906 0.10218E-02 -2.9906 0.10000E+01 0.0000 9 Ca++ 0.16299E-06 -6.7879 0.77634E-07 -7.1099 0.47632E+00 -0.3221 10 Mg++ 0.84204E-10 -10.0747 0.39881E-10 -10.3992 0.47362E+00 -0.3246 11 Fe++ 0.21055E-13 -13.6766 0.99857E-14 -14.0006 0.47426E+00 -0.3240 12 K+ 0.14999E-03 -3.8239 0.12297E-03 -3.9102 0.81985E+00 -0.0863 13 Na+ 0.21942E-01 -1.6587 0.17947E-01 -1.7460 0.81793E+00 -0.0873 14 Mn++ 0.18900E-08 -8.7235 0.89727E-09 -9.0471 0.47475E+00 -0.3235 15 F- 0.35153E-03 -3.4540 0.28686E-03 -3.5423 0.81605E+00 -0.0883 16 HPO4-- 0.76460E-09 -9.1166 0.36762E-09 -9.4346 0.48080E+00 -0.3180 18 HSiO3- 0.21543E-06 -6.6667 0.17625E-06 -6.7539 0.81813E+00 -0.0872 19 Ca(HSiO3)+ 0.37998E-12 -12.4202 0.31161E-12 -12.5064 0.82007E+00 -0.0862 20 Mg(HSiO3)+ 0.24292E-15 -15.6145 0.19921E-15 -15.7007 0.82007E+00 -0.0862 21 NaHSiO3,aq 0.51159E-07 -7.2911 0.51159E-07 -7.2911 0.10000E+01 0.0000 22 AlO+ 0.96326E-10 -10.0163 0.78994E-10 -10.1024 0.82007E+00 -0.0862 23 AlOH+2 0.44859E-11 -11.3482 0.21322E-11 -11.6712 0.47532E+00 -0.3230 24 HAlO2,aq 0.28980E-08 -8.5379 0.28980E-08 -8.5379 0.10000E+01 0.0000 25 AlO2- 0.14497E-08 -8.8387 0.11834E-08 -8.9269 0.81630E+00 -0.0881 26 CH4,aq 0.23737E-08 -8.6246 0.23303E-08 -8.6326 0.98170E+00 -0.0080 27 C2H6,aq 0.14482E-18 -18.8392 0.14217E-18 -18.8472 0.98170E+00 -0.0080 31 CO,aq 0.97374E-11 -11.0116 0.97374E-11 -11.0116 0.10000E+01 0.0000 32 CO2,aq 0.60386E-01 -1.2191 0.59280E-01 -1.2271 0.98170E+00 -0.0080 33 CO3-2 0.17176E-06 -6.7651 0.82349E-07 -7.0843 0.47945E+00 -0.3193 34 CaCO3,aq 0.80162E-10 -10.0960 0.80162E-10 -10.0960 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.12350E-07 -7.9083 0.10128E-07 -7.9945 0.82007E+00 -0.0862 36 CaCl+ 0.69683E-09 -9.1569 0.57145E-09 -9.2430 0.82007E+00 -0.0862 37 CaCl2,aq 0.61751E-12 -12.2094 0.61751E-12 -12.2094 0.10000E+01 0.0000 38 CaF+ 0.39649E-09 -9.4018 0.32515E-09 -9.4879 0.82007E+00 -0.0862 39 CaOH+ 0.12429E-11 -11.9056 0.10193E-11 -11.9917 0.82007E+00 -0.0862 40 CaSO4,aq 0.51704E-07 -7.2865 0.51704E-07 -7.2865 0.10000E+01 0.0000 41 HCl,aq 0.45182E-08 -8.3450 0.45182E-08 -8.3450 0.10000E+01 0.0000 45 HF,aq 0.10645E-04 -4.9728 0.10645E-04 -4.9728 0.10000E+01 0.0000 46 HF2- 0.12602E-08 -8.8996 0.10310E-08 -8.9867 0.81813E+00 -0.0872 48 FeCl+ 0.87665E-16 -16.0572 0.71891E-16 -16.1433 0.82007E+00 -0.0862 51 FeF+ 0.17850E-15 -15.7484 0.14638E-15 -15.8345 0.82007E+00 -0.0862 53 FeO,aq 0.13189E-19 -19.8798 0.13189E-19 -19.8798 0.10000E+01 0.0000 54 FeOH+ 0.73017E-16 -16.1366 0.59879E-16 -16.2227 0.82007E+00 -0.0862 60 H2,aq 0.66515E-08 -8.1771 0.65297E-08 -8.1851 0.98170E+00 -0.0080 61 KCl,aq 0.10137E-07 -7.9941 0.10137E-07 -7.9941 0.10000E+01 0.0000 62 KHSO4,aq 0.39529E-11 -11.4031 0.39529E-11 -11.4031 0.10000E+01 0.0000 63 KOH,aq 0.96742E-11 -11.0144 0.96742E-11 -11.0144 0.10000E+01 0.0000 64 KSO4- 0.48918E-05 -5.3105 0.40021E-05 -5.3977 0.81813E+00 -0.0872 65 MgCO3,aq 0.10322E-13 -13.9862 0.10322E-13 -13.9862 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.64826E-11 -11.1882 0.53162E-11 -11.2744 0.82007E+00 -0.0862 67 MgCl+ 0.32444E-12 -12.4889 0.26606E-12 -12.5750 0.82007E+00 -0.0862 68 MgF+ 0.75448E-12 -12.1224 0.61873E-12 -12.2085 0.82007E+00 -0.0862 69 MgOH+ 0.35330E-14 -14.4519 0.28973E-14 -14.5380 0.82007E+00 -0.0862 71 MnF+ 0.52867E-11 -11.2768 0.43354E-11 -11.3630 0.82007E+00 -0.0862 72 MnO,aq 0.31578E-16 -16.5006 0.31578E-16 -16.5006 0.10000E+01 0.0000 73 MnOH+ 0.60950E-12 -12.2150 0.49983E-12 -12.3012 0.82007E+00 -0.0862 78 MnCl+ 0.30646E-10 -10.5136 0.25132E-10 -10.5998 0.82007E+00 -0.0862 79 MnSO4,aq 0.54328E-09 -9.2650 0.54328E-09 -9.2650 0.10000E+01 0.0000 80 NaCl,aq 0.27053E-04 -4.5678 0.27053E-04 -4.5678 0.10000E+01 0.0000 81 NaF,aq 0.12053E-05 -5.9189 0.12053E-05 -5.9189 0.10000E+01 0.0000 82 NaOH,aq 0.14205E-08 -8.8476 0.14205E-08 -8.8476 0.10000E+01 0.0000 84 OH- 0.13039E-06 -6.8848 0.10644E-06 -6.9729 0.81630E+00 -0.0881 89 HPO3-2 0.15624E-19 -19.8062 0.74911E-20 -20.1255 0.47945E+00 -0.3193 91 H2PO3- 0.99533E-19 -19.0020 0.81431E-19 -19.0892 0.81813E+00 -0.0872 92 H3PO4,aq 0.75553E-10 -10.1217 0.75553E-10 -10.1217 0.10000E+01 0.0000 93 H2PO4- 0.44881E-07 -7.3479 0.36762E-07 -7.4346 0.81909E+00 -0.0867 94 PO4-3 0.26860E-15 -15.5709 0.55330E-16 -16.2570 0.20600E+00 -0.6861 96 H3P2O7- 0.21696E-18 -18.6636 0.17750E-18 -18.7508 0.81813E+00 -0.0872 97 H2P2O7-2 0.22132E-15 -15.6550 0.10611E-15 -15.9742 0.47945E+00 -0.3193 98 HP2O7-3 0.20138E-16 -16.6960 0.39087E-17 -17.4080 0.19409E+00 -0.7120 100 H2S,aq 0.16824E-01 -1.7741 0.16516E-01 -1.7821 0.98170E+00 -0.0080 101 S2-2 0.68785E-08 -8.1625 0.32979E-08 -8.4818 0.47945E+00 -0.3193 102 S3-2 0.23440E-07 -7.6300 0.11238E-07 -7.9493 0.47945E+00 -0.3193 103 S3- 0.61771E-06 -6.2092 0.50536E-06 -6.2964 0.81813E+00 -0.0872 104 S4-2 0.52765E-07 -7.2777 0.25298E-07 -7.5969 0.47945E+00 -0.3193 105 S5-2 0.79202E-07 -7.1013 0.37974E-07 -7.4205 0.47945E+00 -0.3193 106 SO2,aq 0.18023E-11 -11.7442 0.18023E-11 -11.7442 0.10000E+01 0.0000 107 SO3-2 0.36515E-11 -11.4375 0.17821E-11 -11.7491 0.48806E+00 -0.3115 108 HSO3- 0.73934E-09 -9.1312 0.60488E-09 -9.2183 0.81813E+00 -0.0872 109 HSO4- 0.13345E-04 -4.8747 0.10957E-04 -4.9603 0.82107E+00 -0.0856 111 S2O3-2 0.84988E-06 -6.0706 0.40748E-06 -6.3899 0.47945E+00 -0.3193 112 HS2O3- 0.48275E-09 -9.3163 0.39495E-09 -9.4035 0.81813E+00 -0.0872 113 H2S2O3,aq 0.34322E-13 -13.4644 0.34322E-13 -13.4644 0.10000E+01 0.0000 121 S4O6-2 0.33073E-15 -15.4805 0.15857E-15 -15.7998 0.47945E+00 -0.3193 Charge balance for all species = -.6040E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6576551E-05 0.7724287E-01 0.7747774E+02 0.0000 2 H2O 0.1000000E+01 0.5544786E+02 0.9940544E+06 0.0000 3 Cl- 0.5559582E-02 0.5586650E-02 0.1971008E+03 2.9238 4 SO4-- 0.4362912E-02 0.4382566E-02 0.4189499E+03 7.8535 5 HCO3- 0.6235544E-02 0.6662133E-01 0.4045288E+04 2.9744 6 HS- 0.1204761E-02 0.1803192E-01 0.5934529E+03 2.2597 7 Al+++ 0.8815384E-13 0.4448606E-08 0.1194466E-03 2.0305 8 H4SiO4 0.1021781E-02 0.1022047E-02 0.9775700E+02 -2.9906 9 Ca++ 0.1629858E-06 0.2282155E-06 0.9101961E-02 3.4219 10 Mg++ 0.8420394E-10 0.9177959E-10 0.2220499E-05 0.1326 11 Fe++ 0.2105527E-13 0.2139448E-13 0.1189010E-08 -3.4688 12 K+ 0.1499913E-03 0.1548933E-03 0.6027197E+01 1.3557 13 Na+ 0.2194194E-01 0.2197025E-01 0.5026365E+03 3.5199 14 Mn++ 0.1889989E-08 0.2469813E-08 0.1350270E-03 1.4848 15 F- 0.3515266E-03 0.3633802E-03 0.6869940E+01 1.7236 16 HPO4-- 0.7645963E-09 0.4572150E-07 0.4366973E-02 1.0973 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7041938E-01 0.7042892E-01 -.9534444E-05 0.0000000E+00 2 H2O 0.5053411E+02 0.5055655E+02 -.2243753E-01 0.0000000E+00 3 Cl- 0.5093825E-02 0.5093825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.3995967E-02 0.3995959E-02 0.8148063E-08 0.0000000E+00 5 HCO3- 0.6074435E-01 0.6074435E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.1644129E-01 0.1644124E-01 0.5703644E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4056174E-08 0.4771296E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9318878E-03 0.1122113E-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 0.1950717E-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- 0.3360960E-03 0.3313247E-03 0.4771296E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.916239E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.8399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5798E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6740 -0.171 99.93 0.2545 topaz 0.2386E-05 -5.622 0.4391E-03 -3.357 0.6510E-01 0.1229E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674465 g Volume = 0.254664 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: 0.8399900 moles log = -0.0757 Original solution: 1000.0103000 g Original solution / Rock added: 1190.50 (Water/Rock Ratio), log = 3.0757 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 8.0101 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1323E+00 0.9478 0.1005E+01 0.1060E+01 CO2,gas 0.8092E+00 0.9785 0.6342E+01 0.6482E+01 CH4,gas 0.4245E-06 1.0087 0.3430E-05 0.3400E-05 H2,gas 0.1066E-05 1.0043 0.8573E-05 0.8536E-05 H2S,gas 0.5847E-01 0.9695 0.4540E+00 0.4683E+00 S2,gas 0.1314E-10 1.0000 0.1053E-09 0.1053E-09 CO,gas 0.1812E-08 1.0000 0.1451E-07 0.1451E-07 SO3,gas 0.2913E-29 1.0000 0.2334E-28 0.2334E-28 SO2,gas 0.9730E-12 1.0000 0.7794E-11 0.7794E-11 HF,gas 0.3263E-08 1.0000 0.2614E-07 0.2614E-07 HCl,gas 0.9953E-12 1.0000 0.7972E-11 0.7972E-11 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 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+00 214 topaz -16.55 -16.55 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 0.28976E+04 0.002 2 CO2,gas -6.66 -7.56 -0.90 -0.299 0.15311E+04 0.802 3 CH4,gas 4.54 -2.62 -7.16 -1.791 0.12232E+05 -5.465 4 H2,gas 8.00 1.23 -6.77 -3.866 0.11552E+05 -5.067 5 H2S,gas -6.23 -8.27 -2.04 -1.021 0.34865E+04 -0.343 6 S2,gas -7.34 -19.01 -11.68 -1.796 0.19937E+05 -9.978 7 CO,gas 3.21 -6.32 -9.54 -2.935 0.16285E+05 -7.838 8 SO3,gas 17.12 -13.21 -30.33 -7.583 0.51789E+05 -28.632 9 SO2,gas 0.83 -11.98 -12.81 -3.415 0.21868E+05 -11.108 10 HF,gas 0.47 -8.81 -9.28 -4.641 0.15848E+05 -7.583 11 HCl,gas 5.19 -7.61 -12.80 -6.399 0.21851E+05 -11.098 16 albite-high 0.69 -3.42 -4.11 -0.316 0.70214E+04 17 albite -0.38 -3.42 -3.04 -0.233 0.51826E+04 21 analcite 3.32 -0.43 -3.75 -0.417 0.64067E+04 22 andalusite 5.00 1.07 -3.93 -0.393 0.67135E+04 25 anhydrite -5.32 -9.79 -4.47 -2.236 0.76349E+04 40 calcite 0.81 -4.14 -4.95 -1.649 0.84474E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 4.06 -4.32 -0.393 0.73831E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 2.03 -0.84 -0.141 0.14419E+04 69 diamond -3.10 -5.09 -1.99 -0.567 0.33901E+04 86 gibbsite 4.08 2.03 -2.05 -0.293 0.35015E+04 89 graphite -3.55 -5.09 -1.54 -0.440 0.26323E+04 98 jadeite 4.22 -0.43 -4.64 -0.464 0.79312E+04 101 kaolinite -1.33 -1.92 -0.59 -0.053 0.10043E+04 102 kyanite 4.88 1.07 -3.81 -0.381 0.64994E+04 119 microcline -2.49 -5.58 -3.10 -0.238 0.52878E+04 123 muscovite 2.58 -1.52 -4.11 -0.242 0.70130E+04 124 paragonite 4.24 0.64 -3.60 -0.212 0.61470E+04 149 pyrophyllite -6.18 -7.90 -1.72 -0.108 0.29427E+04 156 sanidine -1.28 -5.58 -4.31 -0.331 0.73555E+04 159 sillimanite 5.26 1.07 -4.19 -0.419 0.71575E+04 172 sulfur -9.15 -9.51 -0.35 -0.109 0.60395E+03 180 topaz-H 4.62 1.07 -3.55 -0.323 0.60606E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -5.68 -4.03 -0.249 0.68860E+04 197 beidellite-H -2.33 -6.24 -3.92 -0.250 0.66879E+04 198 beidellite-K -1.52 -5.80 -4.28 -0.262 0.73002E+04 199 beidellite-Mg -1.79 -6.22 -4.43 -0.274 0.75665E+04 200 beidellite-Na -1.34 -5.08 -3.74 -0.229 0.63847E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.01 -3.69 -0.461 0.63007E+04 218 gypsum -4.96 -9.79 -4.83 -1.209 0.82546E+04 237 boehmite 4.41 2.03 -2.38 -0.396 0.40588E+04 240 fluorite -9.93 -14.19 -4.26 -1.421 0.72805E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -2.43 -4.45 -0.343 0.76030E+04 248 an25ab75 2.65 -2.19 -4.83 -0.372 0.82551E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 0.8399900 MOLES New total amount of reactant added: 0.8799900 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 = 0.8799900 Water: Moles liquid = 0.5065E+02 kg liquid = 0.9124E+00 Moles total = 0.5057E+02 kg total = 0.9110E+00 Activity = 0.9985 Stoichiometric ionic strength = .6773110E-01 Osmotic coef. = 0.8775 True ionic strength = .2664991E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5330E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.76950E-05 -5.1138 0.63393E-05 -5.1980 0.82382E+00 -0.0842 2 H2O 0.99853E+00 -0.0006 0.99853E+00 -0.0006 3 Cl- 0.58131E-02 -2.2356 0.47530E-02 -2.3230 0.81765E+00 -0.0874 4 SO4-- 0.45657E-02 -2.3405 0.21903E-02 -2.6595 0.47972E+00 -0.3190 5 HCO3- 0.56579E-02 -2.2473 0.46346E-02 -2.3340 0.81914E+00 -0.0866 6 HS- 0.10888E-02 -2.9630 0.89044E-03 -3.0504 0.81780E+00 -0.0874 7 Al+++ 0.11627E-12 -12.9345 0.22432E-13 -13.6491 0.19292E+00 -0.7146 8 H4SiO4 0.10216E-02 -2.9907 0.10216E-02 -2.9907 0.10000E+01 0.0000 9 Ca++ 0.16213E-06 -6.7901 0.77063E-07 -7.1132 0.47531E+00 -0.3230 10 Mg++ 0.84671E-10 -10.0723 0.40016E-10 -10.3978 0.47260E+00 -0.3255 11 Fe++ 0.23983E-13 -13.6201 0.11350E-13 -13.9450 0.47324E+00 -0.3249 12 K+ 0.14967E-03 -3.8249 0.12264E-03 -3.9114 0.81938E+00 -0.0865 13 Na+ 0.21925E-01 -1.6591 0.17923E-01 -1.7466 0.81745E+00 -0.0875 14 Mn++ 0.18702E-08 -8.7281 0.88599E-09 -9.0526 0.47373E+00 -0.3245 15 F- 0.36643E-03 -3.4360 0.29884E-03 -3.5246 0.81556E+00 -0.0885 16 HPO4-- 0.65572E-09 -9.1833 0.31462E-09 -9.5022 0.47981E+00 -0.3189 18 HSiO3- 0.18431E-06 -6.7345 0.15070E-06 -6.8219 0.81765E+00 -0.0874 19 Ca(HSiO3)+ 0.32270E-12 -12.4912 0.26448E-12 -12.5776 0.81960E+00 -0.0864 20 Mg(HSiO3)+ 0.20853E-15 -15.6808 0.17091E-15 -15.7672 0.81960E+00 -0.0864 21 NaHSiO3,aq 0.43684E-07 -7.3597 0.43684E-07 -7.3597 0.10000E+01 0.0000 22 AlO+ 0.92517E-10 -10.0338 0.75827E-10 -10.1202 0.81960E+00 -0.0864 23 AlOH+2 0.50463E-11 -11.2970 0.23935E-11 -11.6210 0.47431E+00 -0.3239 24 HAlO2,aq 0.23786E-08 -8.6237 0.23786E-08 -8.6237 0.10000E+01 0.0000 25 AlO2- 0.10181E-08 -8.9922 0.83056E-09 -9.0806 0.81582E+00 -0.0884 26 CH4,aq 0.18628E-08 -8.7298 0.18276E-08 -8.7381 0.98106E+00 -0.0083 27 C2H6,aq 0.96122E-19 -19.0172 0.94301E-19 -19.0255 0.98106E+00 -0.0083 31 CO,aq 0.95771E-11 -11.0188 0.95771E-11 -11.0188 0.10000E+01 0.0000 32 CO2,aq 0.64085E-01 -1.1932 0.62871E-01 -1.2015 0.98106E+00 -0.0083 33 CO3-2 0.13347E-06 -6.8746 0.63858E-07 -7.1948 0.47845E+00 -0.3202 34 CaCO3,aq 0.61706E-10 -10.2097 0.61706E-10 -10.2097 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.11124E-07 -7.9538 0.91169E-08 -8.0402 0.81960E+00 -0.0864 36 CaCl+ 0.72324E-09 -9.1407 0.59276E-09 -9.2271 0.81960E+00 -0.0864 37 CaCl2,aq 0.66936E-12 -12.1743 0.66936E-12 -12.1743 0.10000E+01 0.0000 38 CaF+ 0.41025E-09 -9.3870 0.33624E-09 -9.4734 0.81960E+00 -0.0864 39 CaOH+ 0.10555E-11 -11.9765 0.86511E-12 -12.0629 0.81960E+00 -0.0864 40 CaSO4,aq 0.53599E-07 -7.2708 0.53599E-07 -7.2708 0.10000E+01 0.0000 41 HCl,aq 0.55214E-08 -8.2580 0.55214E-08 -8.2580 0.10000E+01 0.0000 45 HF,aq 0.12969E-04 -4.8871 0.12969E-04 -4.8871 0.10000E+01 0.0000 46 HF2- 0.16004E-08 -8.7958 0.13085E-08 -8.8832 0.81765E+00 -0.0874 48 FeCl+ 0.10418E-15 -15.9822 0.85386E-16 -16.0686 0.81960E+00 -0.0864 51 FeF+ 0.21148E-15 -15.6747 0.17332E-15 -15.7611 0.81960E+00 -0.0864 53 FeO,aq 0.10960E-19 -19.9602 0.10960E-19 -19.9602 0.10000E+01 0.0000 54 FeOH+ 0.71001E-16 -16.1487 0.58192E-16 -16.2351 0.81960E+00 -0.0864 60 H2,aq 0.61719E-08 -8.2096 0.60549E-08 -8.2179 0.98106E+00 -0.0083 61 KCl,aq 0.10565E-07 -7.9761 0.10565E-07 -7.9761 0.10000E+01 0.0000 62 KHSO4,aq 0.48145E-11 -11.3174 0.48145E-11 -11.3174 0.10000E+01 0.0000 63 KOH,aq 0.82496E-11 -11.0836 0.82496E-11 -11.0836 0.10000E+01 0.0000 64 KSO4- 0.50979E-05 -5.2926 0.41682E-05 -5.3800 0.81765E+00 -0.0874 65 MgCO3,aq 0.80313E-14 -14.0952 0.80313E-14 -14.0952 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.59020E-11 -11.2290 0.48373E-11 -11.3154 0.81960E+00 -0.0864 67 MgCl+ 0.34037E-12 -12.4680 0.27897E-12 -12.5544 0.81960E+00 -0.0864 68 MgF+ 0.78911E-12 -12.1029 0.64675E-12 -12.1893 0.81960E+00 -0.0864 69 MgOH+ 0.30329E-14 -14.5181 0.24857E-14 -14.6045 0.81960E+00 -0.0864 71 MnF+ 0.54414E-11 -11.2643 0.44597E-11 -11.3507 0.81960E+00 -0.0864 72 MnO,aq 0.22798E-16 -16.6421 0.22798E-16 -16.6421 0.10000E+01 0.0000 73 MnOH+ 0.51489E-12 -12.2883 0.42200E-12 -12.3747 0.81960E+00 -0.0864 78 MnCl+ 0.31640E-10 -10.4998 0.25932E-10 -10.5862 0.81960E+00 -0.0864 79 MnSO4,aq 0.56023E-09 -9.2516 0.56023E-09 -9.2516 0.10000E+01 0.0000 80 NaCl,aq 0.28231E-04 -4.5493 0.28231E-04 -4.5493 0.10000E+01 0.0000 81 NaF,aq 0.12540E-05 -5.9017 0.12540E-05 -5.9017 0.10000E+01 0.0000 82 NaOH,aq 0.12129E-08 -8.9162 0.12129E-08 -8.9162 0.10000E+01 0.0000 84 OH- 0.11155E-06 -6.9525 0.91007E-07 -7.0409 0.81582E+00 -0.0884 89 HPO3-2 0.12426E-19 -19.9057 0.59454E-20 -20.2258 0.47845E+00 -0.3202 91 H2PO3- 0.92434E-19 -19.0342 0.75579E-19 -19.1216 0.81765E+00 -0.0874 92 H3PO4,aq 0.88428E-10 -10.0534 0.88428E-10 -10.0534 0.10000E+01 0.0000 93 H2PO4- 0.44945E-07 -7.3473 0.36792E-07 -7.4342 0.81861E+00 -0.0869 94 PO4-3 0.19742E-15 -15.7046 0.40493E-16 -16.3926 0.20511E+00 -0.6880 96 H3P2O7- 0.25431E-18 -18.5946 0.20793E-18 -18.6821 0.81765E+00 -0.0874 97 H2P2O7-2 0.22217E-15 -15.6533 0.10630E-15 -15.9735 0.47845E+00 -0.3202 98 HP2O7-3 0.17331E-16 -16.7612 0.33482E-17 -17.4752 0.19319E+00 -0.7140 100 H2S,aq 0.17783E-01 -1.7500 0.17446E-01 -1.7583 0.98106E+00 -0.0083 101 S2-2 0.60645E-08 -8.2172 0.29016E-08 -8.5374 0.47845E+00 -0.3202 102 S3-2 0.23541E-07 -7.6282 0.11263E-07 -7.9483 0.47845E+00 -0.3202 103 S3- 0.75227E-06 -6.1236 0.61509E-06 -6.2111 0.81765E+00 -0.0874 104 S4-2 0.60365E-07 -7.2192 0.28882E-07 -7.5394 0.47845E+00 -0.3202 105 S5-2 0.10322E-06 -6.9863 0.49384E-07 -7.3064 0.47845E+00 -0.3202 106 SO2,aq 0.23872E-11 -11.6221 0.23872E-11 -11.6221 0.10000E+01 0.0000 107 SO3-2 0.35434E-11 -11.4506 0.17259E-11 -11.7630 0.48709E+00 -0.3124 108 HSO3- 0.83783E-09 -9.0768 0.68505E-09 -9.1643 0.81765E+00 -0.0874 109 HSO4- 0.16306E-04 -4.7876 0.13381E-04 -4.8735 0.82060E+00 -0.0859 111 S2O3-2 0.93954E-06 -6.0271 0.44952E-06 -6.3472 0.47845E+00 -0.3202 112 HS2O3- 0.62316E-09 -9.2054 0.50953E-09 -9.2928 0.81765E+00 -0.0874 113 H2S2O3,aq 0.51781E-13 -13.2858 0.51781E-13 -13.2858 0.10000E+01 0.0000 121 S4O6-2 0.59486E-15 -15.2256 0.28461E-15 -15.5457 0.47845E+00 -0.3202 Charge balance for all species = -.6036E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7695017E-05 0.8190805E-01 0.8214197E+02 0.0000 2 H2O 0.1000000E+01 0.5544416E+02 0.9938049E+06 0.0000 3 Cl- 0.5813061E-02 0.5841309E-02 0.2060473E+03 2.8749 4 SO4-- 0.4565738E-02 0.4588766E-02 0.4385808E+03 7.7364 5 HCO3- 0.5657913E-02 0.6974329E-01 0.4234075E+04 2.8640 6 HS- 0.1088833E-02 0.1887499E-01 0.6210850E+03 2.1476 7 Al+++ 0.1162740E-12 0.3494339E-08 0.9380695E-04 1.9447 8 H4SiO4 0.1021610E-02 0.1021838E-02 0.9771892E+02 -2.9907 9 Ca++ 0.1621329E-06 0.2280525E-06 0.9093786E-02 3.2828 10 Mg++ 0.8467130E-10 0.9171406E-10 0.2218505E-05 -0.0019 11 Fe++ 0.2398254E-13 0.2436922E-13 0.1354083E-08 -3.5491 12 K+ 0.1496742E-03 0.1547827E-03 0.6021783E+01 1.2866 13 Na+ 0.2192503E-01 0.2195456E-01 0.5021851E+03 3.4514 14 Mn++ 0.1870227E-08 0.2468049E-08 0.1349058E-03 1.3433 15 F- 0.3664287E-03 0.3806552E-03 0.7195211E+01 1.6734 16 HPO4-- 0.6557219E-09 0.4568885E-07 0.4363051E-02 0.8937 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7472638E-01 0.7473592E-01 -.9536179E-05 0.0000000E+00 2 H2O 0.5056686E+02 0.5058929E+02 -.2243658E-01 0.0000000E+00 3 Cl- 0.5329825E-02 0.5329825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4186967E-02 0.4186959E-02 0.8148062E-08 0.0000000E+00 5 HCO3- 0.6363635E-01 0.6363635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.1722229E-01 0.1722224E-01 0.5703643E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3188364E-08 0.4772164E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9323622E-03 0.1122066E-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 0.2223537E-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- 0.3520960E-03 0.3473238E-03 0.4772164E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.917063E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.8799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5798E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6740 -0.171 99.93 0.2545 topaz 0.2386E-05 -5.622 0.4391E-03 -3.357 0.6511E-01 0.1229E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674437 g Volume = 0.254653 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: 0.8799900 moles log = -0.0555 Original solution: 1000.0103000 g Original solution / Rock added: 1136.39 (Water/Rock Ratio), log = 3.0555 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 8.4410 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1258E+00 0.9459 0.1004E+01 0.1062E+01 CO2,gas 0.8155E+00 0.9772 0.6727E+01 0.6884E+01 CH4,gas 0.3159E-06 1.0089 0.2690E-05 0.2666E-05 H2,gas 0.9375E-06 1.0045 0.7949E-05 0.7914E-05 H2S,gas 0.5870E-01 0.9679 0.4796E+00 0.4955E+00 S2,gas 0.1618E-10 1.0000 0.1366E-09 0.1366E-09 CO,gas 0.1691E-08 1.0000 0.1427E-07 0.1427E-07 SO3,gas 0.3949E-29 1.0000 0.3333E-28 0.3333E-28 SO2,gas 0.1223E-11 1.0000 0.1032E-10 0.1032E-10 HF,gas 0.3772E-08 1.0000 0.3184E-07 0.3184E-07 HCl,gas 0.1154E-11 1.0000 0.9743E-11 0.9743E-11 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 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+00 214 topaz -16.55 -16.55 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 0.28976E+04 0.002 2 CO2,gas -6.66 -7.53 -0.87 -0.290 0.14875E+04 0.828 3 CH4,gas 4.54 -2.73 -7.27 -1.817 0.12412E+05 -5.570 4 H2,gas 8.00 1.20 -6.80 -3.885 0.11608E+05 -5.100 5 H2S,gas -6.23 -8.25 -2.02 -1.009 0.34459E+04 -0.319 6 S2,gas -7.34 -18.90 -11.56 -1.779 0.19744E+05 -9.865 7 CO,gas 3.21 -6.33 -9.54 -2.937 0.16297E+05 -7.846 8 SO3,gas 17.12 -13.05 -30.18 -7.544 0.51525E+05 -28.477 9 SO2,gas 0.83 -11.85 -12.69 -3.383 0.21660E+05 -10.986 10 HF,gas 0.47 -8.72 -9.20 -4.598 0.15702E+05 -7.497 11 HCl,gas 5.19 -7.52 -12.71 -6.355 0.21702E+05 -11.011 16 albite-high 0.69 -3.57 -4.27 -0.328 0.72850E+04 17 albite -0.38 -3.57 -3.19 -0.245 0.54462E+04 21 analcite 3.32 -0.58 -3.91 -0.434 0.66703E+04 22 andalusite 5.00 0.90 -4.10 -0.410 0.70064E+04 25 anhydrite -5.32 -9.77 -4.46 -2.228 0.76082E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 3.89 -4.50 -0.409 0.76760E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.94 -0.93 -0.155 0.15883E+04 69 diamond -3.10 -5.13 -2.03 -0.579 0.34583E+04 86 gibbsite 4.08 1.94 -2.14 -0.305 0.36480E+04 89 graphite -3.55 -5.13 -1.58 -0.452 0.27005E+04 98 jadeite 4.22 -0.58 -4.80 -0.480 0.81947E+04 101 kaolinite -1.33 -2.09 -0.76 -0.069 0.12974E+04 102 kyanite 4.88 0.90 -3.98 -0.398 0.67923E+04 119 microcline -2.49 -5.74 -3.25 -0.250 0.55523E+04 123 muscovite 2.58 -1.85 -4.43 -0.261 0.75705E+04 124 paragonite 4.24 0.31 -3.93 -0.231 0.67035E+04 149 pyrophyllite -6.18 -8.07 -1.90 -0.118 0.32357E+04 156 sanidine -1.28 -5.74 -4.46 -0.343 0.76200E+04 159 sillimanite 5.26 0.90 -4.36 -0.436 0.74504E+04 172 sulfur -9.15 -9.45 -0.30 -0.091 0.50736E+03 180 topaz-H 4.62 0.90 -3.72 -0.338 0.63535E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -5.90 -4.26 -0.263 0.72665E+04 197 beidellite-H -2.33 -6.44 -4.12 -0.263 0.70292E+04 198 beidellite-K -1.52 -6.02 -4.50 -0.275 0.76805E+04 199 beidellite-Mg -1.79 -6.44 -4.65 -0.288 0.79457E+04 200 beidellite-Na -1.34 -5.30 -3.96 -0.243 0.67646E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.14 -3.82 -0.477 0.65207E+04 218 gypsum -4.96 -9.77 -4.82 -1.205 0.82280E+04 237 boehmite 4.41 1.94 -2.46 -0.410 0.42053E+04 240 fluorite -9.93 -14.16 -4.23 -1.411 0.72252E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -2.62 -4.64 -0.357 0.79199E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 0.8799900 MOLES New total amount of reactant added: 0.9199900 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 = 0.9199900 Water: Moles liquid = 0.5068E+02 kg liquid = 0.9131E+00 Moles total = 0.5060E+02 kg total = 0.9116E+00 Activity = 0.9984 Stoichiometric ionic strength = .7025808E-01 Osmotic coef. = 0.8762 True ionic strength = .2683595E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5566E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.90655E-05 -5.0426 0.74643E-05 -5.1270 0.82337E+00 -0.0844 2 H2O 0.99844E+00 -0.0007 0.99844E+00 -0.0007 3 Cl- 0.60662E-02 -2.2171 0.49571E-02 -2.3048 0.81717E+00 -0.0877 4 SO4-- 0.47675E-02 -2.3217 0.22824E-02 -2.6416 0.47873E+00 -0.3199 5 HCO3- 0.50814E-02 -2.2940 0.41600E-02 -2.3809 0.81867E+00 -0.0869 6 HS- 0.97437E-03 -3.0113 0.79637E-03 -3.0989 0.81732E+00 -0.0876 7 Al+++ 0.15597E-12 -12.8070 0.29951E-13 -13.5236 0.19203E+00 -0.7166 8 H4SiO4 0.10214E-02 -2.9908 0.10214E-02 -2.9908 0.10000E+01 0.0000 9 Ca++ 0.16130E-06 -6.7924 0.76507E-07 -7.1163 0.47431E+00 -0.3239 10 Mg++ 0.85142E-10 -10.0699 0.40152E-10 -10.3963 0.47159E+00 -0.3264 11 Fe++ 0.27761E-13 -13.5566 0.13110E-13 -13.8824 0.47224E+00 -0.3258 12 K+ 0.14936E-03 -3.8258 0.12231E-03 -3.9125 0.81891E+00 -0.0868 13 Na+ 0.21908E-01 -1.6594 0.17898E-01 -1.7472 0.81697E+00 -0.0878 14 Mn++ 0.18511E-08 -8.7326 0.87506E-09 -9.0580 0.47273E+00 -0.3254 15 F- 0.38074E-03 -3.4194 0.31033E-03 -3.5082 0.81508E+00 -0.0888 16 HPO4-- 0.55833E-09 -9.2531 0.26734E-09 -9.5729 0.47882E+00 -0.3198 17 SiF6-2 0.18960E-19 -19.7222 0.90527E-20 -20.0432 0.47746E+00 -0.3211 18 HSiO3- 0.15661E-06 -6.8052 0.12798E-06 -6.8929 0.81717E+00 -0.0877 19 Ca(HSiO3)+ 0.27221E-12 -12.5651 0.22298E-12 -12.6517 0.81913E+00 -0.0866 20 Mg(HSiO3)+ 0.17779E-15 -15.7501 0.14564E-15 -15.8367 0.81913E+00 -0.0866 21 NaHSiO3,aq 0.37047E-07 -7.4313 0.37047E-07 -7.4313 0.10000E+01 0.0000 22 AlO+ 0.89143E-10 -10.0499 0.73019E-10 -10.1366 0.81913E+00 -0.0866 23 AlOH+2 0.57340E-11 -11.2415 0.27139E-11 -11.5664 0.47331E+00 -0.3249 24 HAlO2,aq 0.19451E-08 -8.7110 0.19451E-08 -8.7110 0.10000E+01 0.0000 25 AlO2- 0.70750E-09 -9.1503 0.57685E-09 -9.2389 0.81533E+00 -0.0887 26 CH4,aq 0.14359E-08 -8.8429 0.14078E-08 -8.8515 0.98042E+00 -0.0086 27 C2H6,aq 0.61773E-19 -19.2092 0.60563E-19 -19.2178 0.98042E+00 -0.0086 31 CO,aq 0.93533E-11 -11.0290 0.93533E-11 -11.0290 0.10000E+01 0.0000 32 CO2,aq 0.67779E-01 -1.1689 0.66453E-01 -1.1775 0.98042E+00 -0.0086 33 CO3-2 0.10196E-06 -6.9916 0.48680E-07 -7.3127 0.47746E+00 -0.3211 34 CaCO3,aq 0.46699E-10 -10.3307 0.46699E-10 -10.3307 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.99180E-08 -8.0036 0.81241E-08 -8.0902 0.81913E+00 -0.0866 36 CaCl+ 0.74927E-09 -9.1254 0.61375E-09 -9.2120 0.81913E+00 -0.0866 37 CaCl2,aq 0.72282E-12 -12.1410 0.72282E-12 -12.1410 0.10000E+01 0.0000 38 CaF+ 0.42319E-09 -9.3735 0.34665E-09 -9.4601 0.81913E+00 -0.0866 39 CaOH+ 0.89041E-12 -12.0504 0.72936E-12 -12.1371 0.81913E+00 -0.0866 40 CaSO4,aq 0.55449E-07 -7.2561 0.55449E-07 -7.2561 0.10000E+01 0.0000 41 HCl,aq 0.67803E-08 -8.1687 0.67803E-08 -8.1687 0.10000E+01 0.0000 45 HF,aq 0.15858E-04 -4.7998 0.15858E-04 -4.7998 0.10000E+01 0.0000 46 HF2- 0.20332E-08 -8.6918 0.16615E-08 -8.7795 0.81717E+00 -0.0877 48 FeCl+ 0.12558E-15 -15.9011 0.10286E-15 -15.9877 0.81913E+00 -0.0866 51 FeF+ 0.25381E-15 -15.5955 0.20790E-15 -15.6821 0.81913E+00 -0.0866 54 FeOH+ 0.69686E-16 -16.1569 0.57082E-16 -16.2435 0.81913E+00 -0.0866 60 H2,aq 0.57060E-08 -8.2437 0.55943E-08 -8.2523 0.98042E+00 -0.0086 61 KCl,aq 0.10989E-07 -7.9590 0.10989E-07 -7.9590 0.10000E+01 0.0000 62 KHSO4,aq 0.58915E-11 -11.2298 0.58915E-11 -11.2298 0.10000E+01 0.0000 63 KOH,aq 0.69870E-11 -11.1557 0.69870E-11 -11.1557 0.10000E+01 0.0000 64 KSO4- 0.53011E-05 -5.2756 0.43319E-05 -5.3633 0.81717E+00 -0.0877 65 MgCO3,aq 0.61432E-14 -14.2116 0.61432E-14 -14.2116 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.53187E-11 -11.2742 0.43567E-11 -11.3608 0.81913E+00 -0.0866 67 MgCl+ 0.35640E-12 -12.4481 0.29194E-12 -12.5347 0.81913E+00 -0.0866 68 MgF+ 0.82271E-12 -12.0848 0.67391E-12 -12.1714 0.81913E+00 -0.0866 69 MgOH+ 0.25858E-14 -14.5874 0.21181E-14 -14.6741 0.81913E+00 -0.0866 71 MnF+ 0.55841E-11 -11.2530 0.45741E-11 -11.3397 0.81913E+00 -0.0866 72 MnO,aq 0.16240E-16 -16.7894 0.16240E-16 -16.7894 0.10000E+01 0.0000 73 MnOH+ 0.43210E-12 -12.3644 0.35395E-12 -12.4511 0.81913E+00 -0.0866 78 MnCl+ 0.32610E-10 -10.4867 0.26712E-10 -10.5733 0.81913E+00 -0.0866 79 MnSO4,aq 0.57658E-09 -9.2391 0.57658E-09 -9.2391 0.10000E+01 0.0000 80 NaCl,aq 0.29403E-04 -4.5316 0.29403E-04 -4.5316 0.10000E+01 0.0000 81 NaF,aq 0.13004E-05 -5.8859 0.13004E-05 -5.8859 0.10000E+01 0.0000 82 NaOH,aq 0.10286E-08 -8.9877 0.10286E-08 -8.9877 0.10000E+01 0.0000 84 OH- 0.94789E-07 -7.0232 0.77285E-07 -7.1119 0.81533E+00 -0.0887 91 H2PO3- 0.85502E-19 -19.0680 0.69870E-19 -19.1557 0.81717E+00 -0.0877 92 H3PO4,aq 0.10417E-09 -9.9822 0.10417E-09 -9.9822 0.10000E+01 0.0000 93 H2PO4- 0.44994E-07 -7.3468 0.36811E-07 -7.4340 0.81814E+00 -0.0872 94 PO4-3 0.14309E-15 -15.8444 0.29222E-16 -16.5343 0.20422E+00 -0.6899 96 H3P2O7- 0.29994E-18 -18.5230 0.24511E-18 -18.6106 0.81717E+00 -0.0877 97 H2P2O7-2 0.22288E-15 -15.6519 0.10642E-15 -15.9730 0.47746E+00 -0.3211 98 HP2O7-3 0.14804E-16 -16.8296 0.28468E-17 -17.5456 0.19230E+00 -0.7160 100 H2S,aq 0.18738E-01 -1.7273 0.18372E-01 -1.7359 0.98042E+00 -0.0086 101 S2-2 0.52612E-08 -8.2789 0.25120E-08 -8.6000 0.47746E+00 -0.3211 102 S3-2 0.23278E-07 -7.6331 0.11114E-07 -7.9541 0.47746E+00 -0.3211 103 S3- 0.90983E-06 -6.0410 0.74349E-06 -6.1287 0.81717E+00 -0.0877 104 S4-2 0.68033E-07 -7.1673 0.32483E-07 -7.4883 0.47746E+00 -0.3211 105 S5-2 0.13259E-06 -6.8775 0.63305E-07 -7.1986 0.47746E+00 -0.3211 106 SO2,aq 0.31869E-11 -11.4966 0.31869E-11 -11.4966 0.10000E+01 0.0000 107 SO3-2 0.34185E-11 -11.4662 0.16618E-11 -11.7794 0.48612E+00 -0.3133 108 HSO3- 0.95041E-09 -9.0221 0.77665E-09 -9.1098 0.81717E+00 -0.0877 109 HSO4- 0.20019E-04 -4.6986 0.16418E-04 -4.7847 0.82014E+00 -0.0861 111 S2O3-2 0.10332E-05 -5.9858 0.49332E-06 -6.3069 0.47746E+00 -0.3211 112 HS2O3- 0.80571E-09 -9.0938 0.65840E-09 -9.1815 0.81717E+00 -0.0877 113 H2S2O3,aq 0.78785E-13 -13.1036 0.78785E-13 -13.1036 0.10000E+01 0.0000 121 S4O6-2 0.10773E-14 -14.9677 0.51436E-15 -15.2887 0.47746E+00 -0.3211 Charge balance for all species = -.6032E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9065490E-05 0.8656657E-01 0.8679782E+02 0.0000 2 H2O 0.1000000E+01 0.5544047E+02 0.9935559E+06 0.0000 3 Cl- 0.6066183E-02 0.6095605E-02 0.2149778E+03 2.8222 4 SO4-- 0.4767499E-02 0.4794672E-02 0.4581764E+03 7.6124 5 HCO3- 0.5081373E-02 0.7286081E-01 0.4422524E+04 2.7461 6 HS- 0.9743664E-03 0.1971686E-01 0.6486676E+03 2.0281 7 Al+++ 0.1559685E-12 0.2747668E-08 0.7374869E-04 1.8575 8 H4SiO4 0.1021439E-02 0.1021632E-02 0.9768132E+02 -2.9908 9 Ca++ 0.1613018E-06 0.2278898E-06 0.9085626E-02 3.1377 10 Mg++ 0.8514194E-10 0.9164862E-10 0.2216514E-05 -0.1423 11 Fe++ 0.2776100E-13 0.2821009E-13 0.1567214E-08 -3.6284 12 K+ 0.1493601E-03 0.1546722E-03 0.6016380E+01 1.2145 13 Na+ 0.2190816E-01 0.2193890E-01 0.5017344E+03 3.3798 14 Mn++ 0.1851084E-08 0.2466288E-08 0.1347847E-03 1.1961 15 F- 0.3807434E-03 0.3979058E-03 0.7519901E+01 1.6188 16 HPO4-- 0.5583291E-09 0.4565625E-07 0.4359136E-02 0.6811 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7903338E-01 0.7904292E-01 -.9537538E-05 0.0000000E+00 2 H2O 0.5059960E+02 0.5062204E+02 -.2243562E-01 0.0000000E+00 3 Cl- 0.5565825E-02 0.5565825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4377967E-02 0.4377959E-02 0.8148061E-08 0.0000000E+00 5 HCO3- 0.6652835E-01 0.6652835E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.1800329E-01 0.1800324E-01 0.5703643E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2508864E-08 0.4772843E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9328405E-03 0.1122018E-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 0.2575830E-13 0.3259224E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3680960E-03 0.3633232E-03 0.4772843E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.917886E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.9199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5798E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6740 -0.171 99.93 0.2545 topaz 0.2386E-05 -5.622 0.4392E-03 -3.357 0.6512E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674408 g Volume = 0.254642 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: 0.9199900 moles log = -0.0362 Original solution: 1000.0103000 g Original solution / Rock added: 1086.98 (Water/Rock Ratio), log = 3.0362 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 8.8717 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1199E+00 0.9441 0.1004E+01 0.1064E+01 CO2,gas 0.8212E+00 0.9759 0.7110E+01 0.7285E+01 CH4,gas 0.2315E-06 1.0091 0.2072E-05 0.2053E-05 H2,gas 0.8240E-06 1.0047 0.7345E-05 0.7310E-05 H2S,gas 0.5891E-01 0.9663 0.5050E+00 0.5227E+00 S2,gas 0.2000E-10 1.0000 0.1775E-09 0.1775E-09 CO,gas 0.1571E-08 1.0000 0.1394E-07 0.1394E-07 SO3,gas 0.5428E-29 1.0000 0.4816E-28 0.4816E-28 SO2,gas 0.1553E-11 1.0000 0.1378E-10 0.1378E-10 HF,gas 0.4389E-08 1.0000 0.3894E-07 0.3894E-07 HCl,gas 0.1349E-11 1.0000 0.1196E-10 0.1196E-10 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 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+00 214 topaz -16.55 -16.55 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 0.28977E+04 0.002 2 CO2,gas -6.66 -7.51 -0.85 -0.282 0.14464E+04 0.852 3 CH4,gas 4.54 -2.84 -7.38 -1.846 0.12605E+05 -5.684 4 H2,gas 8.00 1.17 -6.83 -3.905 0.11667E+05 -5.134 5 H2S,gas -6.23 -8.23 -2.00 -0.998 0.34075E+04 -0.297 6 S2,gas -7.34 -18.79 -11.45 -1.762 0.19550E+05 -9.751 7 CO,gas 3.21 -6.34 -9.55 -2.940 0.16314E+05 -7.856 8 SO3,gas 17.12 -12.89 -30.02 -7.504 0.51252E+05 -28.317 9 SO2,gas 0.83 -11.73 -12.56 -3.349 0.21445E+05 -10.861 10 HF,gas 0.47 -8.64 -9.11 -4.554 0.15553E+05 -7.410 11 HCl,gas 5.19 -7.43 -12.62 -6.311 0.21550E+05 -10.922 16 albite-high 0.69 -3.73 -4.43 -0.340 0.75563E+04 17 albite -0.38 -3.73 -3.35 -0.258 0.57175E+04 21 analcite 3.32 -0.74 -4.07 -0.452 0.69417E+04 22 andalusite 5.00 0.72 -4.28 -0.428 0.73047E+04 25 anhydrite -5.32 -9.76 -4.44 -2.221 0.75831E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 3.71 -4.67 -0.425 0.79743E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.86 -1.02 -0.170 0.17375E+04 69 diamond -3.10 -5.17 -2.07 -0.591 0.35344E+04 86 gibbsite 4.08 1.86 -2.22 -0.318 0.37972E+04 89 graphite -3.55 -5.17 -1.63 -0.465 0.27767E+04 98 jadeite 4.22 -0.74 -4.96 -0.496 0.84660E+04 101 kaolinite -1.33 -2.27 -0.93 -0.085 0.15958E+04 102 kyanite 4.88 0.72 -4.15 -0.415 0.70906E+04 119 microcline -2.49 -5.90 -3.41 -0.262 0.58246E+04 123 muscovite 2.58 -2.19 -4.77 -0.280 0.81412E+04 124 paragonite 4.24 -0.02 -4.26 -0.251 0.72732E+04 149 pyrophyllite -6.18 -8.25 -2.07 -0.129 0.35340E+04 156 sanidine -1.28 -5.90 -4.62 -0.356 0.78923E+04 159 sillimanite 5.26 0.72 -4.54 -0.454 0.77487E+04 172 sulfur -9.15 -9.39 -0.24 -0.074 0.41034E+03 180 topaz-H 4.62 0.72 -3.90 -0.354 0.66518E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -6.13 -4.48 -0.277 0.76549E+04 197 beidellite-H -2.33 -6.65 -4.32 -0.276 0.73768E+04 198 beidellite-K -1.52 -6.25 -4.73 -0.289 0.80687E+04 199 beidellite-Mg -1.79 -6.67 -4.88 -0.302 0.83328E+04 200 beidellite-Na -1.34 -5.53 -4.19 -0.257 0.71525E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.27 -3.95 -0.494 0.67510E+04 218 gypsum -4.96 -9.76 -4.80 -1.201 0.82030E+04 237 boehmite 4.41 1.86 -2.55 -0.425 0.43544E+04 240 fluorite -9.93 -14.13 -4.20 -1.401 0.71747E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 247 an20ab80 2.02 -2.81 -4.83 -0.371 0.82462E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 0.9199900 MOLES New total amount of reactant added: 0.9599900 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 = 0.9599900 Water: Moles liquid = 0.5072E+02 kg liquid = 0.9137E+00 Moles total = 0.5063E+02 kg total = 0.9122E+00 Activity = 0.9984 Stoichiometric ionic strength = .7278179E-01 Osmotic coef. = 0.8750 True ionic strength = .2702103E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5802E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.10782E-04 -4.9673 0.88729E-05 -5.0519 0.82293E+00 -0.0846 2 H2O 0.99836E+00 -0.0007 0.99836E+00 -0.0007 3 Cl- 0.63189E-02 -2.1994 0.51607E-02 -2.2873 0.81670E+00 -0.0879 4 SO4-- 0.49679E-02 -2.3038 0.23735E-02 -2.6246 0.47776E+00 -0.3208 5 HCO3- 0.45065E-02 -2.3462 0.36873E-02 -2.4333 0.81821E+00 -0.0871 6 HS- 0.86131E-03 -3.0648 0.70356E-03 -3.1527 0.81685E+00 -0.0879 7 Al+++ 0.21395E-12 -12.6697 0.40897E-13 -13.3883 0.19115E+00 -0.7186 8 H4SiO4 0.10213E-02 -2.9909 0.10213E-02 -2.9909 0.10000E+01 0.0000 9 Ca++ 0.16049E-06 -6.7945 0.75965E-07 -7.1194 0.47332E+00 -0.3248 10 Mg++ 0.85616E-10 -10.0674 0.40290E-10 -10.3948 0.47059E+00 -0.3274 11 Fe++ 0.32769E-13 -13.4845 0.15442E-13 -13.8113 0.47124E+00 -0.3268 12 K+ 0.14905E-03 -3.8267 0.12199E-03 -3.9137 0.81845E+00 -0.0870 13 Na+ 0.21891E-01 -1.6597 0.17874E-01 -1.7478 0.81650E+00 -0.0880 14 Mn++ 0.18326E-08 -8.7369 0.86448E-09 -9.0632 0.47173E+00 -0.3263 15 F- 0.39427E-03 -3.4042 0.32117E-03 -3.4933 0.81460E+00 -0.0891 16 HPO4-- 0.47075E-09 -9.3272 0.22495E-09 -9.6479 0.47785E+00 -0.3207 17 SiF6-2 0.46621E-19 -19.3314 0.22214E-19 -19.6534 0.47648E+00 -0.3220 18 HSiO3- 0.13181E-06 -6.8801 0.10765E-06 -6.9680 0.81670E+00 -0.0879 19 Ca(HSiO3)+ 0.22749E-12 -12.6430 0.18623E-12 -12.7299 0.81867E+00 -0.0869 20 Mg(HSiO3)+ 0.15015E-15 -15.8235 0.12293E-15 -15.9104 0.81867E+00 -0.0869 21 NaHSiO3,aq 0.31121E-07 -7.5070 0.31121E-07 -7.5070 0.10000E+01 0.0000 22 AlO+ 0.86183E-10 -10.0646 0.70555E-10 -10.1515 0.81867E+00 -0.0869 23 AlOH+2 0.65999E-11 -11.1805 0.31172E-11 -11.5062 0.47231E+00 -0.3258 24 HAlO2,aq 0.15810E-08 -8.8011 0.15810E-08 -8.8011 0.10000E+01 0.0000 25 AlO2- 0.48403E-09 -9.3151 0.39442E-09 -9.4040 0.81485E+00 -0.0889 26 CH4,aq 0.10819E-08 -8.9658 0.10600E-08 -8.9747 0.97980E+00 -0.0089 27 C2H6,aq 0.38117E-19 -19.4189 0.37347E-19 -19.4277 0.97980E+00 -0.0089 31 CO,aq 0.90620E-11 -11.0428 0.90620E-11 -11.0428 0.10000E+01 0.0000 32 CO2,aq 0.71467E-01 -1.1459 0.70023E-01 -1.1548 0.97980E+00 -0.0089 33 CO3-2 0.76179E-07 -7.1182 0.36298E-07 -7.4401 0.47648E+00 -0.3220 34 CaCO3,aq 0.34575E-10 -10.4612 0.34575E-10 -10.4612 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.87337E-08 -8.0588 0.71500E-08 -8.1457 0.81867E+00 -0.0869 36 CaCl+ 0.77495E-09 -9.1107 0.63443E-09 -9.1976 0.81867E+00 -0.0869 37 CaCl2,aq 0.77786E-12 -12.1091 0.77786E-12 -12.1091 0.10000E+01 0.0000 38 CaF+ 0.43511E-09 -9.3614 0.35621E-09 -9.4483 0.81867E+00 -0.0869 39 CaOH+ 0.74410E-12 -12.1284 0.60917E-12 -12.2153 0.81867E+00 -0.0869 40 CaSO4,aq 0.57254E-07 -7.2422 0.57254E-07 -7.2422 0.10000E+01 0.0000 41 HCl,aq 0.83909E-08 -8.0762 0.83909E-08 -8.0762 0.10000E+01 0.0000 45 HF,aq 0.19509E-04 -4.7098 0.19509E-04 -4.7098 0.10000E+01 0.0000 46 HF2- 0.25902E-08 -8.5867 0.21154E-08 -8.6746 0.81670E+00 -0.0879 48 FeCl+ 0.15408E-15 -15.8123 0.12614E-15 -15.8991 0.81867E+00 -0.0869 51 FeF+ 0.30958E-15 -15.5092 0.25345E-15 -15.5961 0.81867E+00 -0.0869 54 FeOH+ 0.69086E-16 -16.1606 0.56558E-16 -16.2475 0.81867E+00 -0.0869 60 H2,aq 0.52492E-08 -8.2799 0.51432E-08 -8.2888 0.97980E+00 -0.0089 61 KCl,aq 0.11410E-07 -7.9427 0.11410E-07 -7.9427 0.10000E+01 0.0000 62 KHSO4,aq 0.72636E-11 -11.1388 0.72636E-11 -11.1388 0.10000E+01 0.0000 63 KOH,aq 0.58617E-11 -11.2320 0.58617E-11 -11.2320 0.10000E+01 0.0000 64 KSO4- 0.55013E-05 -5.2595 0.44929E-05 -5.3475 0.81670E+00 -0.0879 65 MgCO3,aq 0.45964E-14 -14.3376 0.45964E-14 -14.3376 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.47332E-11 -11.3248 0.38749E-11 -11.4117 0.81867E+00 -0.0869 67 MgCl+ 0.37252E-12 -12.4288 0.30497E-12 -12.5157 0.81867E+00 -0.0869 68 MgF+ 0.85486E-12 -12.0681 0.69984E-12 -12.1550 0.81867E+00 -0.0869 69 MgOH+ 0.21838E-14 -14.6608 0.17878E-14 -14.7477 0.81867E+00 -0.0869 71 MnF+ 0.57124E-11 -11.2432 0.46766E-11 -11.3301 0.81867E+00 -0.0869 72 MnO,aq 0.11353E-16 -16.9449 0.11353E-16 -16.9449 0.10000E+01 0.0000 73 MnOH+ 0.35928E-12 -12.4446 0.29413E-12 -12.5315 0.81867E+00 -0.0869 78 MnCl+ 0.33558E-10 -10.4742 0.27473E-10 -10.5611 0.81867E+00 -0.0869 79 MnSO4,aq 0.59234E-09 -9.2274 0.59234E-09 -9.2274 0.10000E+01 0.0000 80 NaCl,aq 0.30570E-04 -4.5147 0.30570E-04 -4.5147 0.10000E+01 0.0000 81 NaF,aq 0.13440E-05 -5.8716 0.13440E-05 -5.8716 0.10000E+01 0.0000 82 NaOH,aq 0.86410E-09 -9.0634 0.86410E-09 -9.0634 0.10000E+01 0.0000 84 OH- 0.79781E-07 -7.0981 0.65010E-07 -7.1870 0.81485E+00 -0.0889 91 H2PO3- 0.78677E-19 -19.1042 0.64256E-19 -19.1921 0.81670E+00 -0.0879 92 H3PO4,aq 0.12386E-09 -9.9071 0.12386E-09 -9.9071 0.10000E+01 0.0000 93 H2PO4- 0.45029E-07 -7.3465 0.36819E-07 -7.4339 0.81768E+00 -0.0874 94 PO4-3 0.10172E-15 -15.9926 0.20684E-16 -16.6844 0.20336E+00 -0.6917 96 H3P2O7- 0.35694E-18 -18.4474 0.29151E-18 -18.5353 0.81670E+00 -0.0879 97 H2P2O7-2 0.22345E-15 -15.6508 0.10647E-15 -15.9728 0.47648E+00 -0.3220 98 HP2O7-3 0.12517E-16 -16.9025 0.23961E-17 -17.6205 0.19142E+00 -0.7180 100 H2S,aq 0.19692E-01 -1.7057 0.19294E-01 -1.7146 0.97980E+00 -0.0089 101 S2-2 0.44757E-08 -8.3491 0.21326E-08 -8.6711 0.47648E+00 -0.3220 102 S3-2 0.22620E-07 -7.6455 0.10778E-07 -7.9675 0.47648E+00 -0.3220 103 S3- 0.10945E-05 -5.9608 0.89386E-06 -6.0487 0.81670E+00 -0.0879 104 S4-2 0.75517E-07 -7.1220 0.35983E-07 -7.4439 0.47648E+00 -0.3220 105 S5-2 0.16811E-06 -6.7744 0.80103E-07 -7.0964 0.47648E+00 -0.3220 106 SO2,aq 0.43062E-11 -11.3659 0.43062E-11 -11.3659 0.10000E+01 0.0000 107 SO3-2 0.32750E-11 -11.4848 0.15889E-11 -11.7989 0.48517E+00 -0.3141 108 HSO3- 0.10809E-08 -8.9662 0.88274E-09 -9.0542 0.81670E+00 -0.0879 109 HSO4- 0.24760E-04 -4.6062 0.20295E-04 -4.6926 0.81968E+00 -0.0864 111 S2O3-2 0.11308E-05 -5.9466 0.53881E-06 -6.2686 0.47648E+00 -0.3220 112 HS2O3- 0.10467E-08 -8.9802 0.85481E-09 -9.0681 0.81670E+00 -0.0879 113 H2S2O3,aq 0.12159E-12 -12.9151 0.12159E-12 -12.9151 0.10000E+01 0.0000 121 S4O6-2 0.19792E-14 -14.7035 0.94306E-15 -15.0255 0.47648E+00 -0.3220 Charge balance for all species = -.6028E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1078211E-04 0.9121845E-01 0.9144533E+02 0.0000 2 H2O 0.1000000E+01 0.5543678E+02 0.9933073E+06 0.0000 3 Cl- 0.6318948E-02 0.6349538E-02 0.2238924E+03 2.7646 4 SO4-- 0.4967914E-02 0.5000285E-02 0.4777368E+03 7.4793 5 HCO3- 0.4506547E-02 0.7597387E-01 0.4610634E+04 2.6186 6 HS- 0.8613110E-03 0.2055754E-01 0.6762008E+03 1.8992 7 Al+++ 0.2139498E-12 0.2158007E-08 0.5791126E-04 1.7675 8 H4SiO4 0.1021268E-02 0.1021431E-02 0.9764414E+02 -2.9909 9 Ca++ 0.1604935E-06 0.2277273E-06 0.9077480E-02 2.9845 10 Mg++ 0.8561577E-10 0.9158328E-10 0.2214527E-05 -0.2909 11 Fe++ 0.3276928E-13 0.3330205E-13 0.1849758E-08 -3.7074 12 K+ 0.1490492E-03 0.1545620E-03 0.6010986E+01 1.1383 13 Na+ 0.2189131E-01 0.2192326E-01 0.5012846E+03 3.3042 14 Mn++ 0.1832557E-08 0.2464530E-08 0.1346639E-03 1.0406 15 F- 0.3942739E-03 0.4151320E-03 0.7844012E+01 1.5587 16 HPO4-- 0.4707486E-09 0.4562370E-07 0.4355228E-02 0.4559 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.8334038E-01 0.8334992E-01 -.9538612E-05 0.0000000E+00 2 H2O 0.5063235E+02 0.5065479E+02 -.2243465E-01 0.0000000E+00 3 Cl- 0.5801825E-02 0.5801825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4568967E-02 0.4568959E-02 0.8148060E-08 0.0000000E+00 5 HCO3- 0.6942035E-01 0.6942035E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.1878429E-01 0.1878424E-01 0.5703642E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1971857E-08 0.4773380E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9333222E-03 0.1121970E-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 0.3042941E-13 0.3259224E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.3840960E-03 0.3793226E-03 0.4773380E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.918710E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.9599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5799E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6739 -0.171 99.93 0.2545 topaz 0.2387E-05 -5.622 0.4393E-03 -3.357 0.6513E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674379 g Volume = 0.254631 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: 0.9599900 moles log = -0.0177 Original solution: 1000.0103000 g Original solution / Rock added: 1041.69 (Water/Rock Ratio), log = 3.0177 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 9.3023 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1146E+00 0.9422 0.1004E+01 0.1066E+01 CO2,gas 0.8263E+00 0.9747 0.7492E+01 0.7687E+01 CH4,gas 0.1662E-06 1.0094 0.1560E-05 0.1546E-05 H2,gas 0.7223E-06 1.0050 0.6752E-05 0.6719E-05 H2S,gas 0.5910E-01 0.9647 0.5304E+00 0.5498E+00 S2,gas 0.2489E-10 1.0000 0.2316E-09 0.2316E-09 CO,gas 0.1452E-08 1.0000 0.1350E-07 0.1350E-07 SO3,gas 0.7608E-29 1.0000 0.7077E-28 0.7077E-28 SO2,gas 0.2002E-11 1.0000 0.1862E-10 0.1862E-10 HF,gas 0.5149E-08 1.0000 0.4790E-07 0.4790E-07 HCl,gas 0.1592E-11 1.0000 0.1481E-10 0.1481E-10 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 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+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 0.28978E+04 0.002 2 CO2,gas -6.66 -7.48 -0.82 -0.275 0.14076E+04 0.875 3 CH4,gas 4.54 -2.96 -7.51 -1.876 0.12816E+05 -5.807 4 H2,gas 8.00 1.13 -6.87 -3.925 0.11730E+05 -5.171 5 H2S,gas -6.23 -8.20 -1.97 -0.987 0.33712E+04 -0.275 6 S2,gas -7.34 -18.67 -11.33 -1.744 0.19353E+05 -9.635 7 CO,gas 3.21 -6.35 -9.57 -2.944 0.16338E+05 -7.870 8 SO3,gas 17.12 -12.73 -29.85 -7.462 0.50967E+05 -28.150 9 SO2,gas 0.83 -11.60 -12.43 -3.314 0.21222E+05 -10.730 10 HF,gas 0.47 -8.55 -9.02 -4.509 0.15399E+05 -7.320 11 HCl,gas 5.19 -7.34 -12.53 -6.264 0.21392E+05 -10.830 16 albite-high 0.69 -3.90 -4.59 -0.353 0.78392E+04 17 albite -0.38 -3.90 -3.51 -0.270 0.60004E+04 21 analcite 3.32 -0.91 -4.23 -0.470 0.72247E+04 22 andalusite 5.00 0.54 -4.46 -0.446 0.76121E+04 25 anhydrite -5.32 -9.74 -4.43 -2.214 0.75593E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 62 corundum 8.38 3.53 -4.85 -0.441 0.82817E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.77 -1.11 -0.185 0.18912E+04 69 diamond -3.10 -5.22 -2.12 -0.606 0.36202E+04 86 gibbsite 4.08 1.77 -2.31 -0.331 0.39510E+04 89 graphite -3.55 -5.22 -1.68 -0.479 0.28624E+04 101 kaolinite -1.33 -2.45 -1.11 -0.101 0.19033E+04 102 kyanite 4.88 0.54 -4.33 -0.433 0.73980E+04 119 microcline -2.49 -6.06 -3.58 -0.275 0.61085E+04 124 paragonite 4.24 -0.37 -4.61 -0.271 0.78635E+04 149 pyrophyllite -6.18 -8.43 -2.25 -0.141 0.38415E+04 156 sanidine -1.28 -6.06 -4.79 -0.368 0.81762E+04 159 sillimanite 5.26 0.54 -4.72 -0.472 0.80560E+04 172 sulfur -9.15 -9.33 -0.18 -0.056 0.31169E+03 180 topaz-H 4.62 0.54 -4.08 -0.371 0.69593E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -6.36 -4.72 -0.292 0.80562E+04 197 beidellite-H -2.33 -6.86 -4.53 -0.289 0.77349E+04 198 beidellite-K -1.52 -6.48 -4.96 -0.304 0.84698E+04 200 beidellite-Na -1.34 -5.77 -4.42 -0.271 0.75533E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.41 -4.10 -0.512 0.69952E+04 218 gypsum -4.96 -9.75 -4.79 -1.198 0.81793E+04 237 boehmite 4.41 1.77 -2.64 -0.440 0.45082E+04 240 fluorite -9.93 -14.11 -4.18 -1.392 0.71290E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 0.9599900 MOLES New total amount of reactant added: 0.9999900 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 = 0.9999900 Water: Moles liquid = 0.5076E+02 kg liquid = 0.9144E+00 Moles total = 0.5067E+02 kg total = 0.9127E+00 Activity = 0.9983 Stoichiometric ionic strength = .7530225E-01 Osmotic coef. = 0.8738 True ionic strength = .2720488E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6038E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.12991E-04 -4.8863 0.10685E-04 -4.9712 0.82249E+00 -0.0849 2 H2O 0.99828E+00 -0.0007 0.99828E+00 -0.0007 3 Cl- 0.65714E-02 -2.1823 0.53638E-02 -2.2705 0.81624E+00 -0.0882 4 SO4-- 0.51665E-02 -2.2868 0.24634E-02 -2.6085 0.47680E+00 -0.3217 5 HCO3- 0.39343E-02 -2.4051 0.32173E-02 -2.4925 0.81775E+00 -0.0874 6 HS- 0.74969E-03 -3.1251 0.61204E-03 -3.2132 0.81639E+00 -0.0881 7 Al+++ 0.30235E-12 -12.5195 0.57534E-13 -13.2401 0.19029E+00 -0.7206 8 H4SiO4 0.10211E-02 -2.9909 0.10211E-02 -2.9909 0.10000E+01 0.0000 9 Ca++ 0.15971E-06 -6.7967 0.75438E-07 -7.1224 0.47234E+00 -0.3257 10 Mg++ 0.86093E-10 -10.0650 0.40430E-10 -10.3933 0.46961E+00 -0.3283 11 Fe++ 0.39632E-13 -13.4020 0.18637E-13 -13.7296 0.47026E+00 -0.3277 12 K+ 0.14874E-03 -3.8276 0.12167E-03 -3.9148 0.81799E+00 -0.0873 13 Na+ 0.21874E-01 -1.6601 0.17850E-01 -1.7484 0.81604E+00 -0.0883 14 Mn++ 0.18147E-08 -8.7412 0.85426E-09 -9.0684 0.47075E+00 -0.3272 15 F- 0.40672E-03 -3.3907 0.33112E-03 -3.4800 0.81412E+00 -0.0893 16 HPO4-- 0.39166E-09 -9.4071 0.18677E-09 -9.7287 0.47688E+00 -0.3216 17 SiF6-2 0.11800E-18 -18.9281 0.56112E-19 -19.2509 0.47552E+00 -0.3228 18 HSiO3- 0.10951E-06 -6.9606 0.89383E-07 -7.0487 0.81624E+00 -0.0882 19 Ca(HSiO3)+ 0.18768E-12 -12.7266 0.15356E-12 -12.8137 0.81821E+00 -0.0871 20 Mg(HSiO3)+ 0.12518E-15 -15.9025 0.10242E-15 -15.9896 0.81821E+00 -0.0871 21 NaHSiO3,aq 0.25805E-07 -7.5883 0.25805E-07 -7.5883 0.10000E+01 0.0000 22 AlO+ 0.83640E-10 -10.0776 0.68436E-10 -10.1647 0.81821E+00 -0.0871 23 AlOH+2 0.77253E-11 -11.1121 0.36412E-11 -11.4388 0.47134E+00 -0.3267 24 HAlO2,aq 0.12733E-08 -8.8951 0.12733E-08 -8.8951 0.10000E+01 0.0000 25 AlO2- 0.32390E-09 -9.4896 0.26377E-09 -9.5788 0.81438E+00 -0.0892 26 CH4,aq 0.79160E-09 -9.1015 0.77512E-09 -9.1106 0.97918E+00 -0.0091 27 C2H6,aq 0.22331E-19 -19.6511 0.21866E-19 -19.6602 0.97918E+00 -0.0091 31 CO,aq 0.86978E-11 -11.0606 0.86978E-11 -11.0606 0.10000E+01 0.0000 32 CO2,aq 0.75148E-01 -1.1241 0.73583E-01 -1.1332 0.97918E+00 -0.0091 33 CO3-2 0.55307E-07 -7.2572 0.26299E-07 -7.5801 0.47552E+00 -0.3228 34 CaCO3,aq 0.24877E-10 -10.6042 0.24877E-10 -10.6042 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.75717E-08 -8.1208 0.61953E-08 -8.2079 0.81821E+00 -0.0871 36 CaCl+ 0.80031E-09 -9.0967 0.65482E-09 -9.1839 0.81821E+00 -0.0871 37 CaCl2,aq 0.83445E-12 -12.0786 0.83445E-12 -12.0786 0.10000E+01 0.0000 38 CaF+ 0.44573E-09 -9.3509 0.36470E-09 -9.4381 0.81821E+00 -0.0871 39 CaOH+ 0.61389E-12 -12.2119 0.50230E-12 -12.2990 0.81821E+00 -0.0871 40 CaSO4,aq 0.59011E-07 -7.2291 0.59011E-07 -7.2291 0.10000E+01 0.0000 41 HCl,aq 0.10502E-07 -7.9787 0.10502E-07 -7.9787 0.10000E+01 0.0000 45 HF,aq 0.24221E-04 -4.6158 0.24221E-04 -4.6158 0.10000E+01 0.0000 46 HF2- 0.33174E-08 -8.4792 0.27078E-08 -8.5674 0.81624E+00 -0.0882 48 FeCl+ 0.19338E-15 -15.7136 0.15823E-15 -15.8007 0.81821E+00 -0.0871 51 FeF+ 0.38542E-15 -15.4141 0.31536E-15 -15.5012 0.81821E+00 -0.0871 54 FeOH+ 0.69270E-16 -16.1595 0.56677E-16 -16.2466 0.81821E+00 -0.0871 60 H2,aq 0.47972E-08 -8.3190 0.46973E-08 -8.3282 0.97918E+00 -0.0091 61 KCl,aq 0.11828E-07 -7.9271 0.11828E-07 -7.9271 0.10000E+01 0.0000 62 KHSO4,aq 0.90550E-11 -11.0431 0.90550E-11 -11.0431 0.10000E+01 0.0000 63 KOH,aq 0.48543E-11 -11.3139 0.48543E-11 -11.3139 0.10000E+01 0.0000 64 KSO4- 0.56980E-05 -5.2443 0.46509E-05 -5.3325 0.81624E+00 -0.0882 65 MgCO3,aq 0.33418E-14 -14.4760 0.33418E-14 -14.4760 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.41465E-11 -11.3823 0.33927E-11 -11.4695 0.81821E+00 -0.0871 67 MgCl+ 0.38874E-12 -12.4103 0.31807E-12 -12.4975 0.81821E+00 -0.0871 68 MgF+ 0.88488E-12 -12.0531 0.72402E-12 -12.1402 0.81821E+00 -0.0871 69 MgOH+ 0.18206E-14 -14.7398 0.14896E-14 -14.8269 0.81821E+00 -0.0871 71 MnF+ 0.58230E-11 -11.2349 0.47644E-11 -11.3220 0.81821E+00 -0.0871 72 MnO,aq 0.77350E-17 -17.1115 0.77350E-17 -17.1115 0.10000E+01 0.0000 73 MnOH+ 0.29495E-12 -12.5302 0.24133E-12 -12.6174 0.81821E+00 -0.0871 78 MnCl+ 0.34485E-10 -10.4624 0.28216E-10 -10.5495 0.81821E+00 -0.0871 79 MnSO4,aq 0.60752E-09 -9.2164 0.60752E-09 -9.2164 0.10000E+01 0.0000 80 NaCl,aq 0.31730E-04 -4.4985 0.31730E-04 -4.4985 0.10000E+01 0.0000 81 NaF,aq 0.13838E-05 -5.8589 0.13838E-05 -5.8589 0.10000E+01 0.0000 82 NaOH,aq 0.71651E-09 -9.1448 0.71651E-09 -9.1448 0.10000E+01 0.0000 84 OH- 0.66282E-07 -7.1786 0.53979E-07 -7.2678 0.81438E+00 -0.0892 91 H2PO3- 0.71897E-19 -19.1433 0.58685E-19 -19.2315 0.81624E+00 -0.0882 92 H3PO4,aq 0.14915E-09 -9.8264 0.14915E-09 -9.8264 0.10000E+01 0.0000 93 H2PO4- 0.45050E-07 -7.3463 0.36816E-07 -7.4340 0.81722E+00 -0.0877 94 PO4-3 0.70426E-16 -16.1523 0.14261E-16 -16.8458 0.20250E+00 -0.6936 96 H3P2O7- 0.43005E-18 -18.3665 0.35102E-18 -18.4547 0.81624E+00 -0.0882 97 H2P2O7-2 0.22389E-15 -15.6500 0.10646E-15 -15.9728 0.47552E+00 -0.3228 98 HP2O7-3 0.10440E-16 -16.9813 0.19895E-17 -17.7013 0.19056E+00 -0.7200 100 H2S,aq 0.20642E-01 -1.6853 0.20212E-01 -1.6944 0.97918E+00 -0.0091 101 S2-2 0.37159E-08 -8.4299 0.17670E-08 -8.7528 0.47552E+00 -0.3228 102 S3-2 0.21542E-07 -7.6667 0.10244E-07 -7.9896 0.47552E+00 -0.3228 103 S3- 0.13115E-05 -5.8822 0.10705E-05 -5.9704 0.81624E+00 -0.0882 104 S4-2 0.82493E-07 -7.0836 0.39227E-07 -7.4064 0.47552E+00 -0.3228 105 S5-2 0.21064E-06 -6.6765 0.10016E-06 -6.9993 0.47552E+00 -0.3228 106 SO2,aq 0.59207E-11 -11.2276 0.59207E-11 -11.2276 0.10000E+01 0.0000 107 SO3-2 0.31107E-11 -11.5071 0.15063E-11 -11.8221 0.48423E+00 -0.3149 108 HSO3- 0.12346E-08 -8.9085 0.10078E-08 -8.9966 0.81624E+00 -0.0882 109 HSO4- 0.30965E-04 -4.5091 0.25367E-04 -4.5957 0.81923E+00 -0.0866 111 S2O3-2 0.12321E-05 -5.9094 0.58589E-06 -6.2322 0.47552E+00 -0.3228 112 HS2O3- 0.13714E-08 -8.8628 0.11194E-08 -8.9510 0.81624E+00 -0.0882 113 H2S2O3,aq 0.19175E-12 -12.7173 0.19175E-12 -12.7173 0.10000E+01 0.0000 121 S4O6-2 0.37236E-14 -14.4290 0.17706E-14 -14.7519 0.47552E+00 -0.3228 Charge balance for all species = -.6023E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1299136E-04 0.9586370E-01 0.9608450E+02 0.0000 2 H2O 0.1000000E+01 0.5543310E+02 0.9930591E+06 0.0000 3 Cl- 0.6571356E-02 0.6603110E-02 0.2327909E+03 2.7007 4 SO4-- 0.5166546E-02 0.5205605E-02 0.4972622E+03 7.3340 5 HCO3- 0.3934296E-02 0.7908251E-01 0.4798408E+04 2.4787 6 HS- 0.7496876E-03 0.2139701E-01 0.7036846E+03 1.7580 7 Al+++ 0.3023500E-12 0.1688840E-08 0.4531260E-04 1.6736 8 H4SiO4 0.1021098E-02 0.1021233E-02 0.9760733E+02 -2.9909 9 Ca++ 0.1597097E-06 0.2275651E-06 0.9069349E-02 2.8200 10 Mg++ 0.8609264E-10 0.9151803E-10 0.2212544E-05 -0.4509 11 Fe++ 0.3963157E-13 0.4027966E-13 0.2236918E-08 -3.7872 12 K+ 0.1487420E-03 0.1544518E-03 0.6005602E+01 1.0564 13 Na+ 0.2187450E-01 0.2190764E-01 0.5008356E+03 3.2229 14 Mn++ 0.1814655E-08 0.2462774E-08 0.1345433E-03 0.8740 15 F- 0.4067220E-03 0.4323338E-03 0.8167545E+01 1.4912 16 HPO4-- 0.3916551E-09 0.4559120E-07 0.4351327E-02 0.2137 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.8764738E-01 0.8765692E-01 -.9539467E-05 0.0000000E+00 2 H2O 0.5066510E+02 0.5068753E+02 -.2243369E-01 0.0000000E+00 3 Cl- 0.6037825E-02 0.6037825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4759967E-02 0.4759959E-02 0.8148058E-08 0.0000000E+00 5 HCO3- 0.7231235E-01 0.7231235E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.1956529E-01 0.1956524E-01 0.5703641E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1544260E-08 0.4773808E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9338068E-03 0.1121921E-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 0.3683137E-13 0.3259223E-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- 0.4000960E-03 0.3953222E-03 0.4773808E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8470E-21 Mass of aqueous solution: 0.919533E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5799E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6739 -0.171 99.93 0.2545 topaz 0.2387E-05 -5.622 0.4393E-03 -3.357 0.6514E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674350 g Volume = 0.254620 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: 0.9999900 moles log = 0.0000 Original solution: 1000.0103000 g Original solution / Rock added: 1000.02 (Water/Rock Ratio), log = 3.0000 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 9.7327 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1097E+00 0.9403 0.1004E+01 0.1068E+01 CO2,gas 0.8310E+00 0.9734 0.7873E+01 0.8088E+01 CH4,gas 0.1161E-06 1.0096 0.1141E-05 0.1130E-05 H2,gas 0.6304E-06 1.0052 0.6167E-05 0.6135E-05 H2S,gas 0.5928E-01 0.9631 0.5556E+00 0.5769E+00 S2,gas 0.3131E-10 1.0000 0.3047E-09 0.3047E-09 CO,gas 0.1332E-08 1.0000 0.1296E-07 0.1296E-07 SO3,gas 0.1095E-28 1.0000 0.1065E-27 0.1065E-27 SO2,gas 0.2631E-11 1.0000 0.2560E-10 0.2560E-10 HF,gas 0.6110E-08 1.0000 0.5947E-07 0.5947E-07 HCl,gas 0.1904E-11 1.0000 0.1853E-10 0.1853E-10 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 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+00 214 topaz -16.55 -16.55 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 0.28978E+04 0.002 2 CO2,gas -6.66 -7.46 -0.80 -0.268 0.13708E+04 0.896 3 CH4,gas 4.54 -3.10 -7.64 -1.910 0.13048E+05 -5.943 4 H2,gas 8.00 1.09 -6.91 -3.948 0.11797E+05 -5.210 5 H2S,gas -6.23 -8.18 -1.95 -0.977 0.33367E+04 -0.255 6 S2,gas -7.34 -18.55 -11.22 -1.725 0.19150E+05 -9.516 7 CO,gas 3.21 -6.37 -9.59 -2.950 0.16368E+05 -7.887 8 SO3,gas 17.12 -12.55 -29.67 -7.418 0.50663E+05 -27.973 9 SO2,gas 0.83 -11.46 -12.29 -3.278 0.20986E+05 -10.592 10 HF,gas 0.47 -8.45 -8.92 -4.462 0.15239E+05 -7.226 11 HCl,gas 5.19 -7.24 -12.43 -6.216 0.21226E+05 -10.732 16 albite-high 0.69 -4.07 -4.77 -0.367 0.81385E+04 17 albite -0.38 -4.07 -3.69 -0.284 0.62997E+04 21 analcite 3.32 -1.08 -4.41 -0.490 0.75241E+04 22 andalusite 5.00 0.36 -4.65 -0.465 0.79330E+04 25 anhydrite -5.32 -9.73 -4.41 -2.207 0.75369E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.67 -1.20 -0.200 0.20517E+04 69 diamond -3.10 -5.28 -2.18 -0.622 0.37178E+04 86 gibbsite 4.08 1.67 -2.41 -0.344 0.41116E+04 89 graphite -3.55 -5.28 -1.73 -0.495 0.29600E+04 101 kaolinite -1.33 -2.64 -1.30 -0.118 0.22243E+04 102 kyanite 4.88 0.36 -4.52 -0.452 0.77189E+04 119 microcline -2.49 -6.24 -3.75 -0.289 0.64087E+04 124 paragonite 4.24 -0.73 -4.97 -0.292 0.84839E+04 149 pyrophyllite -6.18 -8.61 -2.44 -0.152 0.41625E+04 156 sanidine -1.28 -6.24 -4.96 -0.382 0.84765E+04 159 sillimanite 5.26 0.36 -4.91 -0.491 0.83770E+04 172 sulfur -9.15 -9.28 -0.12 -0.038 0.20996E+03 180 topaz-H 4.62 0.35 -4.26 -0.388 0.72803E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 196 beidellite-Ca -1.65 -6.61 -4.96 -0.307 0.84766E+04 197 beidellite-H -2.33 -7.08 -4.75 -0.303 0.81089E+04 200 beidellite-Na -1.34 -6.01 -4.67 -0.286 0.79731E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.57 -4.25 -0.531 0.72578E+04 218 gypsum -4.96 -9.73 -4.78 -1.194 0.81570E+04 237 boehmite 4.41 1.67 -2.73 -0.456 0.46687E+04 240 fluorite -9.93 -14.08 -4.15 -1.384 0.70889E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 0.9999900 MOLES New total amount of reactant added: 1.0399900 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 = 1.0399900 Water: Moles liquid = 0.5079E+02 kg liquid = 0.9150E+00 Moles total = 0.5070E+02 kg total = 0.9133E+00 Activity = 0.9982 Stoichiometric ionic strength = .7781945E-01 Osmotic coef. = 0.8726 True ionic strength = .2738701E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6274E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.15933E-04 -4.7977 0.13098E-04 -4.8828 0.82206E+00 -0.0851 2 H2O 0.99819E+00 -0.0008 0.99819E+00 -0.0008 3 Cl- 0.68234E-02 -2.1660 0.55664E-02 -2.2544 0.81578E+00 -0.0884 4 SO4-- 0.53627E-02 -2.2706 0.25518E-02 -2.5931 0.47585E+00 -0.3225 5 HCO3- 0.33659E-02 -2.4729 0.27510E-02 -2.5605 0.81730E+00 -0.0876 6 HS- 0.63962E-03 -3.1941 0.52189E-03 -3.2824 0.81593E+00 -0.0883 7 Al+++ 0.44473E-12 -12.3519 0.84250E-13 -13.0744 0.18944E+00 -0.7225 8 H4SiO4 0.10209E-02 -2.9910 0.10209E-02 -2.9910 0.10000E+01 0.0000 9 Ca++ 0.15895E-06 -6.7987 0.74928E-07 -7.1254 0.47138E+00 -0.3266 10 Mg++ 0.86572E-10 -10.0626 0.40571E-10 -10.3918 0.46864E+00 -0.3292 11 Fe++ 0.49439E-13 -13.3059 0.23201E-13 -13.6345 0.46929E+00 -0.3286 12 K+ 0.14844E-03 -3.8285 0.12135E-03 -3.9159 0.81754E+00 -0.0875 13 Na+ 0.21858E-01 -1.6604 0.17827E-01 -1.7489 0.81557E+00 -0.0885 14 Mn++ 0.17974E-08 -8.7454 0.84440E-09 -9.0735 0.46979E+00 -0.3281 15 F- 0.41762E-03 -3.3792 0.33979E-03 -3.4688 0.81365E+00 -0.0896 16 HPO4-- 0.32001E-09 -9.4948 0.15230E-09 -9.8173 0.47594E+00 -0.3224 17 SiF6-2 0.31180E-18 -18.5061 0.14797E-18 -18.8298 0.47457E+00 -0.3237 18 HSiO3- 0.89378E-07 -7.0488 0.72913E-07 -7.1372 0.81578E+00 -0.0884 19 Ca(HSiO3)+ 0.15214E-12 -12.8177 0.12442E-12 -12.9051 0.81776E+00 -0.0874 20 Mg(HSiO3)+ 0.10252E-15 -15.9892 0.83841E-16 -16.0765 0.81776E+00 -0.0874 21 NaHSiO3,aq 0.21022E-07 -7.6773 0.21022E-07 -7.6773 0.10000E+01 0.0000 22 AlO+ 0.81550E-10 -10.0886 0.66689E-10 -10.1759 0.81776E+00 -0.0874 23 AlOH+2 0.92468E-11 -11.0340 0.43494E-11 -11.3616 0.47037E+00 -0.3276 24 HAlO2,aq 0.10121E-08 -8.9948 0.10121E-08 -8.9948 0.10000E+01 0.0000 25 AlO2- 0.21016E-09 -9.6774 0.17105E-09 -9.7669 0.81391E+00 -0.0894 26 CH4,aq 0.55747E-09 -9.2538 0.54552E-09 -9.2632 0.97856E+00 -0.0094 27 C2H6,aq 0.12227E-19 -19.9127 0.11965E-19 -19.9221 0.97856E+00 -0.0094 31 CO,aq 0.82533E-11 -11.0834 0.82533E-11 -11.0834 0.10000E+01 0.0000 32 CO2,aq 0.78821E-01 -1.1034 0.77131E-01 -1.1128 0.97856E+00 -0.0094 33 CO3-2 0.38657E-07 -7.4128 0.18345E-07 -7.7365 0.47457E+00 -0.3237 34 CaCO3,aq 0.17236E-10 -10.7636 0.17236E-10 -10.7636 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.64341E-08 -8.1915 0.52615E-08 -8.2789 0.81776E+00 -0.0874 36 CaCl+ 0.82538E-09 -9.0833 0.67496E-09 -9.1707 0.81776E+00 -0.0874 37 CaCl2,aq 0.89261E-12 -12.0493 0.89261E-12 -12.0493 0.10000E+01 0.0000 38 CaF+ 0.45456E-09 -9.3424 0.37172E-09 -9.4298 0.81776E+00 -0.0874 39 CaOH+ 0.49766E-12 -12.3031 0.40697E-12 -12.3904 0.81776E+00 -0.0874 40 CaSO4,aq 0.60717E-07 -7.2167 0.60717E-07 -7.2167 0.10000E+01 0.0000 41 HCl,aq 0.13360E-07 -7.8742 0.13360E-07 -7.8742 0.10000E+01 0.0000 45 HF,aq 0.30468E-04 -4.5162 0.30468E-04 -4.5162 0.10000E+01 0.0000 46 HF2- 0.42847E-08 -8.3681 0.34953E-08 -8.4565 0.81578E+00 -0.0884 48 FeCl+ 0.24997E-15 -15.6021 0.20442E-15 -15.6895 0.81776E+00 -0.0874 51 FeF+ 0.49265E-15 -15.3075 0.40287E-15 -15.3948 0.81776E+00 -0.0874 54 FeOH+ 0.70382E-16 -16.1525 0.57556E-16 -16.2399 0.81776E+00 -0.0874 60 H2,aq 0.43450E-08 -8.3620 0.42518E-08 -8.3714 0.97856E+00 -0.0094 61 KCl,aq 0.12243E-07 -7.9121 0.12243E-07 -7.9121 0.10000E+01 0.0000 62 KHSO4,aq 0.11468E-10 -10.9405 0.11468E-10 -10.9405 0.10000E+01 0.0000 63 KOH,aq 0.39496E-11 -11.4034 0.39496E-11 -11.4034 0.10000E+01 0.0000 64 KSO4- 0.58906E-05 -5.2298 0.48054E-05 -5.3183 0.81578E+00 -0.0884 65 MgCO3,aq 0.23393E-14 -14.6309 0.23393E-14 -14.6309 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.35598E-11 -11.4486 0.29111E-11 -11.5359 0.81776E+00 -0.0874 67 MgCl+ 0.40506E-12 -12.3925 0.33124E-12 -12.4799 0.81776E+00 -0.0874 68 MgF+ 0.91174E-12 -12.0401 0.74558E-12 -12.1275 0.81776E+00 -0.0874 69 MgOH+ 0.14911E-14 -14.8265 0.12194E-14 -14.9139 0.81776E+00 -0.0874 71 MnF+ 0.59098E-11 -11.2284 0.48328E-11 -11.3158 0.81776E+00 -0.0874 72 MnO,aq 0.50880E-17 -17.2935 0.50880E-17 -17.2935 0.10000E+01 0.0000 73 MnOH+ 0.23796E-12 -12.6235 0.19459E-12 -12.7109 0.81776E+00 -0.0874 78 MnCl+ 0.35394E-10 -10.4511 0.28944E-10 -10.5384 0.81776E+00 -0.0874 79 MnSO4,aq 0.62207E-09 -9.2062 0.62207E-09 -9.2062 0.10000E+01 0.0000 80 NaCl,aq 0.32885E-04 -4.4830 0.32885E-04 -4.4830 0.10000E+01 0.0000 81 NaF,aq 0.14181E-05 -5.8483 0.14181E-05 -5.8483 0.10000E+01 0.0000 82 NaOH,aq 0.58370E-09 -9.2338 0.58370E-09 -9.2338 0.10000E+01 0.0000 84 OH- 0.54099E-07 -7.2668 0.44032E-07 -7.3562 0.81391E+00 -0.0894 91 H2PO3- 0.65092E-19 -19.1865 0.53101E-19 -19.2749 0.81578E+00 -0.0884 92 H3PO4,aq 0.18274E-09 -9.7382 0.18274E-09 -9.7382 0.10000E+01 0.0000 93 H2PO4- 0.45056E-07 -7.3462 0.36800E-07 -7.4342 0.81676E+00 -0.0879 94 PO4-3 0.47045E-16 -16.3275 0.94872E-17 -17.0229 0.20166E+00 -0.6954 96 H3P2O7- 0.52704E-18 -18.2782 0.42994E-18 -18.3666 0.81578E+00 -0.0884 97 H2P2O7-2 0.22416E-15 -15.6494 0.10638E-15 -15.9731 0.47457E+00 -0.3237 98 HP2O7-3 0.85483E-17 -17.0681 0.16217E-17 -17.7900 0.18971E+00 -0.7219 100 H2S,aq 0.21589E-01 -1.6658 0.21126E-01 -1.6752 0.97856E+00 -0.0094 101 S2-2 0.29909E-08 -8.5242 0.14194E-08 -8.8479 0.47457E+00 -0.3237 102 S3-2 0.20022E-07 -7.6985 0.95018E-08 -8.0222 0.47457E+00 -0.3237 103 S3- 0.15683E-05 -5.8046 0.12794E-05 -5.8930 0.81578E+00 -0.0884 104 S4-2 0.88537E-07 -7.0529 0.42017E-07 -7.3766 0.47457E+00 -0.3237 105 S5-2 0.26106E-06 -6.5833 0.12389E-06 -6.9070 0.47457E+00 -0.3237 106 SO2,aq 0.83430E-11 -11.0787 0.83430E-11 -11.0787 0.10000E+01 0.0000 107 SO3-2 0.29226E-11 -11.5342 0.14125E-11 -11.8500 0.48331E+00 -0.3158 108 HSO3- 0.14200E-08 -8.8477 0.11584E-08 -8.9361 0.81578E+00 -0.0884 109 HSO4- 0.39340E-04 -4.4052 0.32211E-04 -4.4920 0.81879E+00 -0.0868 111 S2O3-2 0.13369E-05 -5.8739 0.63443E-06 -6.1976 0.47457E+00 -0.3237 112 HS2O3- 0.18213E-08 -8.7396 0.14858E-08 -8.8280 0.81578E+00 -0.0884 113 H2S2O3,aq 0.31198E-12 -12.5059 0.31198E-12 -12.5059 0.10000E+01 0.0000 121 S4O6-2 0.72623E-14 -14.1389 0.34465E-14 -14.4626 0.47457E+00 -0.3237 Charge balance for all species = -.6019E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1593309E-04 0.1005023E+00 0.1007154E+03 0.0000 2 H2O 0.1000000E+01 0.5542942E+02 0.9928114E+06 0.0000 3 Cl- 0.6823409E-02 0.6856321E-02 0.2416735E+03 2.6284 4 SO4-- 0.5362684E-02 0.5410633E-02 0.5167527E+03 7.1724 5 HCO3- 0.3365917E-02 0.8218672E-01 0.4985846E+04 2.3223 6 HS- 0.6396220E-03 0.2223529E-01 0.7311192E+03 1.6004 7 Al+++ 0.4447255E-12 0.1313540E-08 0.3523664E-04 1.5740 8 H4SiO4 0.1020928E-02 0.1021039E-02 0.9757086E+02 -2.9910 9 Ca++ 0.1589538E-06 0.2274031E-06 0.9061233E-02 2.6402 10 Mg++ 0.8657231E-10 0.9145288E-10 0.2210564E-05 -0.6262 11 Fe++ 0.4943873E-13 0.5025174E-13 0.2790203E-08 -3.8689 12 K+ 0.1484390E-03 0.1543419E-03 0.6000227E+01 0.9669 13 Na+ 0.2185772E-01 0.2189204E-01 0.5003874E+03 3.1339 14 Mn++ 0.1797411E-08 0.2461021E-08 0.1344228E-03 0.6921 15 F- 0.4176164E-03 0.4495112E-03 0.8490500E+01 1.4140 16 HPO4-- 0.3200082E-09 0.4555874E-07 0.4347433E-02 -0.0517 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.9195438E-01 0.9196392E-01 -.9540152E-05 0.0000000E+00 2 H2O 0.5069785E+02 0.5072028E+02 -.2243271E-01 0.0000000E+00 3 Cl- 0.6273825E-02 0.6273825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.4950967E-02 0.4950959E-02 0.8148056E-08 0.0000000E+00 5 HCO3- 0.7520435E-01 0.7520435E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2034629E-01 0.2034624E-01 0.5703639E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1201945E-08 0.4774150E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9342940E-03 0.1121873E-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 0.4598248E-13 0.3259222E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4160960E-03 0.4113218E-03 0.4774150E-05 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: 0.920357E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.0399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5799E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6739 -0.171 99.93 0.2545 topaz 0.2387E-05 -5.622 0.4393E-03 -3.357 0.6515E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674321 g Volume = 0.254609 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: 1.0399900 moles log = 0.0170 Original solution: 1000.0103000 g Original solution / Rock added: 961.56 (Water/Rock Ratio), log = 2.9830 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 10.1626 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1053E+00 0.9384 0.1004E+01 0.1070E+01 CO2,gas 0.8353E+00 0.9722 0.8252E+01 0.8489E+01 CH4,gas 0.7824E-07 1.0099 0.8030E-06 0.7951E-06 H2,gas 0.5463E-06 1.0054 0.5582E-05 0.5552E-05 H2S,gas 0.5943E-01 0.9615 0.5807E+00 0.6040E+00 S2,gas 0.3998E-10 1.0000 0.4063E-09 0.4063E-09 CO,gas 0.1210E-08 1.0000 0.1230E-07 0.1230E-07 SO3,gas 0.1632E-28 1.0000 0.1658E-27 0.1658E-27 SO2,gas 0.3550E-11 1.0000 0.3608E-10 0.3608E-10 HF,gas 0.7361E-08 1.0000 0.7481E-07 0.7481E-07 HCl,gas 0.2320E-11 1.0000 0.2357E-10 0.2357E-10 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 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+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 0.28979E+04 0.002 2 CO2,gas -6.66 -7.44 -0.78 -0.261 0.13359E+04 0.917 3 CH4,gas 4.54 -3.25 -7.79 -1.949 0.13309E+05 -6.095 4 H2,gas 8.00 1.05 -6.95 -3.973 0.11871E+05 -5.253 5 H2S,gas -6.23 -8.17 -1.93 -0.967 0.33039E+04 -0.236 6 S2,gas -7.34 -18.43 -11.09 -1.706 0.18936E+05 -9.391 7 CO,gas 3.21 -6.39 -9.61 -2.957 0.16407E+05 -7.910 8 SO3,gas 17.12 -12.36 -29.48 -7.370 0.50335E+05 -27.780 9 SO2,gas 0.83 -11.31 -12.14 -3.238 0.20732E+05 -10.443 10 HF,gas 0.47 -8.35 -8.83 -4.413 0.15068E+05 -7.126 11 HCl,gas 5.19 -7.14 -12.33 -6.163 0.21047E+05 -10.628 16 albite-high 0.69 -4.26 -4.96 -0.381 0.84607E+04 17 albite -0.38 -4.26 -3.88 -0.298 0.66219E+04 21 analcite 3.32 -1.27 -4.60 -0.511 0.78463E+04 22 andalusite 5.00 0.16 -4.85 -0.485 0.82734E+04 25 anhydrite -5.32 -9.72 -4.40 -2.201 0.75158E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.57 -1.30 -0.217 0.22219E+04 69 diamond -3.10 -5.35 -2.24 -0.641 0.38305E+04 86 gibbsite 4.08 1.57 -2.51 -0.358 0.42818E+04 89 graphite -3.55 -5.35 -1.80 -0.514 0.30728E+04 101 kaolinite -1.33 -2.83 -1.50 -0.137 0.25648E+04 102 kyanite 4.88 0.16 -4.72 -0.472 0.80593E+04 119 microcline -2.49 -6.43 -3.94 -0.303 0.67318E+04 149 pyrophyllite -6.18 -8.81 -2.64 -0.165 0.45029E+04 172 sulfur -9.15 -9.21 -0.06 -0.019 0.10326E+03 180 topaz-H 4.62 0.16 -4.46 -0.406 0.76207E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 197 beidellite-H -2.33 -7.31 -4.98 -0.318 0.85055E+04 200 beidellite-Na -1.34 -6.27 -4.93 -0.302 0.84198E+04 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.74 -4.42 -0.552 0.75451E+04 218 gypsum -4.96 -9.72 -4.76 -1.191 0.81360E+04 237 boehmite 4.41 1.57 -2.83 -0.472 0.48389E+04 240 fluorite -9.93 -14.06 -4.13 -1.377 0.70556E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.0399900 MOLES New total amount of reactant added: 1.0799900 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 = 1.0799900 Water: Moles liquid = 0.5083E+02 kg liquid = 0.9157E+00 Moles total = 0.5073E+02 kg total = 0.9139E+00 Activity = 0.9981 Stoichiometric ionic strength = .8033340E-01 Osmotic coef. = 0.8715 True ionic strength = .2756663E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6510E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20025E-04 -4.6984 0.16453E-04 -4.7837 0.82164E+00 -0.0853 2 H2O 0.99811E+00 -0.0008 0.99811E+00 -0.0008 3 Cl- 0.70751E-02 -2.1503 0.57685E-02 -2.2389 0.81532E+00 -0.0887 4 SO4-- 0.55551E-02 -2.2553 0.26382E-02 -2.5787 0.47492E+00 -0.3234 5 HCO3- 0.28035E-02 -2.5523 0.22901E-02 -2.6401 0.81685E+00 -0.0879 6 HS- 0.53142E-03 -3.2746 0.43336E-03 -3.3632 0.81548E+00 -0.0886 7 Al+++ 0.69115E-12 -12.1604 0.13036E-12 -12.8849 0.18861E+00 -0.7244 8 H4SiO4 0.10208E-02 -2.9911 0.10208E-02 -2.9911 0.10000E+01 0.0000 9 Ca++ 0.15823E-06 -6.8007 0.74439E-07 -7.1282 0.47044E+00 -0.3275 10 Mg++ 0.87054E-10 -10.0602 0.40714E-10 -10.3903 0.46769E+00 -0.3300 11 Fe++ 0.64240E-13 -13.1922 0.30087E-13 -13.5216 0.46834E+00 -0.3294 12 K+ 0.14814E-03 -3.8293 0.12105E-03 -3.9171 0.81709E+00 -0.0877 13 Na+ 0.21841E-01 -1.6607 0.17803E-01 -1.7495 0.81512E+00 -0.0888 14 Mn++ 0.17809E-08 -8.7494 0.83496E-09 -9.0783 0.46884E+00 -0.3290 15 F- 0.42617E-03 -3.3704 0.34656E-03 -3.4602 0.81319E+00 -0.0898 16 HPO4-- 0.25503E-09 -9.5934 0.12114E-09 -9.9167 0.47501E+00 -0.3233 17 SiF6-2 0.87575E-18 -18.0576 0.41479E-18 -18.3822 0.47364E+00 -0.3246 18 HSiO3- 0.71185E-07 -7.1476 0.58039E-07 -7.2363 0.81532E+00 -0.0887 19 Ca(HSiO3)+ 0.12038E-12 -12.9194 0.98390E-13 -13.0070 0.81732E+00 -0.0876 20 Mg(HSiO3)+ 0.81943E-16 -16.0865 0.66973E-16 -16.1741 0.81732E+00 -0.0876 21 NaHSiO3,aq 0.16712E-07 -7.7770 0.16712E-07 -7.7770 0.10000E+01 0.0000 22 AlO+ 0.80002E-10 -10.0969 0.65387E-10 -10.1845 0.81732E+00 -0.0876 23 AlOH+2 0.11412E-10 -10.9426 0.53570E-11 -11.2711 0.46943E+00 -0.3284 24 HAlO2,aq 0.78993E-09 -9.1024 0.78993E-09 -9.1024 0.10000E+01 0.0000 25 AlO2- 0.13065E-09 -9.8839 0.10628E-09 -9.9736 0.81345E+00 -0.0897 26 CH4,aq 0.37294E-09 -9.4284 0.36471E-09 -9.4380 0.97795E+00 -0.0097 31 CO,aq 0.77182E-11 -11.1125 0.77182E-11 -11.1125 0.10000E+01 0.0000 32 CO2,aq 0.82483E-01 -1.0836 0.80664E-01 -1.0933 0.97795E+00 -0.0097 33 CO3-2 0.25668E-07 -7.5906 0.12157E-07 -7.9152 0.47364E+00 -0.3246 34 CaCO3,aq 0.11347E-10 -10.9451 0.11347E-10 -10.9451 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.53241E-08 -8.2738 0.43514E-08 -8.3614 0.81732E+00 -0.0876 36 CaCl+ 0.85023E-09 -9.0705 0.69490E-09 -9.1581 0.81732E+00 -0.0876 37 CaCl2,aq 0.95235E-12 -12.0212 0.95235E-12 -12.0212 0.10000E+01 0.0000 38 CaF+ 0.46083E-09 -9.3365 0.37665E-09 -9.4241 0.81732E+00 -0.0876 39 CaOH+ 0.39377E-12 -12.4048 0.32183E-12 -12.4924 0.81732E+00 -0.0876 40 CaSO4,aq 0.62362E-07 -7.2051 0.62362E-07 -7.2051 0.10000E+01 0.0000 41 HCl,aq 0.17392E-07 -7.7596 0.17392E-07 -7.7596 0.10000E+01 0.0000 45 HF,aq 0.39035E-04 -4.4086 0.39035E-04 -4.4086 0.10000E+01 0.0000 46 HF2- 0.56019E-08 -8.2517 0.45673E-08 -8.3403 0.81532E+00 -0.0887 48 FeCl+ 0.33611E-15 -15.4735 0.27471E-15 -15.5611 0.81732E+00 -0.0876 51 FeF+ 0.65192E-15 -15.1858 0.53283E-15 -15.2734 0.81732E+00 -0.0876 54 FeOH+ 0.72690E-16 -16.1385 0.59411E-16 -16.2261 0.81732E+00 -0.0876 60 H2,aq 0.38874E-08 -8.4103 0.38017E-08 -8.4200 0.97795E+00 -0.0097 61 KCl,aq 0.12655E-07 -7.8977 0.12655E-07 -7.8977 0.10000E+01 0.0000 62 KHSO4,aq 0.14856E-10 -10.8281 0.14856E-10 -10.8281 0.10000E+01 0.0000 63 KOH,aq 0.31359E-11 -11.5036 0.31359E-11 -11.5036 0.10000E+01 0.0000 64 KSO4- 0.60779E-05 -5.2162 0.49555E-05 -5.3049 0.81532E+00 -0.0887 65 MgCO3,aq 0.15557E-14 -14.8081 0.15557E-14 -14.8081 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.29755E-11 -11.5264 0.24319E-11 -11.6140 0.81732E+00 -0.0876 67 MgCl+ 0.42148E-12 -12.3752 0.34448E-12 -12.4628 0.81732E+00 -0.0876 68 MgF+ 0.93368E-12 -12.0298 0.76311E-12 -12.1174 0.81732E+00 -0.0876 69 MgOH+ 0.11918E-14 -14.9238 0.97404E-15 -15.0114 0.81732E+00 -0.0876 71 MnF+ 0.59633E-11 -11.2245 0.48739E-11 -11.3121 0.81732E+00 -0.0876 72 MnO,aq 0.31881E-17 -17.4965 0.31881E-17 -17.4965 0.10000E+01 0.0000 73 MnOH+ 0.18740E-12 -12.7272 0.15316E-12 -12.8148 0.81732E+00 -0.0876 78 MnCl+ 0.36289E-10 -10.4402 0.29659E-10 -10.5278 0.81732E+00 -0.0876 79 MnSO4,aq 0.63594E-09 -9.1966 0.63594E-09 -9.1966 0.10000E+01 0.0000 80 NaCl,aq 0.34034E-04 -4.4681 0.34034E-04 -4.4681 0.10000E+01 0.0000 81 NaF,aq 0.14445E-05 -5.8403 0.14445E-05 -5.8403 0.10000E+01 0.0000 82 NaOH,aq 0.46402E-09 -9.3335 0.46402E-09 -9.3335 0.10000E+01 0.0000 84 OH- 0.43088E-07 -7.3656 0.35050E-07 -7.4553 0.81345E+00 -0.0897 91 H2PO3- 0.58189E-19 -19.2352 0.47443E-19 -19.3238 0.81532E+00 -0.0887 92 H3PO4,aq 0.22936E-09 -9.6395 0.22936E-09 -9.6395 0.10000E+01 0.0000 93 H2PO4- 0.45042E-07 -7.3464 0.36768E-07 -7.4345 0.81631E+00 -0.0881 94 PO4-3 0.29910E-16 -16.5242 0.60072E-17 -17.2213 0.20084E+00 -0.6971 96 H3P2O7- 0.66133E-18 -18.1796 0.53920E-18 -18.2682 0.81532E+00 -0.0887 97 H2P2O7-2 0.22423E-15 -15.6493 0.10620E-15 -15.9739 0.47364E+00 -0.3246 98 HP2O7-3 0.68237E-17 -17.1660 0.12889E-17 -17.8898 0.18888E+00 -0.7238 100 H2S,aq 0.22533E-01 -1.6472 0.22037E-01 -1.6569 0.97795E+00 -0.0097 101 S2-2 0.23110E-08 -8.6362 0.10946E-08 -8.9608 0.47364E+00 -0.3246 102 S3-2 0.18047E-07 -7.7436 0.85479E-08 -8.0681 0.47364E+00 -0.3246 103 S3- 0.18753E-05 -5.7269 0.15290E-05 -5.8156 0.81532E+00 -0.0887 104 S4-2 0.93100E-07 -7.0311 0.44095E-07 -7.3556 0.47364E+00 -0.3246 105 S5-2 0.32025E-06 -6.4945 0.15168E-06 -6.8191 0.47364E+00 -0.3246 106 SO2,aq 0.12172E-10 -10.9146 0.12172E-10 -10.9146 0.10000E+01 0.0000 107 SO3-2 0.27070E-11 -11.5675 0.13058E-11 -11.8841 0.48240E+00 -0.3166 108 HSO3- 0.16500E-08 -8.7825 0.13453E-08 -8.8712 0.81532E+00 -0.0887 109 HSO4- 0.51119E-04 -4.2914 0.41833E-04 -4.3785 0.81835E+00 -0.0871 111 S2O3-2 0.14446E-05 -5.8402 0.68423E-06 -6.1648 0.47364E+00 -0.3246 112 HS2O3- 0.24689E-08 -8.6075 0.20129E-08 -8.6962 0.81532E+00 -0.0887 113 H2S2O3,aq 0.53094E-12 -12.2750 0.53094E-12 -12.2750 0.10000E+01 0.0000 121 S4O6-2 0.14937E-13 -13.8257 0.70746E-14 -14.1503 0.47364E+00 -0.3246 Charge balance for all species = -.6015E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2002504E-04 0.1051344E+00 0.1053380E+03 0.0000 2 H2O 0.1000000E+01 0.5542576E+02 0.9925642E+06 0.0000 3 Cl- 0.7075107E-02 0.7109172E-02 0.2505402E+03 2.5448 4 SO4-- 0.5555091E-02 0.5615369E-02 0.5362083E+03 6.9888 5 HCO3- 0.2803547E-02 0.8528652E-01 0.5172948E+04 2.1436 6 HS- 0.5314156E-03 0.2307238E-01 0.7585047E+03 1.4206 7 Al+++ 0.6911450E-12 0.1012687E-08 0.2716107E-04 1.4664 8 H4SiO4 0.1020759E-02 0.1020847E-02 0.9753470E+02 -2.9911 9 Ca++ 0.1582313E-06 0.2272413E-06 0.9053131E-02 2.4393 10 Mg++ 0.8705432E-10 0.9138783E-10 0.2208587E-05 -0.8228 11 Fe++ 0.6424042E-13 0.6530115E-13 0.3625151E-08 -3.9541 12 K+ 0.1481415E-03 0.1542321E-03 0.5994862E+01 0.8667 13 Na+ 0.2184097E-01 0.2187647E-01 0.4999400E+03 3.0342 14 Mn++ 0.1780894E-08 0.2459271E-08 0.1343027E-03 0.4892 15 F- 0.4261735E-03 0.4666642E-03 0.8812880E+01 1.3235 16 HPO4-- 0.2550269E-09 0.4552634E-07 0.4343546E-02 -0.3492 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.9626138E-01 0.9627092E-01 -.9540701E-05 0.0000000E+00 2 H2O 0.5073060E+02 0.5075303E+02 -.2243173E-01 0.0000000E+00 3 Cl- 0.6509825E-02 0.6509825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5141967E-02 0.5141959E-02 0.8148053E-08 0.0000000E+00 5 HCO3- 0.7809635E-01 0.7809635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2112729E-01 0.2112724E-01 0.5703637E-07 0.0000000E+00 7 Al+++ 0.4775352E-05 0.9273115E-09 0.4774425E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9347835E-03 0.1121824E-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 0.5979586E-13 0.3259221E-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- 0.4320960E-03 0.4273216E-03 0.4774425E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.921181E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.0799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5799E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6738 -0.171 99.93 0.2545 topaz 0.2387E-05 -5.622 0.4393E-03 -3.357 0.6516E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.674291 g Volume = 0.254598 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: 1.0799900 moles log = 0.0334 Original solution: 1000.0103000 g Original solution / Rock added: 925.94 (Water/Rock Ratio), log = 2.9666 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 10.5919 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1012E+00 0.9365 0.1004E+01 0.1072E+01 CO2,gas 0.8392E+00 0.9709 0.8630E+01 0.8889E+01 CH4,gas 0.5018E-07 1.0101 0.5368E-06 0.5315E-06 H2,gas 0.4686E-06 1.0057 0.4991E-05 0.4963E-05 H2S,gas 0.5958E-01 0.9599 0.6058E+00 0.6311E+00 S2,gas 0.5220E-10 1.0000 0.5529E-09 0.5529E-09 CO,gas 0.1086E-08 1.0000 0.1150E-07 0.1150E-07 SO3,gas 0.2554E-28 1.0000 0.2706E-27 0.2706E-27 SO2,gas 0.4969E-11 1.0000 0.5264E-10 0.5264E-10 HF,gas 0.9049E-08 1.0000 0.9584E-07 0.9584E-07 HCl,gas 0.2897E-11 1.0000 0.3069E-10 0.3069E-10 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 145 pyrite -21.25 -21.25 0.00 0.000 -0.12132E-10 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 172 sulfur -9.15 -9.15 0.01 0.002 -0.10995E+02 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 0.28979E+04 0.002 2 CO2,gas -6.66 -7.42 -0.76 -0.254 0.13027E+04 0.936 3 CH4,gas 4.54 -3.43 -7.97 -1.992 0.13607E+05 -6.270 4 H2,gas 8.00 1.00 -7.00 -4.000 0.11954E+05 -5.302 5 H2S,gas -6.23 -8.15 -1.92 -0.958 0.32726E+04 -0.218 6 S2,gas -7.34 -18.29 -10.96 -1.686 0.18708E+05 -9.257 7 CO,gas 3.21 -6.42 -9.64 -2.966 0.16457E+05 -7.939 8 SO3,gas 17.12 -12.15 -29.27 -7.317 0.49972E+05 -27.568 9 SO2,gas 0.83 -11.15 -11.98 -3.194 0.20452E+05 -10.279 10 HF,gas 0.47 -8.24 -8.72 -4.359 0.14885E+05 -7.018 11 HCl,gas 5.19 -7.02 -12.21 -6.106 0.20852E+05 -10.513 17 albite -0.38 -4.47 -4.09 -0.314 0.69758E+04 21 analcite 3.32 -1.48 -4.80 -0.534 0.82003E+04 25 anhydrite -5.32 -9.71 -4.39 -2.195 0.74959E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.46 -1.41 -0.235 0.24058E+04 69 diamond -3.10 -5.42 -2.32 -0.663 0.39631E+04 86 gibbsite 4.08 1.46 -2.62 -0.374 0.44657E+04 89 graphite -3.55 -5.42 -1.88 -0.536 0.32054E+04 101 kaolinite -1.33 -3.05 -1.72 -0.156 0.29325E+04 102 kyanite 4.88 -0.06 -4.94 -0.494 0.84268E+04 119 microcline -2.49 -6.64 -4.15 -0.319 0.70867E+04 149 pyrophyllite -6.18 -9.03 -2.85 -0.178 0.48705E+04 180 topaz-H 4.62 -0.06 -4.68 -0.425 0.79883E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.92 -4.61 -0.576 0.78659E+04 218 gypsum -4.96 -9.71 -4.75 -1.188 0.81163E+04 237 boehmite 4.41 1.46 -2.94 -0.490 0.50227E+04 240 fluorite -9.93 -14.05 -4.12 -1.373 0.70312E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 12 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.0799900 Water: Moles liquid = 0.5083E+02 kg liquid = 0.9157E+00 Moles total = 0.5073E+02 kg total = 0.9139E+00 Activity = 0.9981 Stoichiometric ionic strength = .8021911E-01 Osmotic coef. = 0.8717 True ionic strength = .2753500E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6510E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.19627E-04 -4.7071 0.16128E-04 -4.7924 0.82170E+00 -0.0853 2 H2O 0.99811E+00 -0.0008 0.99811E+00 -0.0008 3 Cl- 0.70751E-02 -2.1503 0.57690E-02 -2.2389 0.81540E+00 -0.0886 4 SO4-- 0.55239E-02 -2.2578 0.26243E-02 -2.5810 0.47508E+00 -0.3232 5 HCO3- 0.28581E-02 -2.5439 0.23348E-02 -2.6317 0.81692E+00 -0.0878 6 HS- 0.53957E-03 -3.2680 0.44004E-03 -3.3565 0.81555E+00 -0.0886 7 Al+++ 0.66241E-12 -12.1789 0.12503E-12 -12.9030 0.18876E+00 -0.7241 8 H4SiO4 0.10208E-02 -2.9911 0.10208E-02 -2.9911 0.10000E+01 0.0000 9 Ca++ 0.15837E-06 -6.8003 0.74530E-07 -7.1277 0.47060E+00 -0.3273 10 Mg++ 0.86996E-10 -10.0605 0.40701E-10 -10.3904 0.46785E+00 -0.3299 11 Fe++ 0.62917E-13 -13.2012 0.29477E-13 -13.5305 0.46851E+00 -0.3293 12 K+ 0.14817E-03 -3.8292 0.12108E-03 -3.9169 0.81716E+00 -0.0877 13 Na+ 0.21841E-01 -1.6607 0.17805E-01 -1.7495 0.81519E+00 -0.0887 14 Mn++ 0.17832E-08 -8.7488 0.83630E-09 -9.0776 0.46900E+00 -0.3288 15 F- 0.42688E-03 -3.3697 0.34716E-03 -3.4595 0.81326E+00 -0.0898 16 HPO4-- 0.26011E-09 -9.5848 0.12359E-09 -9.9080 0.47517E+00 -0.3232 17 SiF6-2 0.81665E-18 -18.0880 0.38692E-18 -18.4124 0.47379E+00 -0.3244 18 HSiO3- 0.72616E-07 -7.1390 0.59211E-07 -7.2276 0.81540E+00 -0.0886 19 Ca(HSiO3)+ 0.12295E-12 -12.9103 0.10050E-12 -12.9978 0.81739E+00 -0.0876 20 Mg(HSiO3)+ 0.83563E-16 -16.0780 0.68303E-16 -16.1656 0.81739E+00 -0.0876 21 NaHSiO3,aq 0.17050E-07 -7.7683 0.17050E-07 -7.7683 0.10000E+01 0.0000 22 AlO+ 0.79856E-10 -10.0977 0.65273E-10 -10.1853 0.81739E+00 -0.0876 23 AlOH+2 0.11163E-10 -10.9522 0.52418E-11 -11.2805 0.46959E+00 -0.3283 24 HAlO2,aq 0.80449E-09 -9.0945 0.80449E-09 -9.0945 0.10000E+01 0.0000 25 AlO2- 0.13573E-09 -9.8673 0.11042E-09 -9.9570 0.81352E+00 -0.0896 26 CH4,aq 0.38813E-09 -9.4110 0.37959E-09 -9.4207 0.97798E+00 -0.0097 31 CO,aq 0.77920E-11 -11.1083 0.77920E-11 -11.1083 0.10000E+01 0.0000 32 CO2,aq 0.82428E-01 -1.0839 0.80613E-01 -1.0936 0.97798E+00 -0.0097 33 CO3-2 0.26689E-07 -7.5737 0.12645E-07 -7.8981 0.47379E+00 -0.3244 34 CaCO3,aq 0.11817E-10 -10.9275 0.11817E-10 -10.9275 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.54343E-08 -8.2649 0.44419E-08 -8.3524 0.81739E+00 -0.0876 36 CaCl+ 0.85127E-09 -9.0699 0.69581E-09 -9.1575 0.81739E+00 -0.0876 37 CaCl2,aq 0.95368E-12 -12.0206 0.95368E-12 -12.0206 0.10000E+01 0.0000 38 CaF+ 0.46216E-09 -9.3352 0.37776E-09 -9.4228 0.81739E+00 -0.0876 39 CaOH+ 0.40217E-12 -12.3956 0.32873E-12 -12.4832 0.81739E+00 -0.0876 40 CaSO4,aq 0.62109E-07 -7.2068 0.62109E-07 -7.2068 0.10000E+01 0.0000 41 HCl,aq 0.17049E-07 -7.7683 0.17049E-07 -7.7683 0.10000E+01 0.0000 45 HF,aq 0.38329E-04 -4.4165 0.38329E-04 -4.4165 0.10000E+01 0.0000 46 HF2- 0.55096E-08 -8.2589 0.44925E-08 -8.3475 0.81540E+00 -0.0886 48 FeCl+ 0.32930E-15 -15.4824 0.26916E-15 -15.5700 0.81739E+00 -0.0876 51 FeF+ 0.63977E-15 -15.1940 0.52294E-15 -15.2815 0.81739E+00 -0.0876 54 FeOH+ 0.72649E-16 -16.1388 0.59382E-16 -16.2263 0.81739E+00 -0.0876 60 H2,aq 0.39270E-08 -8.4059 0.38405E-08 -8.4156 0.97798E+00 -0.0097 61 KCl,aq 0.12660E-07 -7.8976 0.12660E-07 -7.8976 0.10000E+01 0.0000 62 KHSO4,aq 0.14489E-10 -10.8390 0.14489E-10 -10.8390 0.10000E+01 0.0000 63 KOH,aq 0.32001E-11 -11.4948 0.32001E-11 -11.4948 0.10000E+01 0.0000 64 KSO4- 0.60470E-05 -5.2185 0.49307E-05 -5.3071 0.81540E+00 -0.0886 65 MgCO3,aq 0.16176E-14 -14.7911 0.16176E-14 -14.7911 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30324E-11 -11.5182 0.24787E-11 -11.6058 0.81739E+00 -0.0876 67 MgCl+ 0.42134E-12 -12.3754 0.34440E-12 -12.4629 0.81739E+00 -0.0876 68 MgF+ 0.93492E-12 -12.0292 0.76419E-12 -12.1168 0.81739E+00 -0.0876 69 MgOH+ 0.12153E-14 -14.9153 0.99338E-15 -15.0029 0.81739E+00 -0.0876 71 MnF+ 0.59828E-11 -11.2231 0.48903E-11 -11.3107 0.81739E+00 -0.0876 72 MnO,aq 0.33235E-17 -17.4784 0.33235E-17 -17.4784 0.10000E+01 0.0000 73 MnOH+ 0.19147E-12 -12.7179 0.15651E-12 -12.8055 0.81739E+00 -0.0876 78 MnCl+ 0.36347E-10 -10.4395 0.29710E-10 -10.5271 0.81739E+00 -0.0876 79 MnSO4,aq 0.63359E-09 -9.1982 0.63359E-09 -9.1982 0.10000E+01 0.0000 80 NaCl,aq 0.34040E-04 -4.4680 0.34040E-04 -4.4680 0.10000E+01 0.0000 81 NaF,aq 0.14471E-05 -5.8395 0.14471E-05 -5.8395 0.10000E+01 0.0000 82 NaOH,aq 0.47343E-09 -9.3247 0.47343E-09 -9.3247 0.10000E+01 0.0000 84 OH- 0.43954E-07 -7.3570 0.35757E-07 -7.4466 0.81352E+00 -0.0896 91 H2PO3- 0.58781E-19 -19.2308 0.47930E-19 -19.3194 0.81540E+00 -0.0886 92 H3PO4,aq 0.22484E-09 -9.6481 0.22484E-09 -9.6481 0.10000E+01 0.0000 93 H2PO4- 0.45041E-07 -7.3464 0.36771E-07 -7.4345 0.81638E+00 -0.0881 94 PO4-3 0.31110E-16 -16.5071 0.62526E-17 -17.2039 0.20098E+00 -0.6968 96 H3P2O7- 0.64828E-18 -18.1882 0.52860E-18 -18.2769 0.81540E+00 -0.0886 97 H2P2O7-2 0.22419E-15 -15.6494 0.10622E-15 -15.9738 0.47379E+00 -0.3244 98 HP2O7-3 0.69571E-17 -17.1576 0.13151E-17 -17.8810 0.18903E+00 -0.7235 100 H2S,aq 0.22428E-01 -1.6492 0.21934E-01 -1.6589 0.97798E+00 -0.0097 101 S2-2 0.23580E-08 -8.6275 0.11172E-08 -8.9519 0.47379E+00 -0.3244 102 S3-2 0.18143E-07 -7.7413 0.85962E-08 -8.0657 0.47379E+00 -0.3244 103 S3- 0.18391E-05 -5.7354 0.14996E-05 -5.8240 0.81540E+00 -0.0886 104 S4-2 0.92218E-07 -7.0352 0.43692E-07 -7.3596 0.47379E+00 -0.3244 105 S5-2 0.31254E-06 -6.5051 0.14808E-06 -6.8295 0.47379E+00 -0.3244 106 SO2,aq 0.11752E-10 -10.9299 0.11752E-10 -10.9299 0.10000E+01 0.0000 107 SO3-2 0.27192E-11 -11.5656 0.13122E-11 -11.8820 0.48256E+00 -0.3165 108 HSO3- 0.16250E-08 -8.7891 0.13250E-08 -8.8778 0.81540E+00 -0.0886 109 HSO4- 0.49838E-04 -4.3024 0.40788E-04 -4.3895 0.81841E+00 -0.0870 111 S2O3-2 0.14298E-05 -5.8447 0.67744E-06 -6.1691 0.47379E+00 -0.3244 112 HS2O3- 0.23958E-08 -8.6206 0.19535E-08 -8.7092 0.81540E+00 -0.0886 113 H2S2O3,aq 0.50507E-12 -12.2966 0.50507E-12 -12.2966 0.10000E+01 0.0000 121 S4O6-2 0.13921E-13 -13.8563 0.65958E-14 -14.1807 0.47379E+00 -0.3244 Charge balance for all species = -.6015E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1962723E-04 0.1049715E+00 0.1051753E+03 0.0000 2 H2O 0.1000000E+01 0.5542581E+02 0.9925706E+06 0.0000 3 Cl- 0.7075092E-02 0.7109162E-02 0.2505413E+03 2.5535 4 SO4-- 0.5523889E-02 0.5582809E-02 0.5331022E+03 7.0039 5 HCO3- 0.2858095E-02 0.8528641E-01 0.5172970E+04 2.1607 6 HS- 0.5395690E-03 0.2297469E-01 0.7552974E+03 1.4359 7 Al+++ 0.6624059E-12 0.1031896E-08 0.2767641E-04 1.4743 8 H4SiO4 0.1020765E-02 0.1020855E-02 0.9753597E+02 -2.9911 9 Ca++ 0.1583715E-06 0.2272410E-06 0.9053169E-02 2.4572 10 Mg++ 0.8699609E-10 0.9138771E-10 0.2208596E-05 -0.8055 11 Fe++ 0.6291702E-13 0.6395875E-13 0.3550648E-08 -3.9457 12 K+ 0.1481722E-03 0.1542319E-03 0.5994887E+01 0.8755 13 Na+ 0.2184094E-01 0.2187644E-01 0.4999421E+03 3.0430 14 Mn++ 0.1783152E-08 0.2459267E-08 0.1343032E-03 0.5072 15 F- 0.4268763E-03 0.4666636E-03 0.8812917E+01 1.3330 16 HPO4-- 0.2601075E-09 0.4552628E-07 0.4343564E-02 -0.3231 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.9626138E-01 0.9612189E-01 0.1394980E-03 0.0000000E+00 2 H2O 0.5073060E+02 0.5075315E+02 -.2255095E-01 0.0000000E+00 3 Cl- 0.6509825E-02 0.6509825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5141967E-02 0.5112151E-02 0.2981588E-04 0.0000000E+00 5 HCO3- 0.7809635E-01 0.7809635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2112729E-01 0.2103781E-01 0.8948024E-04 0.0000000E+00 7 Al+++ 0.4775352E-05 0.9449018E-09 0.4774407E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9347918E-03 0.1121823E-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 0.5856671E-13 0.3259221E-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- 0.4320960E-03 0.4273216E-03 0.4774407E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.5082E-20 Mass of aqueous solution: 0.921177E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.0799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5767E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6738 -0.171 99.37 0.2545 topaz 0.2387E-05 -5.622 0.4393E-03 -3.357 0.6479E-01 0.1230E-03 sulfur 0.1192E-03 -3.924 0.3823E-02 -2.418 0.5637 0.1849E-02 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.678114 g Volume = 0.256447 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: 1.0799900 moles log = 0.0334 Original solution: 1000.0103000 g Original solution / Rock added: 925.94 (Water/Rock Ratio), log = 2.9666 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 10.5830 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1013E+00 0.9365 0.1004E+01 0.1072E+01 CO2,gas 0.8393E+00 0.9709 0.8625E+01 0.8883E+01 CH4,gas 0.5227E-07 1.0101 0.5587E-06 0.5531E-06 H2,gas 0.4738E-06 1.0057 0.5042E-05 0.5014E-05 H2S,gas 0.5935E-01 0.9599 0.6029E+00 0.6281E+00 S2,gas 0.5072E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1097E-08 1.0000 0.1161E-07 0.1161E-07 SO3,gas 0.2443E-28 1.0000 0.2586E-27 0.2586E-27 SO2,gas 0.4802E-11 1.0000 0.5082E-10 0.5082E-10 HF,gas 0.8893E-08 1.0000 0.9411E-07 0.9411E-07 HCl,gas 0.2843E-11 1.0000 0.3008E-10 0.3008E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 0.28979E+04 0.002 2 CO2,gas -6.66 -7.42 -0.76 -0.254 0.13032E+04 0.936 3 CH4,gas 4.54 -3.41 -7.95 -1.988 0.13577E+05 -6.253 4 H2,gas 8.00 1.00 -7.00 -3.998 0.11946E+05 -5.297 5 H2S,gas -6.23 -8.15 -1.92 -0.959 0.32761E+04 -0.220 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.42 -9.63 -2.964 0.16450E+05 -7.935 8 SO3,gas 17.12 -12.17 -29.29 -7.322 0.50006E+05 -27.587 9 SO2,gas 0.83 -11.16 -11.99 -3.198 0.20478E+05 -10.294 10 HF,gas 0.47 -8.25 -8.73 -4.363 0.14898E+05 -7.026 11 HCl,gas 5.19 -7.03 -12.22 -6.110 0.20866E+05 -10.522 17 albite -0.38 -4.45 -4.07 -0.313 0.69474E+04 21 analcite 3.32 -1.46 -4.79 -0.532 0.81718E+04 25 anhydrite -5.32 -9.71 -4.39 -2.196 0.74990E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.47 -1.40 -0.234 0.23922E+04 69 diamond -3.10 -5.41 -2.31 -0.661 0.39485E+04 86 gibbsite 4.08 1.47 -2.61 -0.372 0.44522E+04 89 graphite -3.55 -5.41 -1.87 -0.534 0.31908E+04 101 kaolinite -1.33 -3.03 -1.70 -0.155 0.29054E+04 102 kyanite 4.88 -0.04 -4.92 -0.492 0.83998E+04 119 microcline -2.49 -6.62 -4.13 -0.318 0.70581E+04 149 pyrophyllite -6.18 -9.01 -2.84 -0.177 0.48434E+04 180 topaz-H 4.62 -0.04 -4.66 -0.424 0.79612E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.91 -4.59 -0.574 0.78379E+04 218 gypsum -4.96 -9.71 -4.76 -1.189 0.81193E+04 237 boehmite 4.41 1.47 -2.93 -0.489 0.50091E+04 240 fluorite -9.93 -14.05 -4.12 -1.372 0.70278E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.0799900 MOLES New total amount of reactant added: 1.1199900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.1199900 Water: Moles liquid = 0.5087E+02 kg liquid = 0.9164E+00 Moles total = 0.5076E+02 kg total = 0.9145E+00 Activity = 0.9981 Stoichiometric ionic strength = .8150017E-01 Osmotic coef. = 0.8722 True ionic strength = .2737275E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6746E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20139E-04 -4.6960 0.16554E-04 -4.7811 0.82198E+00 -0.0851 2 H2O 0.99806E+00 -0.0008 0.99806E+00 -0.0008 3 Cl- 0.73263E-02 -2.1351 0.59761E-02 -2.2236 0.81570E+00 -0.0885 4 SO4-- 0.53783E-02 -2.2694 0.25593E-02 -2.5919 0.47586E+00 -0.3225 5 HCO3- 0.28860E-02 -2.5397 0.23585E-02 -2.6274 0.81722E+00 -0.0877 6 HS- 0.52073E-03 -3.2834 0.42484E-03 -3.3718 0.81586E+00 -0.0884 7 Al+++ 0.67182E-12 -12.1727 0.12730E-12 -12.8952 0.18948E+00 -0.7224 8 H4SiO4 0.10207E-02 -2.9911 0.10207E-02 -2.9911 0.10000E+01 0.0000 9 Ca++ 0.15918E-06 -6.7981 0.75039E-07 -7.1247 0.47140E+00 -0.3266 10 Mg++ 0.86853E-10 -10.0612 0.40704E-10 -10.3904 0.46865E+00 -0.3292 11 Fe++ 0.66775E-13 -13.1754 0.31338E-13 -13.5039 0.46930E+00 -0.3285 12 K+ 0.14821E-03 -3.8291 0.12115E-03 -3.9167 0.81746E+00 -0.0875 13 Na+ 0.21824E-01 -1.6611 0.17797E-01 -1.7496 0.81550E+00 -0.0886 14 Mn++ 0.17914E-08 -8.7468 0.84159E-09 -9.0749 0.46980E+00 -0.3281 15 F- 0.44157E-03 -3.3550 0.35925E-03 -3.4446 0.81358E+00 -0.0896 16 HPO4-- 0.25292E-09 -9.5970 0.12037E-09 -9.9195 0.47595E+00 -0.3224 17 SiF6-2 0.11113E-17 -17.9542 0.52738E-18 -18.2779 0.47458E+00 -0.3237 18 HSiO3- 0.70717E-07 -7.1505 0.57684E-07 -7.2389 0.81570E+00 -0.0885 19 Ca(HSiO3)+ 0.12056E-12 -12.9188 0.98578E-13 -13.0062 0.81769E+00 -0.0874 20 Mg(HSiO3)+ 0.81384E-16 -16.0895 0.66547E-16 -16.1769 0.81769E+00 -0.0874 21 NaHSiO3,aq 0.16604E-07 -7.7798 0.16604E-07 -7.7798 0.10000E+01 0.0000 22 AlO+ 0.77141E-10 -10.1127 0.63077E-10 -10.2001 0.81769E+00 -0.0874 23 AlOH+2 0.11053E-10 -10.9565 0.51993E-11 -11.2841 0.47038E+00 -0.3275 24 HAlO2,aq 0.75738E-09 -9.1207 0.75738E-09 -9.1207 0.10000E+01 0.0000 25 AlO2- 0.12445E-09 -9.9050 0.10128E-09 -9.9945 0.81384E+00 -0.0895 26 CH4,aq 0.38824E-09 -9.4109 0.37957E-09 -9.4207 0.97767E+00 -0.0098 31 CO,aq 0.80066E-11 -11.0965 0.80066E-11 -11.0965 0.10000E+01 0.0000 32 CO2,aq 0.85494E-01 -1.0681 0.83585E-01 -1.0779 0.97767E+00 -0.0098 33 CO3-2 0.26223E-07 -7.5813 0.12445E-07 -7.9050 0.47458E+00 -0.3237 34 CaCO3,aq 0.11709E-10 -10.9315 0.11709E-10 -10.9315 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.55249E-08 -8.2577 0.45176E-08 -8.3451 0.81769E+00 -0.0874 36 CaCl+ 0.88752E-09 -9.0518 0.72571E-09 -9.1392 0.81769E+00 -0.0874 37 CaCl2,aq 0.10304E-11 -11.9870 0.10304E-11 -11.9870 0.10000E+01 0.0000 38 CaF+ 0.48134E-09 -9.3175 0.39358E-09 -9.4050 0.81769E+00 -0.0874 39 CaOH+ 0.39434E-12 -12.4041 0.32245E-12 -12.4915 0.81769E+00 -0.0874 40 CaSO4,aq 0.60985E-07 -7.2148 0.60985E-07 -7.2148 0.10000E+01 0.0000 41 HCl,aq 0.18128E-07 -7.7417 0.18128E-07 -7.7417 0.10000E+01 0.0000 45 HF,aq 0.40710E-04 -4.3903 0.40710E-04 -4.3903 0.10000E+01 0.0000 46 HF2- 0.60535E-08 -8.2180 0.49378E-08 -8.3065 0.81570E+00 -0.0885 48 FeCl+ 0.36252E-15 -15.4407 0.29643E-15 -15.5281 0.81769E+00 -0.0874 51 FeF+ 0.70358E-15 -15.1527 0.57531E-15 -15.2401 0.81769E+00 -0.0874 54 FeOH+ 0.75217E-16 -16.1237 0.61503E-16 -16.2111 0.81769E+00 -0.0874 60 H2,aq 0.38927E-08 -8.4097 0.38058E-08 -8.4196 0.97767E+00 -0.0098 61 KCl,aq 0.13122E-07 -7.8820 0.13122E-07 -7.8820 0.10000E+01 0.0000 62 KHSO4,aq 0.14512E-10 -10.8383 0.14512E-10 -10.8383 0.10000E+01 0.0000 63 KOH,aq 0.31195E-11 -11.5059 0.31195E-11 -11.5059 0.10000E+01 0.0000 64 KSO4- 0.58987E-05 -5.2292 0.48116E-05 -5.3177 0.81570E+00 -0.0885 65 MgCO3,aq 0.15921E-14 -14.7980 0.15921E-14 -14.7980 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30623E-11 -11.5140 0.25040E-11 -11.6014 0.81769E+00 -0.0874 67 MgCl+ 0.43633E-12 -12.3602 0.35678E-12 -12.4476 0.81769E+00 -0.0874 68 MgF+ 0.96718E-12 -12.0145 0.79085E-12 -12.1019 0.81769E+00 -0.0874 69 MgOH+ 0.11836E-14 -14.9268 0.96784E-15 -15.0142 0.81769E+00 -0.0874 71 MnF+ 0.62279E-11 -11.2057 0.50925E-11 -11.2931 0.81769E+00 -0.0874 72 MnO,aq 0.31744E-17 -17.4983 0.31744E-17 -17.4983 0.10000E+01 0.0000 73 MnOH+ 0.18765E-12 -12.7267 0.15344E-12 -12.8141 0.81769E+00 -0.0874 78 MnCl+ 0.37876E-10 -10.4216 0.30971E-10 -10.5090 0.81769E+00 -0.0874 79 MnSO4,aq 0.62181E-09 -9.2063 0.62181E-09 -9.2063 0.10000E+01 0.0000 80 NaCl,aq 0.35247E-04 -4.4529 0.35247E-04 -4.4529 0.10000E+01 0.0000 81 NaF,aq 0.14969E-05 -5.8248 0.14969E-05 -5.8248 0.10000E+01 0.0000 82 NaOH,aq 0.46103E-09 -9.3363 0.46103E-09 -9.3363 0.10000E+01 0.0000 84 OH- 0.42804E-07 -7.3685 0.34836E-07 -7.4580 0.81384E+00 -0.0895 91 H2PO3- 0.58211E-19 -19.2350 0.47483E-19 -19.3235 0.81570E+00 -0.0885 92 H3PO4,aq 0.23070E-09 -9.6370 0.23070E-09 -9.6370 0.10000E+01 0.0000 93 H2PO4- 0.45010E-07 -7.3467 0.36759E-07 -7.4346 0.81669E+00 -0.0879 94 PO4-3 0.29415E-16 -16.5314 0.59330E-17 -17.2267 0.20170E+00 -0.6953 96 H3P2O7- 0.66474E-18 -18.1773 0.54223E-18 -18.2658 0.81570E+00 -0.0885 97 H2P2O7-2 0.22368E-15 -15.6504 0.10615E-15 -15.9741 0.47458E+00 -0.3237 98 HP2O7-3 0.67481E-17 -17.1708 0.12805E-17 -17.8926 0.18975E+00 -0.7218 100 H2S,aq 0.22232E-01 -1.6530 0.21735E-01 -1.6628 0.97767E+00 -0.0098 101 S2-2 0.22143E-08 -8.6548 0.10509E-08 -8.9785 0.47458E+00 -0.3237 102 S3-2 0.17038E-07 -7.7686 0.80858E-08 -8.0923 0.47458E+00 -0.3237 103 S3- 0.17830E-05 -5.7489 0.14544E-05 -5.8373 0.81570E+00 -0.0885 104 S4-2 0.86599E-07 -7.0625 0.41098E-07 -7.3862 0.47458E+00 -0.3237 105 S5-2 0.29350E-06 -6.5324 0.13929E-06 -6.8561 0.47458E+00 -0.3237 106 SO2,aq 0.11966E-10 -10.9220 0.11966E-10 -10.9220 0.10000E+01 0.0000 107 SO3-2 0.26239E-11 -11.5810 0.12682E-11 -11.8968 0.48332E+00 -0.3158 108 HSO3- 0.16114E-08 -8.7928 0.13144E-08 -8.8813 0.81570E+00 -0.0885 109 HSO4- 0.49870E-04 -4.3022 0.40829E-04 -4.3890 0.81871E+00 -0.0869 111 S2O3-2 0.13796E-05 -5.8603 0.65472E-06 -6.1839 0.47458E+00 -0.3237 112 HS2O3- 0.23757E-08 -8.6242 0.19379E-08 -8.7127 0.81570E+00 -0.0885 113 H2S2O3,aq 0.51426E-12 -12.2888 0.51426E-12 -12.2888 0.10000E+01 0.0000 121 S4O6-2 0.13801E-13 -13.8601 0.65498E-14 -14.1838 0.47458E+00 -0.3237 Charge balance for all species = -.6010E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2013861E-04 0.1078444E+00 0.1080405E+03 0.0000 2 H2O 0.1000000E+01 0.5542275E+02 0.9923932E+06 0.0000 3 Cl- 0.7326267E-02 0.7361547E-02 0.2594038E+03 2.5575 4 SO4-- 0.5378291E-02 0.5436984E-02 0.5191132E+03 6.9703 5 HCO3- 0.2886014E-02 0.8838051E-01 0.5359978E+04 2.1537 6 HS- 0.5207345E-03 0.2275969E-01 0.7481367E+03 1.4093 7 Al+++ 0.6718228E-12 0.9706922E-09 0.2603166E-04 1.4481 8 H4SiO4 0.1020660E-02 0.1020747E-02 0.9751364E+02 -2.9911 9 Ca++ 0.1591847E-06 0.2270762E-06 0.9045485E-02 2.4375 10 Mg++ 0.8685280E-10 0.9132142E-10 0.2206722E-05 -0.8282 11 Fe++ 0.6677507E-13 0.6791639E-13 0.3769890E-08 -3.9417 12 K+ 0.1482082E-03 0.1541200E-03 0.5989799E+01 0.8644 13 Na+ 0.2182381E-01 0.2186057E-01 0.4995178E+03 3.0315 14 Mn++ 0.1791377E-08 0.2457483E-08 0.1341892E-03 0.4873 15 F- 0.4415655E-03 0.4837855E-03 0.9135133E+01 1.3365 16 HPO4-- 0.2529162E-09 0.4549326E-07 0.4339877E-02 -0.3572 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1005684E+00 0.9882430E-01 0.1744085E-02 0.0000000E+00 2 H2O 0.5076334E+02 0.5078718E+02 -.2383346E-01 0.0000000E+00 3 Cl- 0.6745825E-02 0.6745825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5332967E-02 0.4982234E-02 0.3507333E-03 0.0000000E+00 5 HCO3- 0.8098835E-01 0.8098835E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2190829E-01 0.2085606E-01 0.1052233E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.8895033E-09 0.4774462E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9353716E-03 0.1121765E-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 0.6223585E-13 0.3259221E-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- 0.4480960E-03 0.4433215E-03 0.4774462E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1643E-18 Mass of aqueous solution: 0.921959E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.1199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5437E-03 0.7802E-06 quartz 0.1122E-01 -1.950 0.6738 -0.171 93.68 0.2545 sulfur 0.1403E-02 -2.853 0.4498E-01 -1.347 6.253 0.2176E-01 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.6109E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.719233 g Volume = 0.276344 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: 1.1199900 moles log = 0.0492 Original solution: 1000.0103000 g Original solution / Rock added: 892.87 (Water/Rock Ratio), log = 2.9508 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 10.9163 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9836E-01 0.9351 0.1004E+01 0.1074E+01 CO2,gas 0.8446E+00 0.9700 0.8943E+01 0.9219E+01 CH4,gas 0.5066E-07 1.0103 0.5587E-06 0.5530E-06 H2,gas 0.4551E-06 1.0058 0.4997E-05 0.4968E-05 H2S,gas 0.5709E-01 0.9587 0.5975E+00 0.6232E+00 S2,gas 0.4917E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1093E-08 1.0000 0.1193E-07 0.1193E-07 SO3,gas 0.2434E-28 1.0000 0.2657E-27 0.2657E-27 SO2,gas 0.4740E-11 1.0000 0.5175E-10 0.5175E-10 HF,gas 0.9157E-08 1.0000 0.9996E-07 0.9996E-07 HCl,gas 0.2930E-11 1.0000 0.3199E-10 0.3199E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 0.28980E+04 0.002 2 CO2,gas -6.66 -7.41 -0.75 -0.249 0.12763E+04 0.951 3 CH4,gas 4.54 -3.41 -7.95 -1.988 0.13577E+05 -6.253 4 H2,gas 8.00 1.00 -7.00 -4.000 0.11953E+05 -5.301 5 H2S,gas -6.23 -8.15 -1.92 -0.961 0.32829E+04 -0.224 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.41 -9.62 -2.961 0.16430E+05 -7.923 8 SO3,gas 17.12 -12.15 -29.27 -7.319 0.49986E+05 -27.576 9 SO2,gas 0.83 -11.15 -11.99 -3.196 0.20464E+05 -10.286 10 HF,gas 0.47 -8.23 -8.70 -4.350 0.14854E+05 -7.000 11 HCl,gas 5.19 -7.00 -12.19 -6.097 0.20821E+05 -10.495 17 albite -0.38 -4.49 -4.11 -0.316 0.70118E+04 21 analcite 3.32 -1.50 -4.82 -0.536 0.82362E+04 25 anhydrite -5.32 -9.72 -4.40 -2.200 0.75125E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.45 -1.43 -0.238 0.24370E+04 69 diamond -3.10 -5.41 -2.30 -0.658 0.39351E+04 86 gibbsite 4.08 1.45 -2.63 -0.376 0.44969E+04 89 graphite -3.55 -5.41 -1.86 -0.532 0.31773E+04 101 kaolinite -1.33 -3.09 -1.75 -0.159 0.29949E+04 102 kyanite 4.88 -0.10 -4.97 -0.497 0.84892E+04 119 microcline -2.49 -6.66 -4.17 -0.321 0.71217E+04 149 pyrophyllite -6.18 -9.06 -2.89 -0.181 0.49329E+04 180 topaz-H 4.62 -0.10 -4.71 -0.429 0.80507E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.93 -4.61 -0.577 0.78755E+04 218 gypsum -4.96 -9.72 -4.76 -1.191 0.81330E+04 237 boehmite 4.41 1.45 -2.96 -0.493 0.50539E+04 240 fluorite -9.93 -14.01 -4.08 -1.361 0.69720E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.1199900 MOLES New total amount of reactant added: 1.1599900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.1599900 Water: Moles liquid = 0.5090E+02 kg liquid = 0.9170E+00 Moles total = 0.5080E+02 kg total = 0.9151E+00 Activity = 0.9980 Stoichiometric ionic strength = .8278480E-01 Osmotic coef. = 0.8727 True ionic strength = .2721227E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6982E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20664E-04 -4.6848 0.16991E-04 -4.7698 0.82226E+00 -0.0850 2 H2O 0.99801E+00 -0.0009 0.99801E+00 -0.0009 3 Cl- 0.75771E-02 -2.1205 0.61830E-02 -2.2088 0.81601E+00 -0.0883 4 SO4-- 0.52344E-02 -2.2811 0.24949E-02 -2.6029 0.47664E+00 -0.3218 5 HCO3- 0.29103E-02 -2.5361 0.23792E-02 -2.6236 0.81752E+00 -0.0875 6 HS- 0.50259E-03 -3.2988 0.41020E-03 -3.3870 0.81616E+00 -0.0882 7 Al+++ 0.68238E-12 -12.1660 0.12979E-12 -12.8867 0.19021E+00 -0.7208 8 H4SiO4 0.10206E-02 -2.9912 0.10206E-02 -2.9912 0.10000E+01 0.0000 9 Ca++ 0.16001E-06 -6.7959 0.75553E-07 -7.1217 0.47219E+00 -0.3259 10 Mg++ 0.86714E-10 -10.0619 0.40708E-10 -10.3903 0.46945E+00 -0.3284 11 Fe++ 0.70869E-13 -13.1495 0.33315E-13 -13.4774 0.47010E+00 -0.3278 12 K+ 0.14824E-03 -3.8290 0.12123E-03 -3.9164 0.81776E+00 -0.0874 13 Na+ 0.21807E-01 -1.6614 0.17790E-01 -1.7498 0.81581E+00 -0.0884 14 Mn++ 0.17996E-08 -8.7448 0.84690E-09 -9.0722 0.47059E+00 -0.3274 15 F- 0.45614E-03 -3.3409 0.37125E-03 -3.4303 0.81389E+00 -0.0894 16 HPO4-- 0.24591E-09 -9.6092 0.11723E-09 -9.9310 0.47672E+00 -0.3217 17 SiF6-2 0.15001E-17 -17.8239 0.71308E-18 -18.1469 0.47536E+00 -0.3230 18 HSiO3- 0.68865E-07 -7.1620 0.56195E-07 -7.2503 0.81601E+00 -0.0883 19 Ca(HSiO3)+ 0.11821E-12 -12.9274 0.96690E-13 -13.0146 0.81798E+00 -0.0873 20 Mg(HSiO3)+ 0.79261E-16 -16.1009 0.64834E-16 -16.1882 0.81798E+00 -0.0873 21 NaHSiO3,aq 0.16169E-07 -7.7913 0.16169E-07 -7.7913 0.10000E+01 0.0000 22 AlO+ 0.74621E-10 -10.1271 0.61038E-10 -10.2144 0.81798E+00 -0.0873 23 AlOH+2 0.10960E-10 -10.9602 0.51643E-11 -11.2870 0.47118E+00 -0.3268 24 HAlO2,aq 0.71398E-09 -9.1463 0.71398E-09 -9.1463 0.10000E+01 0.0000 25 AlO2- 0.11425E-09 -9.9422 0.93014E-10 -10.0315 0.81415E+00 -0.0893 26 CH4,aq 0.38801E-09 -9.4112 0.37923E-09 -9.4211 0.97736E+00 -0.0099 31 CO,aq 0.82174E-11 -11.0853 0.82174E-11 -11.0853 0.10000E+01 0.0000 32 CO2,aq 0.88560E-01 -1.0528 0.86555E-01 -1.0627 0.97736E+00 -0.0099 33 CO3-2 0.25729E-07 -7.5896 0.12231E-07 -7.9125 0.47536E+00 -0.3230 34 CaCO3,aq 0.11587E-10 -10.9360 0.11587E-10 -10.9360 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.56096E-08 -8.2511 0.45885E-08 -8.3383 0.81798E+00 -0.0873 36 CaCl+ 0.92420E-09 -9.0342 0.75598E-09 -9.1215 0.81798E+00 -0.0873 37 CaCl2,aq 0.11105E-11 -11.9545 0.11105E-11 -11.9545 0.10000E+01 0.0000 38 CaF+ 0.50064E-09 -9.3005 0.40952E-09 -9.3877 0.81798E+00 -0.0873 39 CaOH+ 0.38665E-12 -12.4127 0.31627E-12 -12.4999 0.81798E+00 -0.0873 40 CaSO4,aq 0.59857E-07 -7.2229 0.59857E-07 -7.2229 0.10000E+01 0.0000 41 HCl,aq 0.19251E-07 -7.7155 0.19251E-07 -7.7155 0.10000E+01 0.0000 45 HF,aq 0.43183E-04 -4.3647 0.43183E-04 -4.3647 0.10000E+01 0.0000 46 HF2- 0.66331E-08 -8.1783 0.54127E-08 -8.2666 0.81601E+00 -0.0883 48 FeCl+ 0.39860E-15 -15.3995 0.32605E-15 -15.4867 0.81798E+00 -0.0873 51 FeF+ 0.77268E-15 -15.1120 0.63204E-15 -15.1993 0.81798E+00 -0.0873 54 FeOH+ 0.77870E-16 -16.1086 0.63696E-16 -16.1959 0.81798E+00 -0.0873 60 H2,aq 0.38591E-08 -8.4135 0.37718E-08 -8.4235 0.97736E+00 -0.0099 61 KCl,aq 0.13585E-07 -7.8669 0.13585E-07 -7.8669 0.10000E+01 0.0000 62 KHSO4,aq 0.14530E-10 -10.8377 0.14530E-10 -10.8377 0.10000E+01 0.0000 63 KOH,aq 0.30408E-11 -11.5170 0.30408E-11 -11.5170 0.10000E+01 0.0000 64 KSO4- 0.57516E-05 -5.2402 0.46933E-05 -5.3285 0.81601E+00 -0.0883 65 MgCO3,aq 0.15648E-14 -14.8055 0.15648E-14 -14.8055 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30883E-11 -11.5103 0.25262E-11 -11.5975 0.81798E+00 -0.0873 67 MgCl+ 0.45132E-12 -12.3455 0.36917E-12 -12.4328 0.81798E+00 -0.0873 68 MgF+ 0.99921E-12 -12.0003 0.81734E-12 -12.0876 0.81798E+00 -0.0873 69 MgOH+ 0.11528E-14 -14.9383 0.94294E-15 -15.0255 0.81798E+00 -0.0873 71 MnF+ 0.64742E-11 -11.1888 0.52958E-11 -11.2761 0.81798E+00 -0.0873 72 MnO,aq 0.30318E-17 -17.5183 0.30318E-17 -17.5183 0.10000E+01 0.0000 73 MnOH+ 0.18389E-12 -12.7354 0.15042E-12 -12.8227 0.81798E+00 -0.0873 78 MnCl+ 0.39420E-10 -10.4043 0.32245E-10 -10.4915 0.81798E+00 -0.0873 79 MnSO4,aq 0.60999E-09 -9.2147 0.60999E-09 -9.2147 0.10000E+01 0.0000 80 NaCl,aq 0.36453E-04 -4.4383 0.36453E-04 -4.4383 0.10000E+01 0.0000 81 NaF,aq 0.15462E-05 -5.8107 0.15462E-05 -5.8107 0.10000E+01 0.0000 82 NaOH,aq 0.44895E-09 -9.3478 0.44895E-09 -9.3478 0.10000E+01 0.0000 84 OH- 0.41683E-07 -7.3800 0.33936E-07 -7.4693 0.81415E+00 -0.0893 91 H2PO3- 0.57653E-19 -19.2392 0.47045E-19 -19.3275 0.81601E+00 -0.0883 92 H3PO4,aq 0.23672E-09 -9.6258 0.23672E-09 -9.6258 0.10000E+01 0.0000 93 H2PO4- 0.44978E-07 -7.3470 0.36746E-07 -7.4348 0.81699E+00 -0.0878 94 PO4-3 0.27810E-16 -16.5558 0.56293E-17 -17.2495 0.20242E+00 -0.6938 96 H3P2O7- 0.68164E-18 -18.1664 0.55622E-18 -18.2547 0.81601E+00 -0.0883 97 H2P2O7-2 0.22317E-15 -15.6514 0.10609E-15 -15.9743 0.47536E+00 -0.3230 98 HP2O7-3 0.65451E-17 -17.1841 0.12467E-17 -17.9042 0.19048E+00 -0.7202 100 H2S,aq 0.22040E-01 -1.6568 0.21541E-01 -1.6667 0.97736E+00 -0.0099 101 S2-2 0.20795E-08 -8.6821 0.98848E-09 -9.0050 0.47536E+00 -0.3230 102 S3-2 0.16000E-07 -7.7959 0.76058E-08 -8.1189 0.47536E+00 -0.3230 103 S3- 0.17286E-05 -5.7623 0.14105E-05 -5.8506 0.81601E+00 -0.0883 104 S4-2 0.81324E-07 -7.0898 0.38658E-07 -7.4128 0.47536E+00 -0.3230 105 S5-2 0.27562E-06 -6.5597 0.13102E-06 -6.8827 0.47536E+00 -0.3230 106 SO2,aq 0.12182E-10 -10.9143 0.12182E-10 -10.9143 0.10000E+01 0.0000 107 SO3-2 0.25312E-11 -11.5967 0.12253E-11 -11.9118 0.48407E+00 -0.3151 108 HSO3- 0.15975E-08 -8.7966 0.13036E-08 -8.8849 0.81601E+00 -0.0883 109 HSO4- 0.49883E-04 -4.3020 0.40854E-04 -4.3888 0.81900E+00 -0.0867 111 S2O3-2 0.13307E-05 -5.8759 0.63257E-06 -6.1989 0.47536E+00 -0.3230 112 HS2O3- 0.23552E-08 -8.6280 0.19218E-08 -8.7163 0.81601E+00 -0.0883 113 H2S2O3,aq 0.52349E-12 -12.2811 0.52349E-12 -12.2811 0.10000E+01 0.0000 121 S4O6-2 0.13674E-13 -13.8641 0.65000E-14 -14.1871 0.47536E+00 -0.3230 Charge balance for all species = -.6006E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2066425E-04 0.1107207E+00 0.1109083E+03 0.0000 2 H2O 0.1000000E+01 0.5541968E+02 0.9922157E+06 0.0000 3 Cl- 0.7577079E-02 0.7613565E-02 0.2682512E+03 2.5610 4 SO4-- 0.5234420E-02 0.5292874E-02 0.5052914E+03 6.9366 5 HCO3- 0.2910314E-02 0.9147013E-01 0.5546668E+04 2.1462 6 HS- 0.5025922E-03 0.2254950E-01 0.7411361E+03 1.3828 7 Al+++ 0.6823799E-12 0.9144850E-09 0.2452128E-04 1.4226 8 H4SiO4 0.1020554E-02 0.1020639E-02 0.9749130E+02 -2.9912 9 Ca++ 0.1600069E-06 0.2269116E-06 0.9037813E-02 2.4178 10 Mg++ 0.8671357E-10 0.9125524E-10 0.2204850E-05 -0.8508 11 Fe++ 0.7086887E-13 0.7211803E-13 0.4002619E-08 -3.9378 12 K+ 0.1482431E-03 0.1540083E-03 0.5984719E+01 0.8534 13 Na+ 0.2180671E-01 0.2184473E-01 0.4990941E+03 3.0199 14 Mn++ 0.1799633E-08 0.2455702E-08 0.1340754E-03 0.4674 15 F- 0.4561393E-03 0.5008825E-03 0.9456802E+01 1.3394 16 HPO4-- 0.2459135E-09 0.4546028E-07 0.4336196E-02 -0.3914 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1048754E+00 0.1015336E+00 0.3341781E-02 0.0000000E+00 2 H2O 0.5079609E+02 0.5082120E+02 -.2511045E-01 0.0000000E+00 3 Cl- 0.6981825E-02 0.6981825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5523967E-02 0.4853695E-02 0.6702725E-03 0.0000000E+00 5 HCO3- 0.8388035E-01 0.8388035E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2268929E-01 0.2067844E-01 0.2010850E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.8386050E-09 0.4774513E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9359512E-03 0.1121707E-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 0.6613400E-13 0.3259220E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4640960E-03 0.4593215E-03 0.4774513E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1719E-18 Mass of aqueous solution: 0.922742E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.1599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.5144E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6738 -0.171 88.63 0.2544 sulfur 0.2681E-02 -2.572 0.8595E-01 -1.066 11.31 0.4158E-01 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.5780E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.760176 g Volume = 0.296156 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: 1.1599900 moles log = 0.0645 Original solution: 1000.0103000 g Original solution / Rock added: 862.09 (Water/Rock Ratio), log = 2.9356 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 11.2501 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9558E-01 0.9337 0.1004E+01 0.1075E+01 CO2,gas 0.8494E+00 0.9690 0.9260E+01 0.9556E+01 CH4,gas 0.4910E-07 1.0105 0.5582E-06 0.5524E-06 H2,gas 0.4375E-06 1.0060 0.4952E-05 0.4922E-05 H2S,gas 0.5497E-01 0.9575 0.5922E+00 0.6184E+00 S2,gas 0.4771E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1088E-08 1.0000 0.1225E-07 0.1225E-07 SO3,gas 0.2426E-28 1.0000 0.2729E-27 0.2729E-27 SO2,gas 0.4682E-11 1.0000 0.5268E-10 0.5268E-10 HF,gas 0.9425E-08 1.0000 0.1060E-06 0.1060E-06 HCl,gas 0.3019E-11 1.0000 0.3397E-10 0.3397E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.30331E-11 214 topaz -16.55 -16.55 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 0.28980E+04 0.002 2 CO2,gas -6.66 -7.39 -0.73 -0.244 0.12504E+04 0.967 3 CH4,gas 4.54 -3.41 -7.95 -1.988 0.13578E+05 -6.253 4 H2,gas 8.00 1.00 -7.00 -4.002 0.11959E+05 -5.305 5 H2S,gas -6.23 -8.16 -1.93 -0.963 0.32895E+04 -0.228 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.40 -9.61 -2.957 0.16411E+05 -7.912 8 SO3,gas 17.12 -12.14 -29.26 -7.316 0.49966E+05 -27.564 9 SO2,gas 0.83 -11.15 -11.98 -3.194 0.20451E+05 -10.278 10 HF,gas 0.47 -8.20 -8.67 -4.337 0.14810E+05 -6.975 11 HCl,gas 5.19 -6.98 -12.17 -6.084 0.20776E+05 -10.469 17 albite -0.38 -4.53 -4.14 -0.319 0.70752E+04 21 analcite 3.32 -1.54 -4.86 -0.540 0.82997E+04 25 anhydrite -5.32 -9.72 -4.41 -2.204 0.75264E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.42 -1.45 -0.242 0.24807E+04 69 diamond -3.10 -5.40 -2.30 -0.656 0.39224E+04 86 gibbsite 4.08 1.42 -2.66 -0.380 0.45408E+04 89 graphite -3.55 -5.40 -1.85 -0.530 0.31647E+04 101 kaolinite -1.33 -3.14 -1.81 -0.164 0.30825E+04 119 microcline -2.49 -6.69 -4.21 -0.324 0.71844E+04 149 pyrophyllite -6.18 -9.12 -2.94 -0.184 0.50204E+04 180 topaz-H 4.62 -0.15 -4.77 -0.433 0.81383E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.95 -4.63 -0.579 0.79130E+04 218 gypsum -4.96 -9.73 -4.77 -1.193 0.81469E+04 237 boehmite 4.41 1.42 -2.99 -0.498 0.50976E+04 240 fluorite -9.93 -13.98 -4.05 -1.351 0.69182E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.1599900 MOLES New total amount of reactant added: 1.1999900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.1999900 Water: Moles liquid = 0.5094E+02 kg liquid = 0.9177E+00 Moles total = 0.5083E+02 kg total = 0.9157E+00 Activity = 0.9980 Stoichiometric ionic strength = .8407284E-01 Osmotic coef. = 0.8733 True ionic strength = .2705352E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7218E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21205E-04 -4.6736 0.17442E-04 -4.7584 0.82254E+00 -0.0848 2 H2O 0.99796E+00 -0.0009 0.99796E+00 -0.0009 3 Cl- 0.78275E-02 -2.1064 0.63897E-02 -2.1945 0.81631E+00 -0.0881 4 SO4-- 0.50922E-02 -2.2931 0.24311E-02 -2.6142 0.47741E+00 -0.3211 5 HCO3- 0.29311E-02 -2.5330 0.23971E-02 -2.6203 0.81782E+00 -0.0873 6 HS- 0.48511E-03 -3.3142 0.39607E-03 -3.4022 0.81646E+00 -0.0881 7 Al+++ 0.69408E-12 -12.1586 0.13252E-12 -12.8777 0.19093E+00 -0.7191 8 H4SiO4 0.10204E-02 -2.9912 0.10204E-02 -2.9912 0.10000E+01 0.0000 9 Ca++ 0.16084E-06 -6.7936 0.76072E-07 -7.1188 0.47297E+00 -0.3252 10 Mg++ 0.86578E-10 -10.0626 0.40713E-10 -10.3903 0.47024E+00 -0.3277 11 Fe++ 0.75215E-13 -13.1237 0.35418E-13 -13.4508 0.47089E+00 -0.3271 12 K+ 0.14828E-03 -3.8289 0.12130E-03 -3.9161 0.81806E+00 -0.0872 13 Na+ 0.21790E-01 -1.6617 0.17783E-01 -1.7500 0.81611E+00 -0.0882 14 Mn++ 0.18079E-08 -8.7428 0.85222E-09 -9.0694 0.47138E+00 -0.3266 15 F- 0.47059E-03 -3.3274 0.38316E-03 -3.4166 0.81421E+00 -0.0893 16 HPO4-- 0.23909E-09 -9.6214 0.11417E-09 -9.9425 0.47750E+00 -0.3210 17 SiF6-2 0.20100E-17 -17.6968 0.95704E-18 -18.0191 0.47613E+00 -0.3223 18 HSiO3- 0.67059E-07 -7.1735 0.54741E-07 -7.2617 0.81631E+00 -0.0881 19 Ca(HSiO3)+ 0.11590E-12 -12.9359 0.94835E-13 -13.0230 0.81828E+00 -0.0871 20 Mg(HSiO3)+ 0.77192E-16 -16.1124 0.63165E-16 -16.1995 0.81828E+00 -0.0871 21 NaHSiO3,aq 0.15744E-07 -7.8029 0.15744E-07 -7.8029 0.10000E+01 0.0000 22 AlO+ 0.72275E-10 -10.1410 0.59141E-10 -10.2281 0.81828E+00 -0.0871 23 AlOH+2 0.10883E-10 -10.9633 0.51364E-11 -11.2893 0.47196E+00 -0.3261 24 HAlO2,aq 0.67388E-09 -9.1714 0.67388E-09 -9.1714 0.10000E+01 0.0000 25 AlO2- 0.10501E-09 -9.9788 0.85524E-10 -10.0679 0.81446E+00 -0.0891 26 CH4,aq 0.38748E-09 -9.4117 0.37859E-09 -9.4218 0.97705E+00 -0.0101 31 CO,aq 0.84244E-11 -11.0745 0.84244E-11 -11.0745 0.10000E+01 0.0000 32 CO2,aq 0.91624E-01 -1.0380 0.89522E-01 -1.0481 0.97705E+00 -0.0101 33 CO3-2 0.25212E-07 -7.5984 0.12004E-07 -7.9207 0.47613E+00 -0.3223 34 CaCO3,aq 0.11450E-10 -10.9412 0.11450E-10 -10.9412 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.56885E-08 -8.2450 0.46548E-08 -8.3321 0.81828E+00 -0.0871 36 CaCl+ 0.96131E-09 -9.0171 0.78662E-09 -9.1042 0.81828E+00 -0.0871 37 CaCl2,aq 0.11941E-11 -11.9229 0.11941E-11 -11.9229 0.10000E+01 0.0000 38 CaF+ 0.52007E-09 -9.2839 0.42556E-09 -9.3710 0.81828E+00 -0.0871 39 CaOH+ 0.37909E-12 -12.4213 0.31020E-12 -12.5084 0.81828E+00 -0.0871 40 CaSO4,aq 0.58726E-07 -7.2312 0.58726E-07 -7.2312 0.10000E+01 0.0000 41 HCl,aq 0.20422E-07 -7.6899 0.20422E-07 -7.6899 0.10000E+01 0.0000 45 HF,aq 0.45750E-04 -4.3396 0.45750E-04 -4.3396 0.10000E+01 0.0000 46 HF2- 0.72502E-08 -8.1396 0.59185E-08 -8.2278 0.81631E+00 -0.0881 48 FeCl+ 0.43776E-15 -15.3588 0.35821E-15 -15.4459 0.81828E+00 -0.0871 51 FeF+ 0.84749E-15 -15.0719 0.69349E-15 -15.1590 0.81828E+00 -0.0871 54 FeOH+ 0.80613E-16 -16.0936 0.65964E-16 -16.1807 0.81828E+00 -0.0871 60 H2,aq 0.38262E-08 -8.4172 0.37385E-08 -8.4273 0.97705E+00 -0.0101 61 KCl,aq 0.14047E-07 -7.8524 0.14047E-07 -7.8524 0.10000E+01 0.0000 62 KHSO4,aq 0.14542E-10 -10.8374 0.14542E-10 -10.8374 0.10000E+01 0.0000 63 KOH,aq 0.29639E-11 -11.5281 0.29639E-11 -11.5281 0.10000E+01 0.0000 64 KSO4- 0.56056E-05 -5.2514 0.45760E-05 -5.3395 0.81631E+00 -0.0881 65 MgCO3,aq 0.15361E-14 -14.8136 0.15361E-14 -14.8136 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31108E-11 -11.5071 0.25455E-11 -11.5942 0.81828E+00 -0.0871 67 MgCl+ 0.46630E-12 -12.3313 0.38156E-12 -12.4184 0.81828E+00 -0.0871 68 MgF+ 0.10310E-11 -11.9867 0.84367E-12 -12.0738 0.81828E+00 -0.0871 69 MgOH+ 0.11227E-14 -14.9497 0.91866E-15 -15.0368 0.81828E+00 -0.0871 71 MnF+ 0.67215E-11 -11.1725 0.55001E-11 -11.2596 0.81828E+00 -0.0871 72 MnO,aq 0.28952E-17 -17.5383 0.28952E-17 -17.5383 0.10000E+01 0.0000 73 MnOH+ 0.18019E-12 -12.7443 0.14745E-12 -12.8314 0.81828E+00 -0.0871 78 MnCl+ 0.40980E-10 -10.3874 0.33533E-10 -10.4745 0.81828E+00 -0.0871 79 MnSO4,aq 0.59812E-09 -9.2232 0.59812E-09 -9.2232 0.10000E+01 0.0000 80 NaCl,aq 0.37656E-04 -4.4242 0.37656E-04 -4.4242 0.10000E+01 0.0000 81 NaF,aq 0.15952E-05 -5.7972 0.15952E-05 -5.7972 0.10000E+01 0.0000 82 NaOH,aq 0.43715E-09 -9.3594 0.43715E-09 -9.3594 0.10000E+01 0.0000 84 OH- 0.40589E-07 -7.3916 0.33058E-07 -7.4807 0.81446E+00 -0.0891 91 H2PO3- 0.57105E-19 -19.2433 0.46616E-19 -19.3315 0.81631E+00 -0.0881 92 H3PO4,aq 0.24291E-09 -9.6146 0.24291E-09 -9.6146 0.10000E+01 0.0000 93 H2PO4- 0.44945E-07 -7.3473 0.36733E-07 -7.4349 0.81729E+00 -0.0876 94 PO4-3 0.26291E-16 -16.5802 0.53404E-17 -17.2724 0.20313E+00 -0.6922 96 H3P2O7- 0.69899E-18 -18.1555 0.57060E-18 -18.2437 0.81631E+00 -0.0881 97 H2P2O7-2 0.22266E-15 -15.6523 0.10602E-15 -15.9746 0.47613E+00 -0.3223 98 HP2O7-3 0.63479E-17 -17.1974 0.12137E-17 -17.9159 0.19120E+00 -0.7185 100 H2S,aq 0.21852E-01 -1.6605 0.21351E-01 -1.6706 0.97705E+00 -0.0101 101 S2-2 0.19528E-08 -8.7093 0.92981E-09 -9.0316 0.47613E+00 -0.3223 102 S3-2 0.15026E-07 -7.8232 0.71543E-08 -8.1454 0.47613E+00 -0.3223 103 S3- 0.16759E-05 -5.7758 0.13680E-05 -5.8639 0.81631E+00 -0.0881 104 S4-2 0.76372E-07 -7.1171 0.36363E-07 -7.4393 0.47613E+00 -0.3223 105 S5-2 0.25884E-06 -6.5870 0.12324E-06 -6.9092 0.47613E+00 -0.3223 106 SO2,aq 0.12398E-10 -10.9066 0.12398E-10 -10.9066 0.10000E+01 0.0000 107 SO3-2 0.24410E-11 -11.6124 0.11835E-11 -11.9268 0.48482E+00 -0.3144 108 HSO3- 0.15833E-08 -8.8004 0.12924E-08 -8.8886 0.81631E+00 -0.0881 109 HSO4- 0.49877E-04 -4.3021 0.40864E-04 -4.3887 0.81930E+00 -0.0866 111 S2O3-2 0.12832E-05 -5.8917 0.61098E-06 -6.2140 0.47613E+00 -0.3223 112 HS2O3- 0.23342E-08 -8.6319 0.19054E-08 -8.7200 0.81631E+00 -0.0881 113 H2S2O3,aq 0.53278E-12 -12.2735 0.53278E-12 -12.2735 0.10000E+01 0.0000 121 S4O6-2 0.13539E-13 -13.8684 0.64464E-14 -14.1907 0.47613E+00 -0.3223 Charge balance for all species = -.6002E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2120483E-04 0.1136002E+00 0.1137786E+03 0.0000 2 H2O 0.1000000E+01 0.5541662E+02 0.9920383E+06 0.0000 3 Cl- 0.7827527E-02 0.7865219E-02 0.2770835E+03 2.5639 4 SO4-- 0.5092234E-02 0.5150434E-02 0.4916324E+03 6.9026 5 HCO3- 0.2931118E-02 0.9455529E-01 0.5733040E+04 2.1381 6 HS- 0.4851093E-03 0.2234401E-01 0.7342913E+03 1.3562 7 Al+++ 0.6940828E-12 0.8627376E-09 0.2313086E-04 1.3975 8 H4SiO4 0.1020449E-02 0.1020532E-02 0.9746896E+02 -2.9912 9 Ca++ 0.1608382E-06 0.2267473E-06 0.9030152E-02 2.3980 10 Mg++ 0.8657827E-10 0.9118915E-10 0.2202981E-05 -0.8735 11 Fe++ 0.7521468E-13 0.7658056E-13 0.4249769E-08 -3.9340 12 K+ 0.1482771E-03 0.1538968E-03 0.5979646E+01 0.8423 13 Na+ 0.2178964E-01 0.2182891E-01 0.4986710E+03 3.0084 14 Mn++ 0.1807921E-08 0.2453924E-08 0.1339618E-03 0.4474 15 F- 0.4705944E-03 0.5179548E-03 0.9777924E+01 1.3418 16 HPO4-- 0.2390918E-09 0.4542736E-07 0.4332520E-02 -0.4257 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1091824E+00 0.1042496E+00 0.4932772E-02 0.0000000E+00 2 H2O 0.5082884E+02 0.5085522E+02 -.2638209E-01 0.0000000E+00 3 Cl- 0.7217825E-02 0.7217825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5714967E-02 0.4726496E-02 0.9884708E-03 0.0000000E+00 5 HCO3- 0.8677235E-01 0.8677235E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2347029E-01 0.2050485E-01 0.2965445E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.7917248E-09 0.4774560E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9365306E-03 0.1121649E-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 0.7027714E-13 0.3259220E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4800960E-03 0.4753214E-03 0.4774560E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.5252E-19 Mass of aqueous solution: 0.923525E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.4882E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6737 -0.172 84.12 0.2544 sulfur 0.3954E-02 -2.403 0.1268 -0.897 15.83 0.6133E-01 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.5486E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.800947 g Volume = 0.315884 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: 1.1999900 moles log = 0.0792 Original solution: 1000.0103000 g Original solution / Rock added: 833.35 (Water/Rock Ratio), log = 2.9208 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 11.5844 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9296E-01 0.9322 0.1004E+01 0.1077E+01 CO2,gas 0.8541E+00 0.9681 0.9578E+01 0.9894E+01 CH4,gas 0.4760E-07 1.0107 0.5573E-06 0.5514E-06 H2,gas 0.4211E-06 1.0062 0.4908E-05 0.4878E-05 H2S,gas 0.5298E-01 0.9563 0.5869E+00 0.6138E+00 S2,gas 0.4633E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1084E-08 1.0000 0.1255E-07 0.1255E-07 SO3,gas 0.2419E-28 1.0000 0.2802E-27 0.2802E-27 SO2,gas 0.4628E-11 1.0000 0.5362E-10 0.5362E-10 HF,gas 0.9697E-08 1.0000 0.1123E-06 0.1123E-06 HCl,gas 0.3111E-11 1.0000 0.3604E-10 0.3604E-10 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 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 -0.75827E-12 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 -0.12132E-10 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 0.28981E+04 0.002 2 CO2,gas -6.66 -7.38 -0.72 -0.239 0.12255E+04 0.981 3 CH4,gas 4.54 -3.41 -7.95 -1.988 0.13579E+05 -6.254 4 H2,gas 8.00 0.99 -7.01 -4.005 0.11966E+05 -5.309 5 H2S,gas -6.23 -8.16 -1.93 -0.965 0.32961E+04 -0.231 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.39 -9.60 -2.954 0.16392E+05 -7.901 8 SO3,gas 17.12 -12.13 -29.25 -7.313 0.49946E+05 -27.553 9 SO2,gas 0.83 -11.14 -11.97 -3.192 0.20438E+05 -10.271 10 HF,gas 0.47 -8.18 -8.65 -4.324 0.14767E+05 -6.949 11 HCl,gas 5.19 -6.95 -12.14 -6.071 0.20733E+05 -10.443 17 albite -0.38 -4.56 -4.18 -0.322 0.71377E+04 21 analcite 3.32 -1.58 -4.90 -0.544 0.83623E+04 25 anhydrite -5.32 -9.73 -4.42 -2.208 0.75405E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.40 -1.48 -0.246 0.25236E+04 69 diamond -3.10 -5.39 -2.29 -0.654 0.39105E+04 86 gibbsite 4.08 1.39 -2.68 -0.383 0.45836E+04 89 graphite -3.55 -5.39 -1.85 -0.528 0.31528E+04 101 kaolinite -1.33 -3.19 -1.86 -0.169 0.31683E+04 119 microcline -2.49 -6.73 -4.24 -0.326 0.72462E+04 149 pyrophyllite -6.18 -9.17 -2.99 -0.187 0.51062E+04 180 topaz-H 4.62 -0.20 -4.82 -0.438 0.82240E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -2.97 -4.66 -0.582 0.79507E+04 218 gypsum -4.96 -9.73 -4.78 -1.195 0.81611E+04 237 boehmite 4.41 1.40 -3.01 -0.502 0.51405E+04 240 fluorite -9.93 -13.95 -4.02 -1.340 0.68662E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.1999900 MOLES New total amount of reactant added: 1.2399900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.2399900 Water: Moles liquid = 0.5098E+02 kg liquid = 0.9184E+00 Moles total = 0.5086E+02 kg total = 0.9163E+00 Activity = 0.9979 Stoichiometric ionic strength = .8536415E-01 Osmotic coef. = 0.8739 True ionic strength = .2689645E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7454E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21761E-04 -4.6623 0.17905E-04 -4.7470 0.82282E+00 -0.0847 2 H2O 0.99791E+00 -0.0009 0.99791E+00 -0.0009 3 Cl- 0.80776E-02 -2.0927 0.65963E-02 -2.1807 0.81661E+00 -0.0880 4 SO4-- 0.49517E-02 -2.3052 0.23678E-02 -2.6257 0.47818E+00 -0.3204 5 HCO3- 0.29485E-02 -2.5304 0.24123E-02 -2.6176 0.81812E+00 -0.0872 6 HS- 0.46825E-03 -3.3295 0.38245E-03 -3.4174 0.81677E+00 -0.0879 7 Al+++ 0.70695E-12 -12.1506 0.13549E-12 -12.8681 0.19165E+00 -0.7175 8 H4SiO4 0.10203E-02 -2.9913 0.10203E-02 -2.9913 0.10000E+01 0.0000 9 Ca++ 0.16168E-06 -6.7913 0.76596E-07 -7.1158 0.47375E+00 -0.3244 10 Mg++ 0.86447E-10 -10.0633 0.40719E-10 -10.3902 0.47103E+00 -0.3270 11 Fe++ 0.79830E-13 -13.0978 0.37654E-13 -13.4242 0.47168E+00 -0.3264 12 K+ 0.14831E-03 -3.8288 0.12137E-03 -3.9159 0.81835E+00 -0.0871 13 Na+ 0.21773E-01 -1.6621 0.17775E-01 -1.7502 0.81642E+00 -0.0881 14 Mn++ 0.18162E-08 -8.7408 0.85757E-09 -9.0667 0.47217E+00 -0.3259 15 F- 0.48493E-03 -3.3143 0.39498E-03 -3.4034 0.81452E+00 -0.0891 16 HPO4-- 0.23244E-09 -9.6337 0.11117E-09 -9.9540 0.47826E+00 -0.3203 17 SiF6-2 0.26747E-17 -17.5727 0.12756E-17 -17.8943 0.47691E+00 -0.3216 18 HSiO3- 0.65295E-07 -7.1851 0.53321E-07 -7.2731 0.81661E+00 -0.0880 19 Ca(HSiO3)+ 0.11363E-12 -12.9445 0.93011E-13 -13.0315 0.81857E+00 -0.0869 20 Mg(HSiO3)+ 0.75175E-16 -16.1239 0.61536E-16 -16.2109 0.81857E+00 -0.0869 21 NaHSiO3,aq 0.15329E-07 -7.8145 0.15329E-07 -7.8145 0.10000E+01 0.0000 22 AlO+ 0.70086E-10 -10.1544 0.57371E-10 -10.2413 0.81857E+00 -0.0869 23 AlOH+2 0.10820E-10 -10.9658 0.51151E-11 -11.2911 0.47275E+00 -0.3254 24 HAlO2,aq 0.63676E-09 -9.1960 0.63676E-09 -9.1960 0.10000E+01 0.0000 25 AlO2- 0.96616E-10 -10.0150 0.78720E-10 -10.1039 0.81477E+00 -0.0890 26 CH4,aq 0.38668E-09 -9.4126 0.37769E-09 -9.4229 0.97675E+00 -0.0102 31 CO,aq 0.86279E-11 -11.0641 0.86279E-11 -11.0641 0.10000E+01 0.0000 32 CO2,aq 0.94687E-01 -1.0237 0.92486E-01 -1.0339 0.97675E+00 -0.0102 33 CO3-2 0.24674E-07 -7.6078 0.11767E-07 -7.9293 0.47691E+00 -0.3216 34 CaCO3,aq 0.11302E-10 -10.9469 0.11302E-10 -10.9469 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.57617E-08 -8.2394 0.47164E-08 -8.3264 0.81857E+00 -0.0869 36 CaCl+ 0.99887E-09 -9.0005 0.81765E-09 -9.0874 0.81857E+00 -0.0869 37 CaCl2,aq 0.12814E-11 -11.8923 0.12814E-11 -11.8923 0.10000E+01 0.0000 38 CaF+ 0.53961E-09 -9.2679 0.44171E-09 -9.3549 0.81857E+00 -0.0869 39 CaOH+ 0.37167E-12 -12.4298 0.30424E-12 -12.5168 0.81857E+00 -0.0869 40 CaSO4,aq 0.57591E-07 -7.2396 0.57591E-07 -7.2396 0.10000E+01 0.0000 41 HCl,aq 0.21643E-07 -7.6647 0.21643E-07 -7.6647 0.10000E+01 0.0000 45 HF,aq 0.48415E-04 -4.3150 0.48415E-04 -4.3150 0.10000E+01 0.0000 46 HF2- 0.79063E-08 -8.1020 0.64564E-08 -8.1900 0.81661E+00 -0.0880 48 FeCl+ 0.48027E-15 -15.3185 0.39314E-15 -15.4055 0.81857E+00 -0.0869 51 FeF+ 0.92846E-15 -15.0322 0.76002E-15 -15.1192 0.81857E+00 -0.0869 54 FeOH+ 0.83450E-16 -16.0786 0.68310E-16 -16.1655 0.81857E+00 -0.0869 60 H2,aq 0.37941E-08 -8.4209 0.37058E-08 -8.4311 0.97675E+00 -0.0102 61 KCl,aq 0.14510E-07 -7.8383 0.14510E-07 -7.8383 0.10000E+01 0.0000 62 KHSO4,aq 0.14549E-10 -10.8372 0.14549E-10 -10.8372 0.10000E+01 0.0000 63 KOH,aq 0.28887E-11 -11.5393 0.28887E-11 -11.5393 0.10000E+01 0.0000 64 KSO4- 0.54609E-05 -5.2627 0.44594E-05 -5.3507 0.81661E+00 -0.0880 65 MgCO3,aq 0.15060E-14 -14.8222 0.15060E-14 -14.8222 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31298E-11 -11.5045 0.25620E-11 -11.5914 0.81857E+00 -0.0869 67 MgCl+ 0.48128E-12 -12.3176 0.39396E-12 -12.4045 0.81857E+00 -0.0869 68 MgF+ 0.10626E-11 -11.9736 0.86983E-12 -12.0606 0.81857E+00 -0.0869 69 MgOH+ 0.10933E-14 -14.9613 0.89496E-15 -15.0482 0.81857E+00 -0.0869 71 MnF+ 0.69699E-11 -11.1568 0.57053E-11 -11.2437 0.81857E+00 -0.0869 72 MnO,aq 0.27643E-17 -17.5584 0.27643E-17 -17.5584 0.10000E+01 0.0000 73 MnOH+ 0.17656E-12 -12.7531 0.14452E-12 -12.8401 0.81857E+00 -0.0869 78 MnCl+ 0.42555E-10 -10.3711 0.34834E-10 -10.4580 0.81857E+00 -0.0869 79 MnSO4,aq 0.58621E-09 -9.2319 0.58621E-09 -9.2319 0.10000E+01 0.0000 80 NaCl,aq 0.38858E-04 -4.4105 0.38858E-04 -4.4105 0.10000E+01 0.0000 81 NaF,aq 0.16437E-05 -5.7842 0.16437E-05 -5.7842 0.10000E+01 0.0000 82 NaOH,aq 0.42564E-09 -9.3710 0.42564E-09 -9.3710 0.10000E+01 0.0000 84 OH- 0.39521E-07 -7.4032 0.32201E-07 -7.4921 0.81477E+00 -0.0890 91 H2PO3- 0.56568E-19 -19.2474 0.46195E-19 -19.3354 0.81661E+00 -0.0880 92 H3PO4,aq 0.24928E-09 -9.6033 0.24928E-09 -9.6033 0.10000E+01 0.0000 93 H2PO4- 0.44913E-07 -7.3476 0.36720E-07 -7.4351 0.81759E+00 -0.0875 94 PO4-3 0.24851E-16 -16.6047 0.50656E-17 -17.2954 0.20384E+00 -0.6907 96 H3P2O7- 0.71682E-18 -18.1446 0.58537E-18 -18.2326 0.81661E+00 -0.0880 97 H2P2O7-2 0.22216E-15 -15.6533 0.10595E-15 -15.9749 0.47691E+00 -0.3216 98 HP2O7-3 0.61562E-17 -17.2107 0.11815E-17 -17.9276 0.19192E+00 -0.7169 100 H2S,aq 0.21668E-01 -1.6642 0.21165E-01 -1.6744 0.97675E+00 -0.0102 101 S2-2 0.18339E-08 -8.7366 0.87459E-09 -9.0582 0.47691E+00 -0.3216 102 S3-2 0.14111E-07 -7.8505 0.67294E-08 -8.1720 0.47691E+00 -0.3216 103 S3- 0.16247E-05 -5.7892 0.13268E-05 -5.8772 0.81661E+00 -0.0880 104 S4-2 0.71720E-07 -7.1444 0.34204E-07 -7.4659 0.47691E+00 -0.3216 105 S5-2 0.24307E-06 -6.6143 0.11592E-06 -6.9358 0.47691E+00 -0.3216 106 SO2,aq 0.12616E-10 -10.8991 0.12616E-10 -10.8991 0.10000E+01 0.0000 107 SO3-2 0.23532E-11 -11.6283 0.11427E-11 -11.9421 0.48557E+00 -0.3137 108 HSO3- 0.15687E-08 -8.8045 0.12810E-08 -8.8924 0.81661E+00 -0.0880 109 HSO4- 0.49852E-04 -4.3023 0.40858E-04 -4.3887 0.81959E+00 -0.0864 111 S2O3-2 0.12369E-05 -5.9076 0.58991E-06 -6.2292 0.47691E+00 -0.3216 112 HS2O3- 0.23127E-08 -8.6359 0.18886E-08 -8.7239 0.81661E+00 -0.0880 113 H2S2O3,aq 0.54212E-12 -12.2659 0.54212E-12 -12.2659 0.10000E+01 0.0000 121 S4O6-2 0.13397E-13 -13.8730 0.63889E-14 -14.1946 0.47691E+00 -0.3216 Charge balance for all species = -.5997E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2176109E-04 0.1164825E+00 0.1166511E+03 0.0000 2 H2O 0.1000000E+01 0.5541356E+02 0.9918608E+06 0.0000 3 Cl- 0.8077614E-02 0.8116509E-02 0.2859009E+03 2.5663 4 SO4-- 0.4951692E-02 0.5009622E-02 0.4781322E+03 6.8684 5 HCO3- 0.2948543E-02 0.9763598E-01 0.5919096E+04 2.1294 6 HS- 0.4682546E-03 0.2214308E-01 0.7275982E+03 1.3296 7 Al+++ 0.7069471E-12 0.8149852E-09 0.2184787E-04 1.3729 8 H4SiO4 0.1020343E-02 0.1020424E-02 0.9744662E+02 -2.9913 9 Ca++ 0.1616789E-06 0.2265832E-06 0.9022502E-02 2.3782 10 Mg++ 0.8644678E-10 0.9112316E-10 0.2201115E-05 -0.8962 11 Fe++ 0.7983013E-13 0.8132233E-13 0.4512351E-08 -3.9302 12 K+ 0.1483100E-03 0.1537854E-03 0.5974580E+01 0.8311 13 Na+ 0.2177260E-01 0.2181311E-01 0.4982486E+03 2.9968 14 Mn++ 0.1816241E-08 0.2452148E-08 0.1338483E-03 0.4273 15 F- 0.4849274E-03 0.5350024E-03 0.1009850E+02 1.3436 16 HPO4-- 0.2324439E-09 0.4539449E-07 0.4328850E-02 -0.4600 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1134894E+00 0.1069721E+00 0.6517234E-02 0.0000000E+00 2 H2O 0.5086159E+02 0.5088924E+02 -.2764850E-01 0.0000000E+00 3 Cl- 0.7453825E-02 0.7453825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.5905967E-02 0.4600604E-02 0.1305363E-02 0.0000000E+00 5 HCO3- 0.8966435E-01 0.8966435E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2425129E-01 0.2033517E-01 0.3916122E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.7484446E-09 0.4774604E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9371098E-03 0.1121591E-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 0.7468265E-13 0.3259220E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.4960960E-03 0.4913214E-03 0.4774604E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.7013E-18 Mass of aqueous solution: 0.924308E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.2399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.4647E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6737 -0.172 80.06 0.2544 sulfur 0.5221E-02 -2.282 0.1674 -0.776 19.89 0.8099E-01 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.5221E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.841550 g Volume = 0.335532 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: 1.2399900 moles log = 0.0934 Original solution: 1000.0103000 g Original solution / Rock added: 806.47 (Water/Rock Ratio), log = 2.9066 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 11.9190 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9049E-01 0.9308 0.1004E+01 0.1079E+01 CO2,gas 0.8584E+00 0.9671 0.9895E+01 0.1023E+02 CH4,gas 0.4614E-07 1.0109 0.5559E-06 0.5500E-06 H2,gas 0.4056E-06 1.0064 0.4865E-05 0.4835E-05 H2S,gas 0.5111E-01 0.9550 0.5818E+00 0.6092E+00 S2,gas 0.4503E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1079E-08 1.0000 0.1286E-07 0.1286E-07 SO3,gas 0.2413E-28 1.0000 0.2876E-27 0.2876E-27 SO2,gas 0.4577E-11 1.0000 0.5456E-10 0.5456E-10 HF,gas 0.9974E-08 1.0000 0.1189E-06 0.1189E-06 HCl,gas 0.3204E-11 1.0000 0.3819E-10 0.3819E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 0.28981E+04 0.002 2 CO2,gas -6.66 -7.36 -0.70 -0.235 0.12013E+04 0.995 3 CH4,gas 4.54 -3.41 -7.95 -1.988 0.13581E+05 -6.255 4 H2,gas 8.00 0.99 -7.01 -4.007 0.11973E+05 -5.313 5 H2S,gas -6.23 -8.16 -1.93 -0.967 0.33026E+04 -0.235 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.37 -9.59 -2.951 0.16374E+05 -7.891 8 SO3,gas 17.12 -12.12 -29.24 -7.310 0.49927E+05 -27.541 9 SO2,gas 0.83 -11.13 -11.96 -3.190 0.20425E+05 -10.263 10 HF,gas 0.47 -8.15 -8.62 -4.312 0.14725E+05 -6.925 11 HCl,gas 5.19 -6.93 -12.12 -6.059 0.20689E+05 -10.418 17 albite -0.38 -4.60 -4.22 -0.324 0.71995E+04 21 analcite 3.32 -1.61 -4.93 -0.548 0.84241E+04 25 anhydrite -5.32 -9.74 -4.42 -2.212 0.75550E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.37 -1.50 -0.250 0.25656E+04 69 diamond -3.10 -5.39 -2.28 -0.652 0.38993E+04 86 gibbsite 4.08 1.37 -2.71 -0.387 0.46257E+04 89 graphite -3.55 -5.39 -1.84 -0.526 0.31415E+04 101 kaolinite -1.33 -3.24 -1.90 -0.173 0.32523E+04 119 microcline -2.49 -6.77 -4.28 -0.329 0.73072E+04 149 pyrophyllite -6.18 -9.22 -3.04 -0.190 0.51902E+04 180 topaz-H 4.62 -0.25 -4.87 -0.442 0.83080E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.00 -4.68 -0.585 0.79883E+04 218 gypsum -4.96 -9.74 -4.79 -1.197 0.81757E+04 237 boehmite 4.41 1.37 -3.04 -0.506 0.51825E+04 240 fluorite -9.93 -13.92 -3.99 -1.331 0.68161E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.2399900 MOLES New total amount of reactant added: 1.2799900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.2799900 Water: Moles liquid = 0.5101E+02 kg liquid = 0.9190E+00 Moles total = 0.5089E+02 kg total = 0.9169E+00 Activity = 0.9979 Stoichiometric ionic strength = .8665861E-01 Osmotic coef. = 0.8745 True ionic strength = .2674104E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7690E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.22334E-04 -4.6510 0.18383E-04 -4.7356 0.82309E+00 -0.0846 2 H2O 0.99786E+00 -0.0009 0.99786E+00 -0.0009 3 Cl- 0.83273E-02 -2.0795 0.68027E-02 -2.1673 0.81691E+00 -0.0878 4 SO4-- 0.48128E-02 -2.3176 0.23050E-02 -2.6373 0.47894E+00 -0.3197 5 HCO3- 0.29627E-02 -2.5283 0.24247E-02 -2.6153 0.81841E+00 -0.0870 6 HS- 0.45200E-03 -3.3449 0.36931E-03 -3.4326 0.81706E+00 -0.0877 7 Al+++ 0.72100E-12 -12.1421 0.13870E-12 -12.8579 0.19237E+00 -0.7159 8 H4SiO4 0.10202E-02 -2.9913 0.10202E-02 -2.9913 0.10000E+01 0.0000 9 Ca++ 0.16253E-06 -6.7891 0.77125E-07 -7.1128 0.47453E+00 -0.3237 10 Mg++ 0.86319E-10 -10.0639 0.40727E-10 -10.3901 0.47181E+00 -0.3262 11 Fe++ 0.84734E-13 -13.0719 0.40034E-13 -13.3976 0.47246E+00 -0.3256 12 K+ 0.14834E-03 -3.8287 0.12144E-03 -3.9156 0.81865E+00 -0.0869 13 Na+ 0.21756E-01 -1.6624 0.17768E-01 -1.7504 0.81672E+00 -0.0879 14 Mn++ 0.18246E-08 -8.7388 0.86294E-09 -9.0640 0.47295E+00 -0.3252 15 F- 0.49913E-03 -3.3018 0.40671E-03 -3.3907 0.81482E+00 -0.0889 16 HPO4-- 0.22596E-09 -9.6460 0.10824E-09 -9.9656 0.47903E+00 -0.3196 17 SiF6-2 0.35364E-17 -17.4514 0.16893E-17 -17.7723 0.47767E+00 -0.3209 18 HSiO3- 0.63573E-07 -7.1967 0.51933E-07 -7.2846 0.81691E+00 -0.0878 19 Ca(HSiO3)+ 0.11139E-12 -12.9531 0.91217E-13 -13.0399 0.81887E+00 -0.0868 20 Mg(HSiO3)+ 0.73206E-16 -16.1355 0.59946E-16 -16.2222 0.81887E+00 -0.0868 21 NaHSiO3,aq 0.14924E-07 -7.8261 0.14924E-07 -7.8261 0.10000E+01 0.0000 22 AlO+ 0.68042E-10 -10.1672 0.55717E-10 -10.2540 0.81887E+00 -0.0868 23 AlOH+2 0.10770E-10 -10.9678 0.51001E-11 -11.2924 0.47353E+00 -0.3247 24 HAlO2,aq 0.60231E-09 -9.2202 0.60231E-09 -9.2202 0.10000E+01 0.0000 25 AlO2- 0.88982E-10 -10.0507 0.72528E-10 -10.1395 0.81508E+00 -0.0888 26 CH4,aq 0.38564E-09 -9.4138 0.37656E-09 -9.4242 0.97644E+00 -0.0104 31 CO,aq 0.88278E-11 -11.0541 0.88278E-11 -11.0541 0.10000E+01 0.0000 32 CO2,aq 0.97749E-01 -1.0099 0.95446E-01 -1.0202 0.97644E+00 -0.0104 33 CO3-2 0.24119E-07 -7.6176 0.11521E-07 -7.9385 0.47767E+00 -0.3209 34 CaCO3,aq 0.11141E-10 -10.9531 0.11141E-10 -10.9531 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.58294E-08 -8.2344 0.47735E-08 -8.3212 0.81887E+00 -0.0868 36 CaCl+ 0.10369E-08 -8.9843 0.84906E-09 -9.0711 0.81887E+00 -0.0868 37 CaCl2,aq 0.13722E-11 -11.8626 0.13722E-11 -11.8626 0.10000E+01 0.0000 38 CaF+ 0.55926E-09 -9.2524 0.45796E-09 -9.3392 0.81887E+00 -0.0868 39 CaOH+ 0.36437E-12 -12.4385 0.29837E-12 -12.5252 0.81887E+00 -0.0868 40 CaSO4,aq 0.56452E-07 -7.2483 0.56452E-07 -7.2483 0.10000E+01 0.0000 41 HCl,aq 0.22915E-07 -7.6399 0.22915E-07 -7.6399 0.10000E+01 0.0000 45 HF,aq 0.51181E-04 -4.2909 0.51181E-04 -4.2909 0.10000E+01 0.0000 46 HF2- 0.86030E-08 -8.0653 0.70279E-08 -8.1532 0.81691E+00 -0.0878 48 FeCl+ 0.52642E-15 -15.2787 0.43107E-15 -15.3655 0.81887E+00 -0.0868 51 FeF+ 0.10161E-14 -14.9931 0.83203E-15 -15.0799 0.81887E+00 -0.0868 54 FeOH+ 0.86384E-16 -16.0636 0.70737E-16 -16.1504 0.81887E+00 -0.0868 60 H2,aq 0.37625E-08 -8.4245 0.36739E-08 -8.4349 0.97644E+00 -0.0104 61 KCl,aq 0.14973E-07 -7.8247 0.14973E-07 -7.8247 0.10000E+01 0.0000 62 KHSO4,aq 0.14549E-10 -10.8372 0.14549E-10 -10.8372 0.10000E+01 0.0000 63 KOH,aq 0.28151E-11 -11.5505 0.28151E-11 -11.5505 0.10000E+01 0.0000 64 KSO4- 0.53172E-05 -5.2743 0.43437E-05 -5.3621 0.81691E+00 -0.0878 65 MgCO3,aq 0.14747E-14 -14.8313 0.14747E-14 -14.8313 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31454E-11 -11.5023 0.25757E-11 -11.5891 0.81887E+00 -0.0868 67 MgCl+ 0.49625E-12 -12.3043 0.40636E-12 -12.3911 0.81887E+00 -0.0868 68 MgF+ 0.10940E-11 -11.9610 0.89582E-12 -12.0478 0.81887E+00 -0.0868 69 MgOH+ 0.10647E-14 -14.9728 0.87184E-15 -15.0596 0.81887E+00 -0.0868 71 MnF+ 0.72191E-11 -11.1415 0.59115E-11 -11.2283 0.81887E+00 -0.0868 72 MnO,aq 0.26389E-17 -17.5786 0.26389E-17 -17.5786 0.10000E+01 0.0000 73 MnOH+ 0.17298E-12 -12.7620 0.14165E-12 -12.8488 0.81887E+00 -0.0868 78 MnCl+ 0.44146E-10 -10.3551 0.36149E-10 -10.4419 0.81887E+00 -0.0868 79 MnSO4,aq 0.57424E-09 -9.2409 0.57424E-09 -9.2409 0.10000E+01 0.0000 80 NaCl,aq 0.40057E-04 -4.3973 0.40057E-04 -4.3973 0.10000E+01 0.0000 81 NaF,aq 0.16918E-05 -5.7716 0.16918E-05 -5.7716 0.10000E+01 0.0000 82 NaOH,aq 0.41439E-09 -9.3826 0.41439E-09 -9.3826 0.10000E+01 0.0000 84 OH- 0.38478E-07 -7.4148 0.31363E-07 -7.5036 0.81508E+00 -0.0888 91 H2PO3- 0.56042E-19 -19.2515 0.45782E-19 -19.3393 0.81691E+00 -0.0878 92 H3PO4,aq 0.25583E-09 -9.5921 0.25583E-09 -9.5921 0.10000E+01 0.0000 93 H2PO4- 0.44880E-07 -7.3479 0.36706E-07 -7.4353 0.81788E+00 -0.0873 94 PO4-3 0.23487E-16 -16.6292 0.48042E-17 -17.3184 0.20455E+00 -0.6892 96 H3P2O7- 0.73516E-18 -18.1336 0.60056E-18 -18.2214 0.81691E+00 -0.0878 97 H2P2O7-2 0.22165E-15 -15.6543 0.10587E-15 -15.9752 0.47767E+00 -0.3209 98 HP2O7-3 0.59699E-17 -17.2240 0.11500E-17 -17.9393 0.19264E+00 -0.7153 100 H2S,aq 0.21488E-01 -1.6678 0.20982E-01 -1.6781 0.97644E+00 -0.0104 101 S2-2 0.17221E-08 -8.7639 0.82260E-09 -9.0848 0.47767E+00 -0.3209 102 S3-2 0.13251E-07 -7.8778 0.63295E-08 -8.1986 0.47767E+00 -0.3209 103 S3- 0.15751E-05 -5.8027 0.12868E-05 -5.8905 0.81691E+00 -0.0878 104 S4-2 0.67349E-07 -7.1717 0.32171E-07 -7.4925 0.47767E+00 -0.3209 105 S5-2 0.22826E-06 -6.6416 0.10903E-06 -6.9624 0.47767E+00 -0.3209 106 SO2,aq 0.12835E-10 -10.8916 0.12835E-10 -10.8916 0.10000E+01 0.0000 107 SO3-2 0.22677E-11 -11.6444 0.11028E-11 -11.9575 0.48632E+00 -0.3131 108 HSO3- 0.15538E-08 -8.8086 0.12694E-08 -8.8964 0.81691E+00 -0.0878 109 HSO4- 0.49807E-04 -4.3027 0.40836E-04 -4.3890 0.81987E+00 -0.0863 111 S2O3-2 0.11919E-05 -5.9238 0.56935E-06 -6.2446 0.47767E+00 -0.3209 112 HS2O3- 0.22908E-08 -8.6400 0.18714E-08 -8.7278 0.81691E+00 -0.0878 113 H2S2O3,aq 0.55150E-12 -12.2585 0.55150E-12 -12.2585 0.10000E+01 0.0000 121 S4O6-2 0.13247E-13 -13.8779 0.63275E-14 -14.1988 0.47767E+00 -0.3209 Charge balance for all species = -.5993E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2233380E-04 0.1193677E+00 0.1195256E+03 0.0000 2 H2O 0.1000000E+01 0.5541049E+02 0.9916834E+06 0.0000 3 Cl- 0.8327340E-02 0.8367436E-02 0.2947033E+03 2.5683 4 SO4-- 0.4812753E-02 0.4870399E-02 0.4647869E+03 6.8339 5 HCO3- 0.2962702E-02 0.1007122E+00 0.6104835E+04 2.1202 6 HS- 0.4519985E-03 0.2194659E-01 0.7210528E+03 1.3030 7 Al+++ 0.7209974E-12 0.7708234E-09 0.2066144E-04 1.3488 8 H4SiO4 0.1020237E-02 0.1020316E-02 0.9742427E+02 -2.9913 9 Ca++ 0.1625290E-06 0.2264194E-06 0.9014864E-02 2.3584 10 Mg++ 0.8631900E-10 0.9105727E-10 0.2199251E-05 -0.9189 11 Fe++ 0.8473437E-13 0.8636327E-13 0.4791467E-08 -3.9264 12 K+ 0.1483420E-03 0.1536742E-03 0.5969522E+01 0.8199 13 Na+ 0.2175558E-01 0.2179734E-01 0.4978268E+03 2.9852 14 Mn++ 0.1824595E-08 0.2450375E-08 0.1337350E-03 0.4072 15 F- 0.4991345E-03 0.5520254E-03 0.1041853E+02 1.3449 16 HPO4-- 0.2259627E-09 0.4536166E-07 0.4325186E-02 -0.4944 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1177964E+00 0.1097011E+00 0.8095329E-02 0.0000000E+00 2 H2O 0.5089434E+02 0.5092325E+02 -.2890982E-01 0.0000000E+00 3 Cl- 0.7689825E-02 0.7689825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6096967E-02 0.4475985E-02 0.1620982E-02 0.0000000E+00 5 HCO3- 0.9255635E-01 0.9255635E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2503229E-01 0.2016932E-01 0.4862979E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.7084007E-09 0.4774644E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9376888E-03 0.1121533E-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 0.7936941E-13 0.3259219E-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- 0.5120960E-03 0.5073214E-03 0.4774644E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1940E-17 Mass of aqueous solution: 0.925091E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.2799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.4434E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6737 -0.172 76.38 0.2544 sulfur 0.6484E-02 -2.188 0.2079 -0.682 23.57 0.1006 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.4982E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.881991 g Volume = 0.355100 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: 1.2799900 moles log = 0.1072 Original solution: 1000.0103000 g Original solution / Rock added: 781.26 (Water/Rock Ratio), log = 2.8928 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 12.2541 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8815E-01 0.9293 0.1004E+01 0.1080E+01 CO2,gas 0.8625E+00 0.9662 0.1021E+02 0.1057E+02 CH4,gas 0.4474E-07 1.0111 0.5543E-06 0.5482E-06 H2,gas 0.3911E-06 1.0066 0.4823E-05 0.4792E-05 H2S,gas 0.4935E-01 0.9538 0.5768E+00 0.6047E+00 S2,gas 0.4380E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1074E-08 1.0000 0.1316E-07 0.1316E-07 SO3,gas 0.2409E-28 1.0000 0.2952E-27 0.2952E-27 SO2,gas 0.4530E-11 1.0000 0.5551E-10 0.5551E-10 HF,gas 0.1026E-07 1.0000 0.1257E-06 0.1257E-06 HCl,gas 0.3300E-11 1.0000 0.4043E-10 0.4043E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 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 0.28981E+04 0.002 2 CO2,gas -6.66 -7.35 -0.69 -0.230 0.11779E+04 1.009 3 CH4,gas 4.54 -3.41 -7.96 -1.989 0.13583E+05 -6.256 4 H2,gas 8.00 0.98 -7.02 -4.009 0.11979E+05 -5.317 5 H2S,gas -6.23 -8.17 -1.94 -0.969 0.33090E+04 -0.239 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.36 -9.58 -2.948 0.16357E+05 -7.881 8 SO3,gas 17.12 -12.11 -29.23 -7.307 0.49908E+05 -27.530 9 SO2,gas 0.83 -11.12 -11.95 -3.188 0.20412E+05 -10.256 10 HF,gas 0.47 -8.13 -8.60 -4.300 0.14684E+05 -6.901 11 HCl,gas 5.19 -6.90 -12.09 -6.046 0.20647E+05 -10.393 17 albite -0.38 -4.64 -4.25 -0.327 0.72606E+04 21 analcite 3.32 -1.65 -4.97 -0.552 0.84852E+04 25 anhydrite -5.32 -9.75 -4.43 -2.217 0.75698E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.35 -1.53 -0.254 0.26068E+04 69 diamond -3.10 -5.38 -2.28 -0.651 0.38887E+04 86 gibbsite 4.08 1.35 -2.73 -0.390 0.46670E+04 89 graphite -3.55 -5.38 -1.83 -0.524 0.31309E+04 101 kaolinite -1.33 -3.29 -1.95 -0.178 0.33349E+04 119 microcline -2.49 -6.80 -4.31 -0.332 0.73676E+04 149 pyrophyllite -6.18 -9.26 -3.09 -0.193 0.52727E+04 180 topaz-H 4.62 -0.30 -4.91 -0.447 0.83905E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.02 -4.70 -0.588 0.80260E+04 218 gypsum -4.96 -9.75 -4.80 -1.199 0.81905E+04 237 boehmite 4.41 1.35 -3.06 -0.510 0.52238E+04 240 fluorite -9.93 -13.89 -3.96 -1.321 0.67676E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.2799900 MOLES New total amount of reactant added: 1.3199900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.3199900 Water: Moles liquid = 0.5105E+02 kg liquid = 0.9197E+00 Moles total = 0.5093E+02 kg total = 0.9175E+00 Activity = 0.9978 Stoichiometric ionic strength = .8795608E-01 Osmotic coef. = 0.8752 True ionic strength = .2658723E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7926E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.22924E-04 -4.6397 0.18875E-04 -4.7241 0.82337E+00 -0.0844 2 H2O 0.99780E+00 -0.0010 0.99780E+00 -0.0010 3 Cl- 0.85767E-02 -2.0667 0.70090E-02 -2.1543 0.81721E+00 -0.0877 4 SO4-- 0.46754E-02 -2.3302 0.22428E-02 -2.6492 0.47970E+00 -0.3190 5 HCO3- 0.29737E-02 -2.5267 0.24346E-02 -2.6136 0.81870E+00 -0.0869 6 HS- 0.43631E-03 -3.3602 0.35663E-03 -3.4478 0.81736E+00 -0.0876 7 Al+++ 0.73627E-12 -12.1330 0.14216E-12 -12.8472 0.19308E+00 -0.7143 8 H4SiO4 0.10201E-02 -2.9913 0.10201E-02 -2.9913 0.10000E+01 0.0000 9 Ca++ 0.16339E-06 -6.7868 0.77659E-07 -7.1098 0.47530E+00 -0.3230 10 Mg++ 0.86195E-10 -10.0645 0.40735E-10 -10.3900 0.47259E+00 -0.3255 11 Fe++ 0.89948E-13 -13.0460 0.42567E-13 -13.3709 0.47324E+00 -0.3249 12 K+ 0.14837E-03 -3.8286 0.12151E-03 -3.9154 0.81894E+00 -0.0868 13 Na+ 0.21739E-01 -1.6628 0.17761E-01 -1.7505 0.81702E+00 -0.0878 14 Mn++ 0.18330E-08 -8.7368 0.86834E-09 -9.0613 0.47373E+00 -0.3245 15 F- 0.51321E-03 -3.2897 0.41833E-03 -3.3785 0.81513E+00 -0.0888 16 HPO4-- 0.21964E-09 -9.6583 0.10538E-09 -9.9772 0.47979E+00 -0.3189 17 SiF6-2 0.46477E-17 -17.3328 0.22236E-17 -17.6529 0.47844E+00 -0.3202 18 HSiO3- 0.61890E-07 -7.2084 0.50577E-07 -7.2960 0.81721E+00 -0.0877 19 Ca(HSiO3)+ 0.10920E-12 -12.9618 0.89451E-13 -13.0484 0.81916E+00 -0.0866 20 Mg(HSiO3)+ 0.71285E-16 -16.1470 0.58393E-16 -16.2336 0.81916E+00 -0.0866 21 NaHSiO3,aq 0.14529E-07 -7.8378 0.14529E-07 -7.8378 0.10000E+01 0.0000 22 AlO+ 0.66127E-10 -10.1796 0.54168E-10 -10.2663 0.81916E+00 -0.0866 23 AlOH+2 0.10734E-10 -10.9693 0.50910E-11 -11.2932 0.47430E+00 -0.3239 24 HAlO2,aq 0.57028E-09 -9.2439 0.57028E-09 -9.2439 0.10000E+01 0.0000 25 AlO2- 0.82024E-10 -10.0861 0.66881E-10 -10.1747 0.81538E+00 -0.0886 26 CH4,aq 0.38439E-09 -9.4152 0.37521E-09 -9.4257 0.97613E+00 -0.0105 31 CO,aq 0.90243E-11 -11.0446 0.90243E-11 -11.0446 0.10000E+01 0.0000 32 CO2,aq 0.10081E+00 -0.9965 0.98404E-01 -1.0070 0.97613E+00 -0.0105 33 CO3-2 0.23548E-07 -7.6280 0.11266E-07 -7.9482 0.47844E+00 -0.3202 34 CaCO3,aq 0.10971E-10 -10.9598 0.10971E-10 -10.9598 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.58916E-08 -8.2298 0.48261E-08 -8.3164 0.81916E+00 -0.0866 36 CaCl+ 0.10753E-08 -8.9685 0.88087E-09 -9.0551 0.81916E+00 -0.0866 37 CaCl2,aq 0.14668E-11 -11.8336 0.14668E-11 -11.8336 0.10000E+01 0.0000 38 CaF+ 0.57903E-09 -9.2373 0.47432E-09 -9.3239 0.81916E+00 -0.0866 39 CaOH+ 0.35719E-12 -12.4471 0.29259E-12 -12.5337 0.81916E+00 -0.0866 40 CaSO4,aq 0.55308E-07 -7.2572 0.55308E-07 -7.2572 0.10000E+01 0.0000 41 HCl,aq 0.24242E-07 -7.6154 0.24242E-07 -7.6154 0.10000E+01 0.0000 45 HF,aq 0.54053E-04 -4.2672 0.54053E-04 -4.2672 0.10000E+01 0.0000 46 HF2- 0.93421E-08 -8.0296 0.76345E-08 -8.1172 0.81721E+00 -0.0877 48 FeCl+ 0.57650E-15 -15.2392 0.47224E-15 -15.3258 0.81916E+00 -0.0866 51 FeF+ 0.11109E-14 -14.9543 0.90998E-15 -15.0410 0.81916E+00 -0.0866 54 FeOH+ 0.89421E-16 -16.0486 0.73249E-16 -16.1352 0.81916E+00 -0.0866 60 H2,aq 0.37317E-08 -8.4281 0.36426E-08 -8.4386 0.97613E+00 -0.0105 61 KCl,aq 0.15435E-07 -7.8115 0.15435E-07 -7.8115 0.10000E+01 0.0000 62 KHSO4,aq 0.14543E-10 -10.8373 0.14543E-10 -10.8373 0.10000E+01 0.0000 63 KOH,aq 0.27432E-11 -11.5617 0.27432E-11 -11.5617 0.10000E+01 0.0000 64 KSO4- 0.51747E-05 -5.2861 0.42288E-05 -5.3738 0.81721E+00 -0.0877 65 MgCO3,aq 0.14424E-14 -14.8409 0.14424E-14 -14.8409 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31578E-11 -11.5006 0.25867E-11 -11.5873 0.81916E+00 -0.0866 67 MgCl+ 0.51123E-12 -12.2914 0.41878E-12 -12.3780 0.81916E+00 -0.0866 68 MgF+ 0.11251E-11 -11.9488 0.92163E-12 -12.0354 0.81916E+00 -0.0866 69 MgOH+ 0.10367E-14 -14.9843 0.84926E-15 -15.0710 0.81916E+00 -0.0866 71 MnF+ 0.74693E-11 -11.1267 0.61185E-11 -11.2134 0.81916E+00 -0.0866 72 MnO,aq 0.25186E-17 -17.5988 0.25186E-17 -17.5988 0.10000E+01 0.0000 73 MnOH+ 0.16945E-12 -12.7709 0.13881E-12 -12.8576 0.81916E+00 -0.0866 78 MnCl+ 0.45752E-10 -10.3396 0.37478E-10 -10.4262 0.81916E+00 -0.0866 79 MnSO4,aq 0.56223E-09 -9.2501 0.56223E-09 -9.2501 0.10000E+01 0.0000 80 NaCl,aq 0.41255E-04 -4.3845 0.41255E-04 -4.3845 0.10000E+01 0.0000 81 NaF,aq 0.17395E-05 -5.7596 0.17395E-05 -5.7596 0.10000E+01 0.0000 82 NaOH,aq 0.40340E-09 -9.3943 0.40340E-09 -9.3943 0.10000E+01 0.0000 84 OH- 0.37459E-07 -7.4264 0.30544E-07 -7.5151 0.81538E+00 -0.0886 91 H2PO3- 0.55527E-19 -19.2555 0.45377E-19 -19.3432 0.81721E+00 -0.0877 92 H3PO4,aq 0.26257E-09 -9.5808 0.26257E-09 -9.5808 0.10000E+01 0.0000 93 H2PO4- 0.44847E-07 -7.3483 0.36693E-07 -7.4354 0.81818E+00 -0.0872 94 PO4-3 0.22193E-16 -16.6538 0.45553E-17 -17.3415 0.20525E+00 -0.6877 96 H3P2O7- 0.75402E-18 -18.1226 0.61619E-18 -18.2103 0.81721E+00 -0.0877 97 H2P2O7-2 0.22113E-15 -15.6553 0.10580E-15 -15.9755 0.47844E+00 -0.3202 98 HP2O7-3 0.57887E-17 -17.2374 0.11193E-17 -17.9511 0.19335E+00 -0.7137 100 H2S,aq 0.21312E-01 -1.6714 0.20804E-01 -1.6819 0.97613E+00 -0.0105 101 S2-2 0.16170E-08 -8.7913 0.77365E-09 -9.1115 0.47844E+00 -0.3202 102 S3-2 0.12442E-07 -7.9051 0.59528E-08 -8.2253 0.47844E+00 -0.3202 103 S3- 0.15270E-05 -5.8162 0.12479E-05 -5.9038 0.81721E+00 -0.0877 104 S4-2 0.63240E-07 -7.1990 0.30256E-07 -7.5192 0.47844E+00 -0.3202 105 S5-2 0.21433E-06 -6.6689 0.10254E-06 -6.9891 0.47844E+00 -0.3202 106 SO2,aq 0.13055E-10 -10.8842 0.13055E-10 -10.8842 0.10000E+01 0.0000 107 SO3-2 0.21845E-11 -11.6606 0.10640E-11 -11.9731 0.48706E+00 -0.3124 108 HSO3- 0.15386E-08 -8.8129 0.12574E-08 -8.9005 0.81721E+00 -0.0877 109 HSO4- 0.49742E-04 -4.3033 0.40796E-04 -4.3894 0.82016E+00 -0.0861 111 S2O3-2 0.11481E-05 -5.9400 0.54929E-06 -6.2602 0.47844E+00 -0.3202 112 HS2O3- 0.22684E-08 -8.6443 0.18538E-08 -8.7319 0.81721E+00 -0.0877 113 H2S2O3,aq 0.56092E-12 -12.2511 0.56092E-12 -12.2511 0.10000E+01 0.0000 121 S4O6-2 0.13089E-13 -13.8831 0.62622E-14 -14.2033 0.47844E+00 -0.3202 Charge balance for all species = -.5989E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2292379E-04 0.1222554E+00 0.1224020E+03 0.0000 2 H2O 0.1000000E+01 0.5540743E+02 0.9915061E+06 0.0000 3 Cl- 0.8576706E-02 0.8618001E-02 0.3034907E+03 2.5698 4 SO4-- 0.4675384E-02 0.4732729E-02 0.4515931E+03 6.7990 5 HCO3- 0.2973698E-02 0.1037840E+00 0.6290260E+04 2.1105 6 HS- 0.4363133E-03 0.2175445E-01 0.7146516E+03 1.2763 7 Al+++ 0.7362681E-12 0.7298986E-09 0.1956205E-04 1.3251 8 H4SiO4 0.1020132E-02 0.1020208E-02 0.9740193E+02 -2.9913 9 Ca++ 0.1633887E-06 0.2262558E-06 0.9007237E-02 2.3384 10 Mg++ 0.8619483E-10 0.9099148E-10 0.2197391E-05 -0.9418 11 Fe++ 0.8994827E-13 0.9172507E-13 0.5088312E-08 -3.9227 12 K+ 0.1483731E-03 0.1535632E-03 0.5964472E+01 0.8087 13 Na+ 0.2173858E-01 0.2178159E-01 0.4974056E+03 2.9736 14 Mn++ 0.1832984E-08 0.2448605E-08 0.1336218E-03 0.3869 15 F- 0.5132119E-03 0.5690239E-03 0.1073802E+02 1.3456 16 HPO4-- 0.2196416E-09 0.4532889E-07 0.4321526E-02 -0.5290 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1221034E+00 0.1124362E+00 0.9667211E-02 0.0000000E+00 2 H2O 0.5092708E+02 0.5095725E+02 -.3016617E-01 0.0000000E+00 3 Cl- 0.7925825E-02 0.7925825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6287967E-02 0.4352609E-02 0.1935359E-02 0.0000000E+00 5 HCO3- 0.9544835E-01 0.9544835E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2581329E-01 0.2000719E-01 0.5806109E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.6712750E-09 0.4774681E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9382675E-03 0.1121475E-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 0.8435795E-13 0.3259219E-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- 0.5280960E-03 0.5233213E-03 0.4774681E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.3083E-18 Mass of aqueous solution: 0.925874E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.3199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.4240E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6736 -0.172 73.04 0.2544 sulfur 0.7741E-02 -2.111 0.2482 -0.605 26.91 0.1201 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.4764E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.922272 g Volume = 0.374591 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: 1.3199900 moles log = 0.1206 Original solution: 1000.0103000 g Original solution / Rock added: 757.59 (Water/Rock Ratio), log = 2.8794 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 12.5896 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8593E-01 0.9278 0.1004E+01 0.1082E+01 CO2,gas 0.8664E+00 0.9652 0.1053E+02 0.1091E+02 CH4,gas 0.4338E-07 1.0113 0.5523E-06 0.5461E-06 H2,gas 0.3773E-06 1.0067 0.4782E-05 0.4750E-05 H2S,gas 0.4768E-01 0.9526 0.5719E+00 0.6003E+00 S2,gas 0.4263E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1068E-08 1.0000 0.1345E-07 0.1345E-07 SO3,gas 0.2405E-28 1.0000 0.3028E-27 0.3028E-27 SO2,gas 0.4484E-11 1.0000 0.5646E-10 0.5646E-10 HF,gas 0.1054E-07 1.0000 0.1327E-06 0.1327E-06 HCl,gas 0.3398E-11 1.0000 0.4278E-10 0.4278E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 -0.30331E-11 214 topaz -16.55 -16.55 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 0.28982E+04 0.002 2 CO2,gas -6.66 -7.34 -0.68 -0.226 0.11553E+04 1.022 3 CH4,gas 4.54 -3.41 -7.96 -1.989 0.13586E+05 -6.258 4 H2,gas 8.00 0.98 -7.02 -4.011 0.11985E+05 -5.320 5 H2S,gas -6.23 -8.17 -1.94 -0.971 0.33153E+04 -0.243 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.36 -9.57 -2.945 0.16341E+05 -7.871 8 SO3,gas 17.12 -12.10 -29.22 -7.304 0.49889E+05 -27.519 9 SO2,gas 0.83 -11.12 -11.95 -3.186 0.20400E+05 -10.248 10 HF,gas 0.47 -8.10 -8.58 -4.288 0.14643E+05 -6.877 11 HCl,gas 5.19 -6.88 -12.07 -6.034 0.20605E+05 -10.369 17 albite -0.38 -4.67 -4.29 -0.330 0.73210E+04 25 anhydrite -5.32 -9.76 -4.44 -2.221 0.75850E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.32 -1.55 -0.258 0.26474E+04 69 diamond -3.10 -5.37 -2.27 -0.649 0.38787E+04 86 gibbsite 4.08 1.32 -2.76 -0.394 0.47075E+04 89 graphite -3.55 -5.37 -1.83 -0.522 0.31209E+04 101 kaolinite -1.33 -3.33 -2.00 -0.182 0.34159E+04 119 microcline -2.49 -6.84 -4.35 -0.335 0.74273E+04 149 pyrophyllite -6.18 -9.31 -3.14 -0.196 0.53537E+04 180 topaz-H 4.62 -0.34 -4.96 -0.451 0.84715E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.04 -4.72 -0.590 0.80639E+04 218 gypsum -4.96 -9.76 -4.81 -1.201 0.82058E+04 237 boehmite 4.41 1.32 -3.08 -0.514 0.52643E+04 240 fluorite -9.93 -13.87 -3.94 -1.312 0.67207E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.3199900 MOLES New total amount of reactant added: 1.3599900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.3599900 Water: Moles liquid = 0.5109E+02 kg liquid = 0.9203E+00 Moles total = 0.5096E+02 kg total = 0.9181E+00 Activity = 0.9978 Stoichiometric ionic strength = .8925646E-01 Osmotic coef. = 0.8758 True ionic strength = .2643501E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8162E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.23532E-04 -4.6283 0.19382E-04 -4.7126 0.82364E+00 -0.0843 2 H2O 0.99775E+00 -0.0010 0.99775E+00 -0.0010 3 Cl- 0.88257E-02 -2.0543 0.72151E-02 -2.1418 0.81751E+00 -0.0875 4 SO4-- 0.45395E-02 -2.3430 0.21811E-02 -2.6613 0.48046E+00 -0.3183 5 HCO3- 0.29816E-02 -2.5255 0.24419E-02 -2.6123 0.81899E+00 -0.0867 6 HS- 0.42117E-03 -3.3755 0.34437E-03 -3.4630 0.81766E+00 -0.0874 7 Al+++ 0.75280E-12 -12.1233 0.14589E-12 -12.8360 0.19380E+00 -0.7126 8 H4SiO4 0.10200E-02 -2.9914 0.10200E-02 -2.9914 0.10000E+01 0.0000 9 Ca++ 0.16426E-06 -6.7845 0.78199E-07 -7.1068 0.47607E+00 -0.3223 10 Mg++ 0.86074E-10 -10.0651 0.40745E-10 -10.3899 0.47337E+00 -0.3248 11 Fe++ 0.95495E-13 -13.0200 0.45266E-13 -13.3442 0.47401E+00 -0.3242 12 K+ 0.14840E-03 -3.8286 0.12158E-03 -3.9152 0.81922E+00 -0.0866 13 Na+ 0.21722E-01 -1.6631 0.17753E-01 -1.7507 0.81731E+00 -0.0876 14 Mn++ 0.18414E-08 -8.7348 0.87375E-09 -9.0586 0.47450E+00 -0.3238 15 F- 0.52716E-03 -3.2781 0.42986E-03 -3.3667 0.81543E+00 -0.0886 16 HPO4-- 0.21347E-09 -9.6707 0.10258E-09 -9.9889 0.48055E+00 -0.3183 17 SiF6-2 0.60740E-17 -17.2165 0.29106E-17 -17.5360 0.47920E+00 -0.3195 18 HSiO3- 0.60246E-07 -7.2201 0.49252E-07 -7.3076 0.81751E+00 -0.0875 19 Ca(HSiO3)+ 0.10704E-12 -12.9705 0.87711E-13 -13.0569 0.81944E+00 -0.0865 20 Mg(HSiO3)+ 0.69408E-16 -16.1586 0.56876E-16 -16.2451 0.81944E+00 -0.0865 21 NaHSiO3,aq 0.14142E-07 -7.8495 0.14142E-07 -7.8495 0.10000E+01 0.0000 22 AlO+ 0.64331E-10 -10.1916 0.52716E-10 -10.2781 0.81944E+00 -0.0865 23 AlOH+2 0.10709E-10 -10.9703 0.50876E-11 -11.2935 0.47508E+00 -0.3232 24 HAlO2,aq 0.54044E-09 -9.2673 0.54044E-09 -9.2673 0.10000E+01 0.0000 25 AlO2- 0.75670E-10 -10.1211 0.61723E-10 -10.2096 0.81569E+00 -0.0885 26 CH4,aq 0.38294E-09 -9.4169 0.37368E-09 -9.4275 0.97583E+00 -0.0106 31 CO,aq 0.92176E-11 -11.0354 0.92176E-11 -11.0354 0.10000E+01 0.0000 32 CO2,aq 0.10387E+00 -0.9835 0.10136E+00 -0.9941 0.97583E+00 -0.0106 33 CO3-2 0.22965E-07 -7.6389 0.11005E-07 -7.9584 0.47920E+00 -0.3195 34 CaCO3,aq 0.10790E-10 -10.9670 0.10790E-10 -10.9670 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.59483E-08 -8.2256 0.48743E-08 -8.3121 0.81944E+00 -0.0865 36 CaCl+ 0.11143E-08 -8.9530 0.91307E-09 -9.0395 0.81944E+00 -0.0865 37 CaCl2,aq 0.15651E-11 -11.8054 0.15651E-11 -11.8054 0.10000E+01 0.0000 38 CaF+ 0.59891E-09 -9.2226 0.49077E-09 -9.3091 0.81944E+00 -0.0865 39 CaOH+ 0.35012E-12 -12.4558 0.28690E-12 -12.5423 0.81944E+00 -0.0865 40 CaSO4,aq 0.54160E-07 -7.2663 0.54160E-07 -7.2663 0.10000E+01 0.0000 41 HCl,aq 0.25625E-07 -7.5913 0.25625E-07 -7.5913 0.10000E+01 0.0000 45 HF,aq 0.57035E-04 -4.2439 0.57035E-04 -4.2439 0.10000E+01 0.0000 46 HF2- 0.10125E-07 -7.9946 0.82775E-08 -8.0821 0.81751E+00 -0.0875 48 FeCl+ 0.63085E-15 -15.2001 0.51695E-15 -15.2866 0.81944E+00 -0.0865 51 FeF+ 0.12134E-14 -14.9160 0.99433E-15 -15.0025 0.81944E+00 -0.0865 54 FeOH+ 0.92564E-16 -16.0336 0.75851E-16 -16.1200 0.81944E+00 -0.0865 60 H2,aq 0.37015E-08 -8.4316 0.36120E-08 -8.4423 0.97583E+00 -0.0106 61 KCl,aq 0.15898E-07 -7.7987 0.15898E-07 -7.7987 0.10000E+01 0.0000 62 KHSO4,aq 0.14531E-10 -10.8377 0.14531E-10 -10.8377 0.10000E+01 0.0000 63 KOH,aq 0.26728E-11 -11.5730 0.26728E-11 -11.5730 0.10000E+01 0.0000 64 KSO4- 0.50333E-05 -5.2982 0.41147E-05 -5.3857 0.81751E+00 -0.0875 65 MgCO3,aq 0.14093E-14 -14.8510 0.14093E-14 -14.8510 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31670E-11 -11.4994 0.25952E-11 -11.5858 0.81944E+00 -0.0865 67 MgCl+ 0.52620E-12 -12.2788 0.43119E-12 -12.3653 0.81944E+00 -0.0865 68 MgF+ 0.11560E-11 -11.9371 0.94725E-12 -12.0235 0.81944E+00 -0.0865 69 MgOH+ 0.10095E-14 -14.9959 0.82719E-15 -15.0824 0.81944E+00 -0.0865 71 MnF+ 0.77202E-11 -11.1124 0.63263E-11 -11.1988 0.81944E+00 -0.0865 72 MnO,aq 0.24033E-17 -17.6192 0.24033E-17 -17.6192 0.10000E+01 0.0000 73 MnOH+ 0.16598E-12 -12.7799 0.13601E-12 -12.8664 0.81944E+00 -0.0865 78 MnCl+ 0.47375E-10 -10.3245 0.38821E-10 -10.4109 0.81944E+00 -0.0865 79 MnSO4,aq 0.55017E-09 -9.2595 0.55017E-09 -9.2595 0.10000E+01 0.0000 80 NaCl,aq 0.42450E-04 -4.3721 0.42450E-04 -4.3721 0.10000E+01 0.0000 81 NaF,aq 0.17867E-05 -5.7480 0.17867E-05 -5.7480 0.10000E+01 0.0000 82 NaOH,aq 0.39266E-09 -9.4060 0.39266E-09 -9.4060 0.10000E+01 0.0000 84 OH- 0.36464E-07 -7.4381 0.29743E-07 -7.5266 0.81569E+00 -0.0885 91 H2PO3- 0.55021E-19 -19.2595 0.44980E-19 -19.3470 0.81751E+00 -0.0875 92 H3PO4,aq 0.26952E-09 -9.5694 0.26952E-09 -9.5694 0.10000E+01 0.0000 93 H2PO4- 0.44813E-07 -7.3486 0.36678E-07 -7.4356 0.81847E+00 -0.0870 94 PO4-3 0.20967E-16 -16.6785 0.43183E-17 -17.3647 0.20596E+00 -0.6862 96 H3P2O7- 0.77343E-18 -18.1116 0.63229E-18 -18.1991 0.81751E+00 -0.0875 97 H2P2O7-2 0.22062E-15 -15.6564 0.10572E-15 -15.9758 0.47920E+00 -0.3195 98 HP2O7-3 0.56124E-17 -17.2509 0.10892E-17 -17.9629 0.19407E+00 -0.7121 100 H2S,aq 0.21140E-01 -1.6749 0.20629E-01 -1.6855 0.97583E+00 -0.0106 101 S2-2 0.15182E-08 -8.8187 0.72752E-09 -9.1382 0.47920E+00 -0.3195 102 S3-2 0.11682E-07 -7.9325 0.55979E-08 -8.2520 0.47920E+00 -0.3195 103 S3- 0.14802E-05 -5.8297 0.12101E-05 -5.9172 0.81751E+00 -0.0875 104 S4-2 0.59375E-07 -7.2264 0.28452E-07 -7.5459 0.47920E+00 -0.3195 105 S5-2 0.20123E-06 -6.6963 0.96430E-07 -7.0158 0.47920E+00 -0.3195 106 SO2,aq 0.13276E-10 -10.8769 0.13276E-10 -10.8769 0.10000E+01 0.0000 107 SO3-2 0.21035E-11 -11.6771 0.10261E-11 -11.9888 0.48779E+00 -0.3118 108 HSO3- 0.15231E-08 -8.8173 0.12452E-08 -8.9048 0.81751E+00 -0.0875 109 HSO4- 0.49655E-04 -4.3040 0.40739E-04 -4.3900 0.82044E+00 -0.0860 111 S2O3-2 0.11054E-05 -5.9565 0.52971E-06 -6.2760 0.47920E+00 -0.3195 112 HS2O3- 0.22455E-08 -8.6487 0.18357E-08 -8.7362 0.81751E+00 -0.0875 113 H2S2O3,aq 0.57039E-12 -12.2438 0.57039E-12 -12.2438 0.10000E+01 0.0000 121 S4O6-2 0.12924E-13 -13.8886 0.61929E-14 -14.2081 0.47920E+00 -0.3195 Charge balance for all species = -.5984E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2353198E-04 0.1251456E+00 0.1252802E+03 0.0000 2 H2O 0.1000000E+01 0.5540437E+02 0.9913288E+06 0.0000 3 Cl- 0.8825712E-02 0.8868204E-02 0.3122632E+03 2.5708 4 SO4-- 0.4539549E-02 0.4596577E-02 0.4385474E+03 6.7639 5 HCO3- 0.2981629E-02 0.1068514E+00 0.6475370E+04 2.1003 6 HS- 0.4211727E-03 0.2156654E-01 0.7083910E+03 1.2496 7 Al+++ 0.7528024E-12 0.6919005E-09 0.1854137E-04 1.3018 8 H4SiO4 0.1020026E-02 0.1020100E-02 0.9737959E+02 -2.9914 9 Ca++ 0.1642583E-06 0.2260924E-06 0.8999621E-02 2.3184 10 Mg++ 0.8607416E-10 0.9092579E-10 0.2195533E-05 -0.9647 11 Fe++ 0.9549455E-13 0.9743140E-13 0.5404194E-08 -3.9190 12 K+ 0.1484032E-03 0.1534523E-03 0.5959429E+01 0.7975 13 Na+ 0.2172162E-01 0.2176587E-01 0.4969850E+03 2.9619 14 Mn++ 0.1841410E-08 0.2446837E-08 0.1335088E-03 0.3666 15 F- 0.5271555E-03 0.5859978E-03 0.1105697E+02 1.3459 16 HPO4-- 0.2134743E-09 0.4529617E-07 0.4317872E-02 -0.5637 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1264104E+00 0.1151774E+00 0.1123302E-01 0.0000000E+00 2 H2O 0.5095983E+02 0.5099125E+02 -.3141766E-01 0.0000000E+00 3 Cl- 0.8161825E-02 0.8161825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6478967E-02 0.4230446E-02 0.2248521E-02 0.0000000E+00 5 HCO3- 0.9834035E-01 0.9834035E-01 0.0000000E+00 0.0000000E+00 6 HS- 0.2659429E-01 0.1984870E-01 0.6745596E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.6367886E-09 0.4774715E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9388461E-03 0.1121417E-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 0.8967070E-13 0.3259218E-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- 0.5440960E-03 0.5393213E-03 0.4774715E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.9360E-18 Mass of aqueous solution: 0.926658E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.3599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.4063E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6736 -0.172 69.99 0.2544 sulfur 0.8994E-02 -2.046 0.2883 -0.540 29.96 0.1395 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.4565E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.962397 g Volume = 0.394007 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: 1.3599900 moles log = 0.1335 Original solution: 1000.0103000 g Original solution / Rock added: 735.31 (Water/Rock Ratio), log = 2.8665 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 12.9255 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8382E-01 0.9264 0.1004E+01 0.1083E+01 CO2,gas 0.8701E+00 0.9643 0.1084E+02 0.1125E+02 CH4,gas 0.4207E-07 1.0115 0.5500E-06 0.5438E-06 H2,gas 0.3644E-06 1.0069 0.4742E-05 0.4710E-05 H2S,gas 0.4611E-01 0.9514 0.5671E+00 0.5961E+00 S2,gas 0.4153E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1063E-08 1.0000 0.1374E-07 0.1374E-07 SO3,gas 0.2402E-28 1.0000 0.3105E-27 0.3105E-27 SO2,gas 0.4442E-11 1.0000 0.5741E-10 0.5741E-10 HF,gas 0.1083E-07 1.0000 0.1400E-06 0.1400E-06 HCl,gas 0.3498E-11 1.0000 0.4522E-10 0.4522E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 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 0.28982E+04 0.002 2 CO2,gas -6.66 -7.32 -0.66 -0.221 0.11334E+04 1.035 3 CH4,gas 4.54 -3.41 -7.96 -1.990 0.13589E+05 -6.260 4 H2,gas 8.00 0.98 -7.02 -4.013 0.11992E+05 -5.324 5 H2S,gas -6.23 -8.18 -1.95 -0.973 0.33216E+04 -0.246 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.35 -9.56 -2.942 0.16325E+05 -7.862 8 SO3,gas 17.12 -12.09 -29.21 -7.302 0.49870E+05 -27.508 9 SO2,gas 0.83 -11.11 -11.94 -3.184 0.20387E+05 -10.241 10 HF,gas 0.47 -8.08 -8.55 -4.276 0.14604E+05 -6.854 11 HCl,gas 5.19 -6.85 -12.04 -6.022 0.20564E+05 -10.345 17 albite -0.38 -4.71 -4.32 -0.333 0.73808E+04 25 anhydrite -5.32 -9.77 -4.45 -2.226 0.76005E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.30 -1.57 -0.262 0.26872E+04 69 diamond -3.10 -5.37 -2.27 -0.647 0.38692E+04 86 gibbsite 4.08 1.30 -2.78 -0.397 0.47474E+04 89 graphite -3.55 -5.37 -1.82 -0.521 0.31114E+04 101 kaolinite -1.33 -3.38 -2.05 -0.186 0.34957E+04 119 microcline -2.49 -6.87 -4.38 -0.337 0.74864E+04 149 pyrophyllite -6.18 -9.36 -3.18 -0.199 0.54334E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.06 -4.74 -0.593 0.81018E+04 218 gypsum -4.96 -9.77 -4.81 -1.204 0.82214E+04 237 boehmite 4.41 1.30 -3.11 -0.518 0.53041E+04 240 fluorite -9.93 -13.84 -3.91 -1.303 0.66752E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.3599900 MOLES New total amount of reactant added: 1.3999900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.3999900 Water: Moles liquid = 0.5112E+02 kg liquid = 0.9210E+00 Moles total = 0.5099E+02 kg total = 0.9186E+00 Activity = 0.9977 Stoichiometric ionic strength = .9055963E-01 Osmotic coef. = 0.8765 True ionic strength = .2628434E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8398E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.24159E-04 -4.6169 0.19905E-04 -4.7010 0.82391E+00 -0.0841 2 H2O 0.99770E+00 -0.0010 0.99770E+00 -0.0010 3 Cl- 0.90744E-02 -2.0422 0.74210E-02 -2.1295 0.81780E+00 -0.0874 4 SO4-- 0.44052E-02 -2.3560 0.21199E-02 -2.6737 0.48121E+00 -0.3177 5 HCO3- 0.29866E-02 -2.5248 0.24468E-02 -2.6114 0.81928E+00 -0.0866 6 HS- 0.40655E-03 -3.3909 0.33254E-03 -3.4782 0.81795E+00 -0.0873 7 Al+++ 0.77065E-12 -12.1131 0.14990E-12 -12.8242 0.19451E+00 -0.7111 8 H4SiO4 0.10199E-02 -2.9914 0.10199E-02 -2.9914 0.10000E+01 0.0000 9 Ca++ 0.16514E-06 -6.7822 0.78744E-07 -7.1038 0.47684E+00 -0.3216 10 Mg++ 0.85957E-10 -10.0657 0.40756E-10 -10.3898 0.47414E+00 -0.3241 11 Fe++ 0.10140E-12 -12.9940 0.48142E-13 -13.3175 0.47479E+00 -0.3235 12 K+ 0.14843E-03 -3.8285 0.12164E-03 -3.9149 0.81951E+00 -0.0864 13 Na+ 0.21705E-01 -1.6634 0.17746E-01 -1.7509 0.81761E+00 -0.0875 14 Mn++ 0.18499E-08 -8.7329 0.87919E-09 -9.0559 0.47527E+00 -0.3231 15 F- 0.54096E-03 -3.2668 0.44128E-03 -3.3553 0.81573E+00 -0.0885 16 HPO4-- 0.20745E-09 -9.6831 0.99848E-10 -10.0007 0.48130E+00 -0.3176 17 SiF6-2 0.78965E-17 -17.1026 0.37899E-17 -17.4214 0.47995E+00 -0.3188 18 HSiO3- 0.58638E-07 -7.2318 0.47954E-07 -7.3192 0.81780E+00 -0.0874 19 Ca(HSiO3)+ 0.10491E-12 -12.9792 0.85996E-13 -13.0655 0.81973E+00 -0.0863 20 Mg(HSiO3)+ 0.67575E-16 -16.1702 0.55393E-16 -16.2565 0.81973E+00 -0.0863 21 NaHSiO3,aq 0.13764E-07 -7.8613 0.13764E-07 -7.8613 0.10000E+01 0.0000 22 AlO+ 0.62645E-10 -10.2031 0.51352E-10 -10.2894 0.81973E+00 -0.0863 23 AlOH+2 0.10696E-10 -10.9708 0.50897E-11 -11.2933 0.47584E+00 -0.3225 24 HAlO2,aq 0.51259E-09 -9.2902 0.51259E-09 -9.2902 0.10000E+01 0.0000 25 AlO2- 0.69858E-10 -10.1558 0.57003E-10 -10.2441 0.81599E+00 -0.0883 26 CH4,aq 0.38133E-09 -9.4187 0.37199E-09 -9.4295 0.97552E+00 -0.0108 31 CO,aq 0.94078E-11 -11.0265 0.94078E-11 -11.0265 0.10000E+01 0.0000 32 CO2,aq 0.10693E+00 -0.9709 0.10431E+00 -0.9817 0.97552E+00 -0.0108 33 CO3-2 0.22371E-07 -7.6503 0.10737E-07 -7.9691 0.47995E+00 -0.3188 34 CaCO3,aq 0.10601E-10 -10.9746 0.10601E-10 -10.9746 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.59998E-08 -8.2219 0.49182E-08 -8.3082 0.81973E+00 -0.0863 36 CaCl+ 0.11536E-08 -8.9379 0.94568E-09 -9.0243 0.81973E+00 -0.0863 37 CaCl2,aq 0.16673E-11 -11.7780 0.16673E-11 -11.7780 0.10000E+01 0.0000 38 CaF+ 0.61889E-09 -9.2084 0.50732E-09 -9.2947 0.81973E+00 -0.0863 39 CaOH+ 0.34315E-12 -12.4645 0.28129E-12 -12.5508 0.81973E+00 -0.0863 40 CaSO4,aq 0.53007E-07 -7.2757 0.53007E-07 -7.2757 0.10000E+01 0.0000 41 HCl,aq 0.27068E-07 -7.5675 0.27068E-07 -7.5675 0.10000E+01 0.0000 45 HF,aq 0.60131E-04 -4.2209 0.60131E-04 -4.2209 0.10000E+01 0.0000 46 HF2- 0.10955E-07 -7.9604 0.89587E-08 -8.0478 0.81780E+00 -0.0874 48 FeCl+ 0.68985E-15 -15.1612 0.56549E-15 -15.2476 0.81973E+00 -0.0863 51 FeF+ 0.13244E-14 -14.8780 0.10856E-14 -14.9643 0.81973E+00 -0.0863 54 FeOH+ 0.95821E-16 -16.0185 0.78547E-16 -16.1049 0.81973E+00 -0.0863 60 H2,aq 0.36719E-08 -8.4351 0.35820E-08 -8.4459 0.97552E+00 -0.0108 61 KCl,aq 0.16361E-07 -7.7862 0.16361E-07 -7.7862 0.10000E+01 0.0000 62 KHSO4,aq 0.14512E-10 -10.8383 0.14512E-10 -10.8383 0.10000E+01 0.0000 63 KOH,aq 0.26038E-11 -11.5844 0.26038E-11 -11.5844 0.10000E+01 0.0000 64 KSO4- 0.48929E-05 -5.3104 0.40014E-05 -5.3978 0.81780E+00 -0.0874 65 MgCO3,aq 0.13754E-14 -14.8616 0.13754E-14 -14.8616 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31731E-11 -11.4985 0.26011E-11 -11.5848 0.81973E+00 -0.0863 67 MgCl+ 0.54118E-12 -12.2667 0.44362E-12 -12.3530 0.81973E+00 -0.0863 68 MgF+ 0.11866E-11 -11.9257 0.97268E-12 -12.0120 0.81973E+00 -0.0863 69 MgOH+ 0.98279E-15 -15.0075 0.80562E-15 -15.0939 0.81973E+00 -0.0863 71 MnF+ 0.79719E-11 -11.0984 0.65348E-11 -11.1848 0.81973E+00 -0.0863 72 MnO,aq 0.22927E-17 -17.6396 0.22927E-17 -17.6396 0.10000E+01 0.0000 73 MnOH+ 0.16256E-12 -12.7890 0.13326E-12 -12.8753 0.81973E+00 -0.0863 78 MnCl+ 0.49013E-10 -10.3097 0.40177E-10 -10.3960 0.81973E+00 -0.0863 79 MnSO4,aq 0.53805E-09 -9.2692 0.53805E-09 -9.2692 0.10000E+01 0.0000 80 NaCl,aq 0.43643E-04 -4.3601 0.43643E-04 -4.3601 0.10000E+01 0.0000 81 NaF,aq 0.18334E-05 -5.7368 0.18334E-05 -5.7368 0.10000E+01 0.0000 82 NaOH,aq 0.38216E-09 -9.4178 0.38216E-09 -9.4178 0.10000E+01 0.0000 84 OH- 0.35490E-07 -7.4499 0.28960E-07 -7.5382 0.81599E+00 -0.0883 91 H2PO3- 0.54526E-19 -19.2634 0.44591E-19 -19.3507 0.81780E+00 -0.0874 92 H3PO4,aq 0.27669E-09 -9.5580 0.27669E-09 -9.5580 0.10000E+01 0.0000 93 H2PO4- 0.44779E-07 -7.3489 0.36663E-07 -7.4358 0.81876E+00 -0.0868 94 PO4-3 0.19804E-16 -16.7033 0.40927E-17 -17.3880 0.20666E+00 -0.6847 96 H3P2O7- 0.79343E-18 -18.1005 0.64887E-18 -18.1878 0.81780E+00 -0.0874 97 H2P2O7-2 0.22011E-15 -15.6574 0.10564E-15 -15.9762 0.47995E+00 -0.3188 98 HP2O7-3 0.54408E-17 -17.2643 0.10597E-17 -17.9748 0.19478E+00 -0.7105 100 H2S,aq 0.20971E-01 -1.6784 0.20457E-01 -1.6891 0.97552E+00 -0.0108 101 S2-2 0.14252E-08 -8.8461 0.68405E-09 -9.1649 0.47995E+00 -0.3188 102 S3-2 0.10966E-07 -7.9599 0.52634E-08 -8.2787 0.47995E+00 -0.3188 103 S3- 0.14348E-05 -5.8432 0.11734E-05 -5.9306 0.81780E+00 -0.0874 104 S4-2 0.55739E-07 -7.2538 0.26752E-07 -7.5726 0.47995E+00 -0.3188 105 S5-2 0.18891E-06 -6.7237 0.90669E-07 -7.0425 0.47995E+00 -0.3188 106 SO2,aq 0.13498E-10 -10.8697 0.13498E-10 -10.8697 0.10000E+01 0.0000 107 SO3-2 0.20245E-11 -11.6937 0.98902E-12 -12.0048 0.48853E+00 -0.3111 108 HSO3- 0.15072E-08 -8.8218 0.12326E-08 -8.9092 0.81780E+00 -0.0874 109 HSO4- 0.49547E-04 -4.3050 0.40665E-04 -4.3908 0.82072E+00 -0.0858 111 S2O3-2 0.10638E-05 -5.9731 0.51060E-06 -6.2919 0.47995E+00 -0.3188 112 HS2O3- 0.22221E-08 -8.6532 0.18172E-08 -8.7406 0.81780E+00 -0.0874 113 H2S2O3,aq 0.57988E-12 -12.2367 0.57988E-12 -12.2367 0.10000E+01 0.0000 121 S4O6-2 0.12750E-13 -13.8945 0.61197E-14 -14.2133 0.47995E+00 -0.3188 Charge balance for all species = -.5980E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2415933E-04 0.1280380E+00 0.1281599E+03 0.0000 2 H2O 0.1000000E+01 0.5540132E+02 0.9911515E+06 0.0000 3 Cl- 0.9074359E-02 0.9118047E-02 0.3210209E+03 2.5715 4 SO4-- 0.4405219E-02 0.4461912E-02 0.4256467E+03 6.7284 5 HCO3- 0.2986590E-02 0.1099143E+00 0.6660165E+04 2.0896 6 HS- 0.4065516E-03 0.2138277E-01 0.7022680E+03 1.2229 7 Al+++ 0.7706533E-12 0.6565559E-09 0.1759204E-04 1.2789 8 H4SiO4 0.1019920E-02 0.1019992E-02 0.9735725E+02 -2.9914 9 Ca++ 0.1651378E-06 0.2259293E-06 0.8992017E-02 2.2983 10 Mg++ 0.8595691E-10 0.9086020E-10 0.2193678E-05 -0.9877 11 Fe++ 0.1013980E-12 0.1035081E-12 0.5740538E-08 -3.9154 12 K+ 0.1484324E-03 0.1533416E-03 0.5954393E+01 0.7861 13 Na+ 0.2170467E-01 0.2175016E-01 0.4965651E+03 2.9501 14 Mn++ 0.1849872E-08 0.2445072E-08 0.1333960E-03 0.3462 15 F- 0.5409607E-03 0.6029472E-03 0.1137537E+02 1.3458 16 HPO4-- 0.2074546E-09 0.4526349E-07 0.4314224E-02 -0.5986 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1307174E+00 0.1179245E+00 0.1279290E-01 0.0000000E+00 2 H2O 0.5099258E+02 0.5102524E+02 -.3266440E-01 0.0000000E+00 3 Cl- 0.8397825E-02 0.8397825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6669967E-02 0.4109472E-02 0.2560496E-02 0.0000000E+00 5 HCO3- 0.1012323E+00 0.1012323E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.2737529E-01 0.1969378E-01 0.7681519E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.6046954E-09 0.4774747E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9394245E-03 0.1121360E-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 0.9533213E-13 0.3259217E-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- 0.5600960E-03 0.5553213E-03 0.4774747E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.5717E-18 Mass of aqueous solution: 0.927442E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3901E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6736 -0.172 67.20 0.2544 sulfur 0.1024E-01 -1.990 0.3284 -0.484 32.76 0.1589 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.4383E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.002370 g Volume = 0.413350 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: 1.3999900 moles log = 0.1461 Original solution: 1000.0103000 g Original solution / Rock added: 714.30 (Water/Rock Ratio), log = 2.8539 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 13.2618 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8183E-01 0.9249 0.1004E+01 0.1085E+01 CO2,gas 0.8735E+00 0.9633 0.1116E+02 0.1158E+02 CH4,gas 0.4081E-07 1.0117 0.5475E-06 0.5412E-06 H2,gas 0.3521E-06 1.0071 0.4703E-05 0.4670E-05 H2S,gas 0.4463E-01 0.9502 0.5624E+00 0.5919E+00 S2,gas 0.4047E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1057E-08 1.0000 0.1402E-07 0.1402E-07 SO3,gas 0.2400E-28 1.0000 0.3183E-27 0.3183E-27 SO2,gas 0.4401E-11 1.0000 0.5837E-10 0.5837E-10 HF,gas 0.1113E-07 1.0000 0.1476E-06 0.1476E-06 HCl,gas 0.3602E-11 1.0000 0.4776E-10 0.4776E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 0.28982E+04 0.002 2 CO2,gas -6.66 -7.31 -0.65 -0.217 0.11121E+04 1.048 3 CH4,gas 4.54 -3.42 -7.96 -1.990 0.13592E+05 -6.262 4 H2,gas 8.00 0.97 -7.03 -4.015 0.11998E+05 -5.328 5 H2S,gas -6.23 -8.18 -1.95 -0.974 0.33278E+04 -0.250 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.34 -9.55 -2.939 0.16310E+05 -7.853 8 SO3,gas 17.12 -12.07 -29.20 -7.299 0.49852E+05 -27.497 9 SO2,gas 0.83 -11.10 -11.93 -3.182 0.20375E+05 -10.234 10 HF,gas 0.47 -8.06 -8.53 -4.265 0.14564E+05 -6.831 11 HCl,gas 5.19 -6.83 -12.02 -6.010 0.20524E+05 -10.321 17 albite -0.38 -4.74 -4.36 -0.335 0.74401E+04 25 anhydrite -5.32 -9.78 -4.46 -2.230 0.76165E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.28 -1.60 -0.266 0.27265E+04 69 diamond -3.10 -5.36 -2.26 -0.646 0.38602E+04 86 gibbsite 4.08 1.28 -2.80 -0.400 0.47867E+04 89 graphite -3.55 -5.36 -1.82 -0.519 0.31024E+04 101 kaolinite -1.33 -3.43 -2.09 -0.190 0.35742E+04 119 microcline -2.49 -6.91 -4.42 -0.340 0.75449E+04 149 pyrophyllite -6.18 -9.40 -3.23 -0.202 0.55119E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.09 -4.77 -0.596 0.81398E+04 218 gypsum -4.96 -9.78 -4.82 -1.206 0.82375E+04 237 boehmite 4.41 1.28 -3.13 -0.522 0.53434E+04 240 fluorite -9.93 -13.81 -3.88 -1.295 0.66312E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.3999900 MOLES New total amount of reactant added: 1.4399900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.4399900 Water: Moles liquid = 0.5116E+02 kg liquid = 0.9217E+00 Moles total = 0.5103E+02 kg total = 0.9192E+00 Activity = 0.9976 Stoichiometric ionic strength = .9186550E-01 Osmotic coef. = 0.8772 True ionic strength = .2613519E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8634E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.24807E-04 -4.6054 0.20445E-04 -4.6894 0.82417E+00 -0.0840 2 H2O 0.99765E+00 -0.0010 0.99765E+00 -0.0010 3 Cl- 0.93226E-02 -2.0305 0.76268E-02 -2.1177 0.81809E+00 -0.0872 4 SO4-- 0.42724E-02 -2.3693 0.20591E-02 -2.6863 0.48196E+00 -0.3170 5 HCO3- 0.29887E-02 -2.5245 0.24494E-02 -2.6109 0.81956E+00 -0.0864 6 HS- 0.39243E-03 -3.4062 0.32110E-03 -3.4934 0.81824E+00 -0.0871 7 Al+++ 0.78988E-12 -12.1024 0.15420E-12 -12.8119 0.19522E+00 -0.7095 8 H4SiO4 0.10198E-02 -2.9915 0.10198E-02 -2.9915 0.10000E+01 0.0000 9 Ca++ 0.16603E-06 -6.7798 0.79295E-07 -7.1008 0.47760E+00 -0.3209 10 Mg++ 0.85843E-10 -10.0663 0.40768E-10 -10.3897 0.47491E+00 -0.3234 11 Fe++ 0.10769E-12 -12.9678 0.51210E-13 -13.2906 0.47555E+00 -0.3228 12 K+ 0.14846E-03 -3.8284 0.12171E-03 -3.9147 0.81980E+00 -0.0863 13 Na+ 0.21688E-01 -1.6638 0.17738E-01 -1.7511 0.81790E+00 -0.0873 14 Mn++ 0.18584E-08 -8.7309 0.88466E-09 -9.0532 0.47604E+00 -0.3224 15 F- 0.55462E-03 -3.2560 0.45259E-03 -3.3443 0.81603E+00 -0.0883 16 HPO4-- 0.20158E-09 -9.6956 0.97170E-10 -10.0125 0.48205E+00 -0.3169 17 SiF6-2 0.10215E-16 -16.9907 0.49107E-17 -17.3089 0.48071E+00 -0.3181 18 HSiO3- 0.57066E-07 -7.2436 0.46685E-07 -7.3308 0.81809E+00 -0.0872 19 Ca(HSiO3)+ 0.10281E-12 -12.9880 0.84306E-13 -13.0741 0.82001E+00 -0.0862 20 Mg(HSiO3)+ 0.65783E-16 -16.1819 0.53943E-16 -16.2681 0.82001E+00 -0.0862 21 NaHSiO3,aq 0.13394E-07 -7.8731 0.13394E-07 -7.8731 0.10000E+01 0.0000 22 AlO+ 0.61058E-10 -10.2143 0.50068E-10 -10.3004 0.82001E+00 -0.0862 23 AlOH+2 0.10695E-10 -10.9708 0.50972E-11 -11.2927 0.47661E+00 -0.3218 24 HAlO2,aq 0.48655E-09 -9.3129 0.48655E-09 -9.3129 0.10000E+01 0.0000 25 AlO2- 0.64534E-10 -10.1902 0.52678E-10 -10.2784 0.81629E+00 -0.0882 26 CH4,aq 0.37956E-09 -9.4207 0.37016E-09 -9.4316 0.97522E+00 -0.0109 31 CO,aq 0.95949E-11 -11.0180 0.95949E-11 -11.0180 0.10000E+01 0.0000 32 CO2,aq 0.10998E+00 -0.9587 0.10726E+00 -0.9696 0.97522E+00 -0.0109 33 CO3-2 0.21769E-07 -7.6622 0.10464E-07 -7.9803 0.48071E+00 -0.3181 34 CaCO3,aq 0.10404E-10 -10.9828 0.10404E-10 -10.9828 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.60460E-08 -8.2185 0.49578E-08 -8.3047 0.82001E+00 -0.0862 36 CaCl+ 0.11935E-08 -8.9232 0.97870E-09 -9.0094 0.82001E+00 -0.0862 37 CaCl2,aq 0.17734E-11 -11.7512 0.17734E-11 -11.7512 0.10000E+01 0.0000 38 CaF+ 0.63897E-09 -9.1945 0.52397E-09 -9.2807 0.82001E+00 -0.0862 39 CaOH+ 0.33629E-12 -12.4733 0.27576E-12 -12.5595 0.82001E+00 -0.0862 40 CaSO4,aq 0.51848E-07 -7.2853 0.51848E-07 -7.2853 0.10000E+01 0.0000 41 HCl,aq 0.28574E-07 -7.5440 0.28574E-07 -7.5440 0.10000E+01 0.0000 45 HF,aq 0.63345E-04 -4.1983 0.63345E-04 -4.1983 0.10000E+01 0.0000 46 HF2- 0.11832E-07 -7.9269 0.96796E-08 -8.0141 0.81809E+00 -0.0872 48 FeCl+ 0.75390E-15 -15.1227 0.61821E-15 -15.2089 0.82001E+00 -0.0862 51 FeF+ 0.14444E-14 -14.8403 0.11844E-14 -14.9265 0.82001E+00 -0.0862 54 FeOH+ 0.99195E-16 -16.0035 0.81341E-16 -16.0897 0.82001E+00 -0.0862 60 H2,aq 0.36429E-08 -8.4385 0.35526E-08 -8.4494 0.97522E+00 -0.0109 61 KCl,aq 0.16824E-07 -7.7741 0.16824E-07 -7.7741 0.10000E+01 0.0000 62 KHSO4,aq 0.14487E-10 -10.8390 0.14487E-10 -10.8390 0.10000E+01 0.0000 63 KOH,aq 0.25362E-11 -11.5958 0.25362E-11 -11.5958 0.10000E+01 0.0000 64 KSO4- 0.47536E-05 -5.3230 0.38889E-05 -5.4102 0.81809E+00 -0.0872 65 MgCO3,aq 0.13408E-14 -14.8726 0.13408E-14 -14.8726 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31763E-11 -11.4981 0.26046E-11 -11.5843 0.82001E+00 -0.0862 67 MgCl+ 0.55616E-12 -12.2548 0.45606E-12 -12.3410 0.82001E+00 -0.0862 68 MgF+ 0.12169E-11 -11.9147 0.99790E-12 -12.0009 0.82001E+00 -0.0862 69 MgOH+ 0.95673E-15 -15.0192 0.78453E-15 -15.1054 0.82001E+00 -0.0862 71 MnF+ 0.82242E-11 -11.0849 0.67440E-11 -11.1711 0.82001E+00 -0.0862 72 MnO,aq 0.21866E-17 -17.6602 0.21866E-17 -17.6602 0.10000E+01 0.0000 73 MnOH+ 0.15919E-12 -12.7981 0.13053E-12 -12.8843 0.82001E+00 -0.0862 78 MnCl+ 0.50668E-10 -10.2953 0.41548E-10 -10.3814 0.82001E+00 -0.0862 79 MnSO4,aq 0.52589E-09 -9.2791 0.52589E-09 -9.2791 0.10000E+01 0.0000 80 NaCl,aq 0.44834E-04 -4.3484 0.44834E-04 -4.3484 0.10000E+01 0.0000 81 NaF,aq 0.18796E-05 -5.7259 0.18796E-05 -5.7259 0.10000E+01 0.0000 82 NaOH,aq 0.37189E-09 -9.4296 0.37189E-09 -9.4296 0.10000E+01 0.0000 84 OH- 0.34538E-07 -7.4617 0.28193E-07 -7.5499 0.81629E+00 -0.0882 91 H2PO3- 0.54040E-19 -19.2673 0.44210E-19 -19.3545 0.81809E+00 -0.0872 92 H3PO4,aq 0.28408E-09 -9.5466 0.28408E-09 -9.5466 0.10000E+01 0.0000 93 H2PO4- 0.44745E-07 -7.3493 0.36648E-07 -7.4359 0.81905E+00 -0.0867 94 PO4-3 0.18700E-16 -16.7282 0.38777E-17 -17.4114 0.20736E+00 -0.6833 96 H3P2O7- 0.81404E-18 -18.0894 0.66596E-18 -18.1765 0.81809E+00 -0.0872 97 H2P2O7-2 0.21960E-15 -15.6584 0.10556E-15 -15.9765 0.48071E+00 -0.3181 98 HP2O7-3 0.52738E-17 -17.2779 0.10310E-17 -17.9868 0.19549E+00 -0.7089 100 H2S,aq 0.20805E-01 -1.6818 0.20290E-01 -1.6927 0.97522E+00 -0.0109 101 S2-2 0.13378E-08 -8.8736 0.64307E-09 -9.1917 0.48071E+00 -0.3181 102 S3-2 0.10293E-07 -7.9874 0.49480E-08 -8.3056 0.48071E+00 -0.3181 103 S3- 0.13907E-05 -5.8568 0.11377E-05 -5.9440 0.81809E+00 -0.0872 104 S4-2 0.52318E-07 -7.2814 0.25150E-07 -7.5995 0.48071E+00 -0.3181 105 S5-2 0.17731E-06 -6.7513 0.85237E-07 -7.0694 0.48071E+00 -0.3181 106 SO2,aq 0.13721E-10 -10.8626 0.13721E-10 -10.8626 0.10000E+01 0.0000 107 SO3-2 0.19476E-11 -11.7105 0.95287E-12 -12.0210 0.48925E+00 -0.3105 108 HSO3- 0.14910E-08 -8.8265 0.12198E-08 -8.9137 0.81809E+00 -0.0872 109 HSO4- 0.49417E-04 -4.3061 0.40572E-04 -4.3918 0.82100E+00 -0.0857 111 S2O3-2 0.10233E-05 -5.9900 0.49193E-06 -6.3081 0.48071E+00 -0.3181 112 HS2O3- 0.21982E-08 -8.6579 0.17983E-08 -8.7451 0.81809E+00 -0.0872 113 H2S2O3,aq 0.58942E-12 -12.2296 0.58942E-12 -12.2296 0.10000E+01 0.0000 121 S4O6-2 0.12570E-13 -13.9007 0.60424E-14 -14.2188 0.48071E+00 -0.3181 Charge balance for all species = -.5976E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2480688E-04 0.1309326E+00 0.1310410E+03 0.0000 2 H2O 0.1000000E+01 0.5539826E+02 0.9909742E+06 0.0000 3 Cl- 0.9322649E-02 0.9367530E-02 0.3297637E+03 2.5718 4 SO4-- 0.4272363E-02 0.4328703E-02 0.4128881E+03 6.6925 5 HCO3- 0.2988666E-02 0.1129729E+00 0.6844648E+04 2.0785 6 HS- 0.3924267E-03 0.2120305E-01 0.6962795E+03 1.1960 7 Al+++ 0.7898835E-12 0.6236231E-09 0.1670756E-04 1.2563 8 H4SiO4 0.1019814E-02 0.1019884E-02 0.9733491E+02 -2.9915 9 Ca++ 0.1660273E-06 0.2257665E-06 0.8984424E-02 2.2781 10 Mg++ 0.8584300E-10 0.9079470E-10 0.2191825E-05 -1.0109 11 Fe++ 0.1076859E-12 0.1099834E-12 0.6098903E-08 -3.9118 12 K+ 0.1484607E-03 0.1532311E-03 0.5949365E+01 0.7747 13 Na+ 0.2168776E-01 0.2173449E-01 0.4961458E+03 2.9383 14 Mn++ 0.1858372E-08 0.2443309E-08 0.1332834E-03 0.3256 15 F- 0.5546229E-03 0.6198722E-03 0.1169324E+02 1.3451 16 HPO4-- 0.2015768E-09 0.4523086E-07 0.4310581E-02 -0.6337 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1350244E+00 0.1206774E+00 0.1434695E-01 0.0000000E+00 2 H2O 0.5102533E+02 0.5105923E+02 -.3390649E-01 0.0000000E+00 3 Cl- 0.8633825E-02 0.8633825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.6860967E-02 0.3989660E-02 0.2871307E-02 0.0000000E+00 5 HCO3- 0.1041243E+00 0.1041243E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.2815629E-01 0.1954234E-01 0.8613953E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5747783E-09 0.4774777E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9400026E-03 0.1121302E-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 0.1013690E-12 0.3259217E-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- 0.5760960E-03 0.5713212E-03 0.4774777E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2927E-17 Mass of aqueous solution: 0.928225E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.4399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3752E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6735 -0.172 64.63 0.2544 sulfur 0.1149E-01 -1.940 0.3682 -0.434 35.33 0.1781 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.4216E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.042193 g Volume = 0.432620 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: 1.4399900 moles log = 0.1584 Original solution: 1000.0103000 g Original solution / Rock added: 694.46 (Water/Rock Ratio), log = 2.8416 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 13.5985 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7992E-01 0.9234 0.1004E+01 0.1087E+01 CO2,gas 0.8769E+00 0.9624 0.1148E+02 0.1192E+02 CH4,gas 0.3960E-07 1.0119 0.5448E-06 0.5385E-06 H2,gas 0.3405E-06 1.0073 0.4664E-05 0.4631E-05 H2S,gas 0.4322E-01 0.9489 0.5578E+00 0.5878E+00 S2,gas 0.3947E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1051E-08 1.0000 0.1430E-07 0.1430E-07 SO3,gas 0.2399E-28 1.0000 0.3262E-27 0.3262E-27 SO2,gas 0.4363E-11 1.0000 0.5933E-10 0.5933E-10 HF,gas 0.1144E-07 1.0000 0.1555E-06 0.1555E-06 HCl,gas 0.3708E-11 1.0000 0.5042E-10 0.5042E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 0.28983E+04 0.002 2 CO2,gas -6.66 -7.30 -0.64 -0.213 0.10914E+04 1.060 3 CH4,gas 4.54 -3.42 -7.96 -1.991 0.13596E+05 -6.264 4 H2,gas 8.00 0.97 -7.03 -4.017 0.12004E+05 -5.331 5 H2S,gas -6.23 -8.18 -1.95 -0.976 0.33339E+04 -0.254 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.33 -9.54 -2.937 0.16296E+05 -7.845 8 SO3,gas 17.12 -12.06 -29.19 -7.296 0.49833E+05 -27.487 9 SO2,gas 0.83 -11.09 -11.93 -3.180 0.20363E+05 -10.227 10 HF,gas 0.47 -8.03 -8.51 -4.254 0.14526E+05 -6.808 11 HCl,gas 5.19 -6.81 -12.00 -5.998 0.20483E+05 -10.297 17 albite -0.38 -4.78 -4.39 -0.338 0.74990E+04 25 anhydrite -5.32 -9.79 -4.47 -2.235 0.76329E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.25 -1.62 -0.270 0.27651E+04 69 diamond -3.10 -5.36 -2.26 -0.645 0.38516E+04 86 gibbsite 4.08 1.25 -2.83 -0.404 0.48254E+04 89 graphite -3.55 -5.36 -1.81 -0.518 0.30939E+04 101 kaolinite -1.33 -3.47 -2.14 -0.194 0.36516E+04 119 microcline -2.49 -6.94 -4.45 -0.343 0.76031E+04 149 pyrophyllite -6.18 -9.45 -3.27 -0.205 0.55892E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.11 -4.79 -0.599 0.81780E+04 218 gypsum -4.96 -9.79 -4.83 -1.209 0.82539E+04 237 boehmite 4.41 1.25 -3.15 -0.525 0.53820E+04 240 fluorite -9.93 -13.79 -3.86 -1.286 0.65885E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.4399900 MOLES New total amount of reactant added: 1.4799900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.4799900 Water: Moles liquid = 0.5120E+02 kg liquid = 0.9223E+00 Moles total = 0.5106E+02 kg total = 0.9198E+00 Activity = 0.9976 Stoichiometric ionic strength = .9317399E-01 Osmotic coef. = 0.8780 True ionic strength = .2598754E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8870E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.25476E-04 -4.5939 0.21003E-04 -4.6777 0.82444E+00 -0.0838 2 H2O 0.99760E+00 -0.0010 0.99760E+00 -0.0010 3 Cl- 0.95706E-02 -2.0191 0.78324E-02 -2.1061 0.81838E+00 -0.0870 4 SO4-- 0.41410E-02 -2.3829 0.19989E-02 -2.6992 0.48271E+00 -0.3163 5 HCO3- 0.29879E-02 -2.5246 0.24497E-02 -2.6109 0.81985E+00 -0.0863 6 HS- 0.37878E-03 -3.4216 0.31004E-03 -3.5086 0.81853E+00 -0.0870 7 Al+++ 0.81057E-12 -12.0912 0.15881E-12 -12.7991 0.19593E+00 -0.7079 8 H4SiO4 0.10197E-02 -2.9915 0.10197E-02 -2.9915 0.10000E+01 0.0000 9 Ca++ 0.16693E-06 -6.7775 0.79851E-07 -7.0977 0.47836E+00 -0.3202 10 Mg++ 0.85732E-10 -10.0669 0.40781E-10 -10.3895 0.47568E+00 -0.3227 11 Fe++ 0.11439E-12 -12.9416 0.54485E-13 -13.2637 0.47632E+00 -0.3221 12 K+ 0.14849E-03 -3.8283 0.12177E-03 -3.9145 0.82008E+00 -0.0861 13 Na+ 0.21671E-01 -1.6641 0.17731E-01 -1.7513 0.81819E+00 -0.0871 14 Mn++ 0.18669E-08 -8.7289 0.89014E-09 -9.0505 0.47680E+00 -0.3217 15 F- 0.56814E-03 -3.2455 0.46379E-03 -3.3337 0.81633E+00 -0.0881 16 HPO4-- 0.19584E-09 -9.7081 0.94548E-10 -10.0243 0.48279E+00 -0.3162 17 SiF6-2 0.13155E-16 -16.8809 0.63336E-17 -17.1984 0.48146E+00 -0.3174 18 HSiO3- 0.55527E-07 -7.2555 0.45442E-07 -7.3425 0.81838E+00 -0.0870 19 Ca(HSiO3)+ 0.10074E-12 -12.9968 0.82637E-13 -13.0828 0.82030E+00 -0.0860 20 Mg(HSiO3)+ 0.64030E-16 -16.1936 0.52524E-16 -16.2796 0.82030E+00 -0.0860 21 NaHSiO3,aq 0.13032E-07 -7.8850 0.13032E-07 -7.8850 0.10000E+01 0.0000 22 AlO+ 0.59563E-10 -10.2250 0.48859E-10 -10.3111 0.82030E+00 -0.0860 23 AlOH+2 0.10704E-10 -10.9704 0.51099E-11 -11.2916 0.47737E+00 -0.3211 24 HAlO2,aq 0.46216E-09 -9.3352 0.46216E-09 -9.3352 0.10000E+01 0.0000 25 AlO2- 0.59649E-10 -10.2244 0.48708E-10 -10.3124 0.81658E+00 -0.0880 26 CH4,aq 0.37767E-09 -9.4229 0.36820E-09 -9.4339 0.97491E+00 -0.0110 31 CO,aq 0.97790E-11 -11.0097 0.97790E-11 -11.0097 0.10000E+01 0.0000 32 CO2,aq 0.11304E+00 -0.9468 0.11020E+00 -0.9578 0.97491E+00 -0.0110 33 CO3-2 0.21159E-07 -7.6745 0.10187E-07 -7.9919 0.48146E+00 -0.3174 34 CaCO3,aq 0.10200E-10 -10.9914 0.10200E-10 -10.9914 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.60869E-08 -8.2156 0.49931E-08 -8.3016 0.82030E+00 -0.0860 36 CaCl+ 0.12339E-08 -8.9087 0.10121E-08 -8.9948 0.82030E+00 -0.0860 37 CaCl2,aq 0.18834E-11 -11.7251 0.18834E-11 -11.7251 0.10000E+01 0.0000 38 CaF+ 0.65915E-09 -9.1810 0.54070E-09 -9.2670 0.82030E+00 -0.0860 39 CaOH+ 0.32952E-12 -12.4821 0.27030E-12 -12.5681 0.82030E+00 -0.0860 40 CaSO4,aq 0.50684E-07 -7.2951 0.50684E-07 -7.2951 0.10000E+01 0.0000 41 HCl,aq 0.30145E-07 -7.5208 0.30145E-07 -7.5208 0.10000E+01 0.0000 45 HF,aq 0.66684E-04 -4.1760 0.66684E-04 -4.1760 0.10000E+01 0.0000 46 HF2- 0.12759E-07 -7.8942 0.10442E-07 -7.9812 0.81838E+00 -0.0870 48 FeCl+ 0.82345E-15 -15.0844 0.67547E-15 -15.1704 0.82030E+00 -0.0860 51 FeF+ 0.15742E-14 -14.8029 0.12913E-14 -14.8890 0.82030E+00 -0.0860 54 FeOH+ 0.10269E-15 -15.9885 0.84239E-16 -16.0745 0.82030E+00 -0.0860 60 H2,aq 0.36146E-08 -8.4419 0.35239E-08 -8.4530 0.97491E+00 -0.0110 61 KCl,aq 0.17286E-07 -7.7623 0.17286E-07 -7.7623 0.10000E+01 0.0000 62 KHSO4,aq 0.14455E-10 -10.8400 0.14455E-10 -10.8400 0.10000E+01 0.0000 63 KOH,aq 0.24700E-11 -11.6073 0.24700E-11 -11.6073 0.10000E+01 0.0000 64 KSO4- 0.46153E-05 -5.3358 0.37771E-05 -5.4228 0.81838E+00 -0.0870 65 MgCO3,aq 0.13058E-14 -14.8841 0.13058E-14 -14.8841 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31765E-11 -11.4980 0.26057E-11 -11.5841 0.82030E+00 -0.0860 67 MgCl+ 0.57114E-12 -12.2433 0.46850E-12 -12.3293 0.82030E+00 -0.0860 68 MgF+ 0.12470E-11 -11.9041 0.10229E-11 -11.9902 0.82030E+00 -0.0860 69 MgOH+ 0.93124E-15 -15.0309 0.76389E-15 -15.1170 0.82030E+00 -0.0860 71 MnF+ 0.84770E-11 -11.0718 0.69537E-11 -11.1578 0.82030E+00 -0.0860 72 MnO,aq 0.20847E-17 -17.6810 0.20847E-17 -17.6810 0.10000E+01 0.0000 73 MnOH+ 0.15586E-12 -12.8073 0.12785E-12 -12.8933 0.82030E+00 -0.0860 78 MnCl+ 0.52338E-10 -10.2812 0.42933E-10 -10.3672 0.82030E+00 -0.0860 79 MnSO4,aq 0.51367E-09 -9.2893 0.51367E-09 -9.2893 0.10000E+01 0.0000 80 NaCl,aq 0.46024E-04 -4.3370 0.46024E-04 -4.3370 0.10000E+01 0.0000 81 NaF,aq 0.19252E-05 -5.7155 0.19252E-05 -5.7155 0.10000E+01 0.0000 82 NaOH,aq 0.36184E-09 -9.4415 0.36184E-09 -9.4415 0.10000E+01 0.0000 84 OH- 0.33607E-07 -7.4736 0.27443E-07 -7.5616 0.81658E+00 -0.0880 91 H2PO3- 0.53564E-19 -19.2711 0.43836E-19 -19.3582 0.81838E+00 -0.0870 92 H3PO4,aq 0.29171E-09 -9.5351 0.29171E-09 -9.5351 0.10000E+01 0.0000 93 H2PO4- 0.44711E-07 -7.3496 0.36633E-07 -7.4361 0.81933E+00 -0.0865 94 PO4-3 0.17653E-16 -16.7532 0.36728E-17 -17.4350 0.20806E+00 -0.6818 96 H3P2O7- 0.83531E-18 -18.0782 0.68360E-18 -18.1652 0.81838E+00 -0.0870 97 H2P2O7-2 0.21908E-15 -15.6594 0.10548E-15 -15.9768 0.48146E+00 -0.3174 98 HP2O7-3 0.51111E-17 -17.2915 0.10028E-17 -17.9988 0.19619E+00 -0.7073 100 H2S,aq 0.20643E-01 -1.6852 0.20126E-01 -1.6963 0.97491E+00 -0.0110 101 S2-2 0.12554E-08 -8.9012 0.60442E-09 -9.2187 0.48146E+00 -0.3174 102 S3-2 0.96595E-08 -8.0150 0.46507E-08 -8.3325 0.48146E+00 -0.3174 103 S3- 0.13478E-05 -5.8704 0.11030E-05 -5.9574 0.81838E+00 -0.0870 104 S4-2 0.49097E-07 -7.3089 0.23638E-07 -7.6264 0.48146E+00 -0.3174 105 S5-2 0.16640E-06 -6.7789 0.80114E-07 -7.0963 0.48146E+00 -0.3174 106 SO2,aq 0.13944E-10 -10.8556 0.13944E-10 -10.8556 0.10000E+01 0.0000 107 SO3-2 0.18726E-11 -11.7275 0.91755E-12 -12.0374 0.48998E+00 -0.3098 108 HSO3- 0.14744E-08 -8.8314 0.12066E-08 -8.9184 0.81838E+00 -0.0870 109 HSO4- 0.49264E-04 -4.3075 0.40460E-04 -4.3930 0.82128E+00 -0.0855 111 S2O3-2 0.98388E-06 -6.0071 0.47370E-06 -6.3245 0.48146E+00 -0.3174 112 HS2O3- 0.21737E-08 -8.6628 0.17789E-08 -8.7498 0.81838E+00 -0.0870 113 H2S2O3,aq 0.59898E-12 -12.2226 0.59898E-12 -12.2226 0.10000E+01 0.0000 121 S4O6-2 0.12381E-13 -13.9072 0.59610E-14 -14.2247 0.48146E+00 -0.3174 Charge balance for all species = -.5971E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2547577E-04 0.1338292E+00 0.1339235E+03 0.0000 2 H2O 0.1000000E+01 0.5539521E+02 0.9907971E+06 0.0000 3 Cl- 0.9570581E-02 0.9616653E-02 0.3384917E+03 2.5716 4 SO4-- 0.4140956E-02 0.4196923E-02 0.4002689E+03 6.6562 5 HCO3- 0.2987940E-02 0.1160270E+00 0.7028819E+04 2.0668 6 HS- 0.3787753E-03 0.2102731E-01 0.6904229E+03 1.1691 7 Al+++ 0.8105663E-12 0.5928881E-09 0.1588217E-04 1.2340 8 H4SiO4 0.1019708E-02 0.1019776E-02 0.9731257E+02 -2.9915 9 Ca++ 0.1669271E-06 0.2256039E-06 0.8976843E-02 2.2577 10 Mg++ 0.8573235E-10 0.9072931E-10 0.2189976E-05 -1.0341 11 Fe++ 0.1143880E-12 0.1168883E-12 0.6481000E-08 -3.9083 12 K+ 0.1484881E-03 0.1531207E-03 0.5944345E+01 0.7633 13 Na+ 0.2167087E-01 0.2171883E-01 0.4957271E+03 2.9264 14 Mn++ 0.1866911E-08 0.2441549E-08 0.1331709E-03 0.3049 15 F- 0.5681371E-03 0.6367729E-03 0.1201057E+02 1.3440 16 HPO4-- 0.1958353E-09 0.4519828E-07 0.4306944E-02 -0.6689 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1393314E+00 0.1234361E+00 0.1589530E-01 0.0000000E+00 2 H2O 0.5105808E+02 0.5109322E+02 -.3514401E-01 0.0000000E+00 3 Cl- 0.8869825E-02 0.8869825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7051967E-02 0.3870990E-02 0.3180977E-02 0.0000000E+00 5 HCO3- 0.1070163E+00 0.1070163E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.2893729E-01 0.1939433E-01 0.9542963E-02 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5468445E-09 0.4774805E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9405806E-03 0.1121244E-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 0.1078108E-12 0.3259216E-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- 0.5920960E-03 0.5873212E-03 0.4774805E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1113E-17 Mass of aqueous solution: 0.929009E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.4799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3614E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6735 -0.172 62.25 0.2543 sulfur 0.1272E-01 -1.895 0.4079 -0.389 37.71 0.1974 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.4061E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.081871 g Volume = 0.451819 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: 1.4799900 moles log = 0.1703 Original solution: 1000.0103000 g Original solution / Rock added: 675.69 (Water/Rock Ratio), log = 2.8297 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 13.9355 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7811E-01 0.9219 0.1004E+01 0.1089E+01 CO2,gas 0.8800E+00 0.9615 0.1179E+02 0.1226E+02 CH4,gas 0.3843E-07 1.0121 0.5420E-06 0.5355E-06 H2,gas 0.3295E-06 1.0075 0.4626E-05 0.4592E-05 H2S,gas 0.4189E-01 0.9477 0.5532E+00 0.5838E+00 S2,gas 0.3852E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1046E-08 1.0000 0.1457E-07 0.1457E-07 SO3,gas 0.2398E-28 1.0000 0.3342E-27 0.3342E-27 SO2,gas 0.4327E-11 1.0000 0.6030E-10 0.6030E-10 HF,gas 0.1175E-07 1.0000 0.1637E-06 0.1637E-06 HCl,gas 0.3817E-11 1.0000 0.5319E-10 0.5319E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 0.28983E+04 0.002 2 CO2,gas -6.66 -7.29 -0.63 -0.209 0.10713E+04 1.072 3 CH4,gas 4.54 -3.42 -7.97 -1.991 0.13600E+05 -6.266 4 H2,gas 8.00 0.97 -7.03 -4.019 0.12010E+05 -5.335 5 H2S,gas -6.23 -8.19 -1.96 -0.978 0.33399E+04 -0.257 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.32 -9.54 -2.934 0.16281E+05 -7.836 8 SO3,gas 17.12 -12.05 -29.17 -7.294 0.49815E+05 -27.476 9 SO2,gas 0.83 -11.09 -11.92 -3.178 0.20351E+05 -10.220 10 HF,gas 0.47 -8.01 -8.48 -4.242 0.14488E+05 -6.786 11 HCl,gas 5.19 -6.78 -11.97 -5.987 0.20444E+05 -10.274 17 albite -0.38 -4.81 -4.43 -0.340 0.75574E+04 25 anhydrite -5.32 -9.80 -4.48 -2.240 0.76497E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.23 -1.64 -0.274 0.28033E+04 69 diamond -3.10 -5.35 -2.25 -0.643 0.38435E+04 86 gibbsite 4.08 1.23 -2.85 -0.407 0.48636E+04 89 graphite -3.55 -5.35 -1.81 -0.516 0.30858E+04 101 kaolinite -1.33 -3.52 -2.18 -0.198 0.37279E+04 119 microcline -2.49 -6.97 -4.49 -0.345 0.76608E+04 149 pyrophyllite -6.18 -9.49 -3.32 -0.207 0.56655E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.13 -4.81 -0.602 0.82164E+04 218 gypsum -4.96 -9.80 -4.84 -1.211 0.82708E+04 237 boehmite 4.41 1.23 -3.17 -0.529 0.54202E+04 240 fluorite -9.93 -13.77 -3.83 -1.278 0.65471E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.4799900 MOLES New total amount of reactant added: 1.5199900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.5199900 Water: Moles liquid = 0.5123E+02 kg liquid = 0.9230E+00 Moles total = 0.5109E+02 kg total = 0.9204E+00 Activity = 0.9975 Stoichiometric ionic strength = .9448500E-01 Osmotic coef. = 0.8788 True ionic strength = .2584136E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9106E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.26167E-04 -4.5822 0.21580E-04 -4.6659 0.82470E+00 -0.0837 2 H2O 0.99755E+00 -0.0011 0.99755E+00 -0.0011 3 Cl- 0.98182E-02 -2.0080 0.80378E-02 -2.0949 0.81867E+00 -0.0869 4 SO4-- 0.40110E-02 -2.3968 0.19391E-02 -2.7124 0.48345E+00 -0.3156 5 HCO3- 0.29845E-02 -2.5251 0.24477E-02 -2.6112 0.82013E+00 -0.0861 6 HS- 0.36558E-03 -3.4370 0.29934E-03 -3.5238 0.81882E+00 -0.0868 7 Al+++ 0.83279E-12 -12.0795 0.16376E-12 -12.7858 0.19664E+00 -0.7063 8 H4SiO4 0.10196E-02 -2.9916 0.10196E-02 -2.9916 0.10000E+01 0.0000 9 Ca++ 0.16784E-06 -6.7751 0.80413E-07 -7.0947 0.47911E+00 -0.3196 10 Mg++ 0.85625E-10 -10.0674 0.40795E-10 -10.3894 0.47644E+00 -0.3220 11 Fe++ 0.12154E-12 -12.9153 0.57983E-13 -13.2367 0.47708E+00 -0.3214 12 K+ 0.14851E-03 -3.8282 0.12184E-03 -3.9142 0.82036E+00 -0.0860 13 Na+ 0.21654E-01 -1.6645 0.17723E-01 -1.7515 0.81848E+00 -0.0870 14 Mn++ 0.18755E-08 -8.7269 0.89566E-09 -9.0479 0.47756E+00 -0.3210 15 F- 0.58150E-03 -3.2355 0.47487E-03 -3.3234 0.81663E+00 -0.0880 16 HPO4-- 0.19022E-09 -9.7207 0.91980E-10 -10.0363 0.48354E+00 -0.3156 17 SiF6-2 0.16868E-16 -16.7729 0.81336E-17 -17.0897 0.48220E+00 -0.3168 18 HSiO3- 0.54021E-07 -7.2674 0.44225E-07 -7.3543 0.81867E+00 -0.0869 19 Ca(HSiO3)+ 0.98698E-13 -13.0057 0.80990E-13 -13.0916 0.82058E+00 -0.0859 20 Mg(HSiO3)+ 0.62315E-16 -16.2054 0.51134E-16 -16.2913 0.82058E+00 -0.0859 21 NaHSiO3,aq 0.12677E-07 -7.8970 0.12677E-07 -7.8970 0.10000E+01 0.0000 22 AlO+ 0.58154E-10 -10.2354 0.47720E-10 -10.3213 0.82058E+00 -0.0859 23 AlOH+2 0.10725E-10 -10.9696 0.51278E-11 -11.2901 0.47813E+00 -0.3205 24 HAlO2,aq 0.43929E-09 -9.3573 0.43929E-09 -9.3573 0.10000E+01 0.0000 25 AlO2- 0.55161E-10 -10.2584 0.45060E-10 -10.3462 0.81688E+00 -0.0878 26 CH4,aq 0.37567E-09 -9.4252 0.36613E-09 -9.4364 0.97461E+00 -0.0112 31 CO,aq 0.99604E-11 -11.0017 0.99604E-11 -11.0017 0.10000E+01 0.0000 32 CO2,aq 0.11609E+00 -0.9352 0.11314E+00 -0.9464 0.97461E+00 -0.0112 33 CO3-2 0.20545E-07 -7.6873 0.99070E-08 -8.0041 0.48220E+00 -0.3168 34 CaCO3,aq 0.99891E-11 -11.0005 0.99891E-11 -11.0005 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61227E-08 -8.2131 0.50241E-08 -8.2989 0.82058E+00 -0.0859 36 CaCl+ 0.12747E-08 -8.8946 0.10460E-08 -8.9805 0.82058E+00 -0.0859 37 CaCl2,aq 0.19974E-11 -11.6995 0.19974E-11 -11.6995 0.10000E+01 0.0000 38 CaF+ 0.67941E-09 -9.1679 0.55751E-09 -9.2537 0.82058E+00 -0.0859 39 CaOH+ 0.32284E-12 -12.4910 0.26491E-12 -12.5769 0.82058E+00 -0.0859 40 CaSO4,aq 0.49515E-07 -7.3053 0.49515E-07 -7.3053 0.10000E+01 0.0000 41 HCl,aq 0.31785E-07 -7.4978 0.31785E-07 -7.4978 0.10000E+01 0.0000 45 HF,aq 0.70153E-04 -4.1540 0.70153E-04 -4.1540 0.10000E+01 0.0000 46 HF2- 0.13739E-07 -7.8621 0.11247E-07 -7.9489 0.81867E+00 -0.0869 48 FeCl+ 0.89899E-15 -15.0462 0.73769E-15 -15.1321 0.82058E+00 -0.0859 51 FeF+ 0.17147E-14 -14.7658 0.14070E-14 -14.8517 0.82058E+00 -0.0859 54 FeOH+ 0.10632E-15 -15.9734 0.87245E-16 -16.0593 0.82058E+00 -0.0859 60 H2,aq 0.35868E-08 -8.4453 0.34958E-08 -8.4565 0.97461E+00 -0.0112 61 KCl,aq 0.17749E-07 -7.7508 0.17749E-07 -7.7508 0.10000E+01 0.0000 62 KHSO4,aq 0.14415E-10 -10.8412 0.14415E-10 -10.8412 0.10000E+01 0.0000 63 KOH,aq 0.24051E-11 -11.6189 0.24051E-11 -11.6189 0.10000E+01 0.0000 64 KSO4- 0.44781E-05 -5.3489 0.36661E-05 -5.4358 0.81867E+00 -0.0869 65 MgCO3,aq 0.12702E-14 -14.8961 0.12702E-14 -14.8961 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31739E-11 -11.4984 0.26045E-11 -11.5843 0.82058E+00 -0.0859 67 MgCl+ 0.58612E-12 -12.2320 0.48096E-12 -12.3179 0.82058E+00 -0.0859 68 MgF+ 0.12768E-11 -11.8939 0.10477E-11 -11.9798 0.82058E+00 -0.0859 69 MgOH+ 0.90630E-15 -15.0427 0.74369E-15 -15.1286 0.82058E+00 -0.0859 71 MnF+ 0.87303E-11 -11.0590 0.71639E-11 -11.1449 0.82058E+00 -0.0859 72 MnO,aq 0.19868E-17 -17.7018 0.19868E-17 -17.7018 0.10000E+01 0.0000 73 MnOH+ 0.15257E-12 -12.8165 0.12519E-12 -12.9024 0.82058E+00 -0.0859 78 MnCl+ 0.54025E-10 -10.2674 0.44332E-10 -10.3533 0.82058E+00 -0.0859 79 MnSO4,aq 0.50140E-09 -9.2998 0.50140E-09 -9.2998 0.10000E+01 0.0000 80 NaCl,aq 0.47211E-04 -4.3260 0.47211E-04 -4.3260 0.10000E+01 0.0000 81 NaF,aq 0.19704E-05 -5.7054 0.19704E-05 -5.7054 0.10000E+01 0.0000 82 NaOH,aq 0.35199E-09 -9.4535 0.35199E-09 -9.4535 0.10000E+01 0.0000 84 OH- 0.32695E-07 -7.4855 0.26708E-07 -7.5734 0.81688E+00 -0.0878 91 H2PO3- 0.53098E-19 -19.2749 0.43470E-19 -19.3618 0.81867E+00 -0.0869 92 H3PO4,aq 0.29959E-09 -9.5235 0.29959E-09 -9.5235 0.10000E+01 0.0000 93 H2PO4- 0.44676E-07 -7.3499 0.36617E-07 -7.4363 0.81962E+00 -0.0864 94 PO4-3 0.16658E-16 -16.7784 0.34775E-17 -17.4587 0.20876E+00 -0.6804 96 H3P2O7- 0.85725E-18 -18.0669 0.70181E-18 -18.1538 0.81867E+00 -0.0869 97 H2P2O7-2 0.21856E-15 -15.6604 0.10539E-15 -15.9772 0.48220E+00 -0.3168 98 HP2O7-3 0.49526E-17 -17.3052 0.97516E-18 -18.0109 0.19690E+00 -0.7058 100 H2S,aq 0.20485E-01 -1.6886 0.19965E-01 -1.6997 0.97461E+00 -0.0112 101 S2-2 0.11778E-08 -8.9289 0.56796E-09 -9.2457 0.48220E+00 -0.3168 102 S3-2 0.90628E-08 -8.0427 0.43701E-08 -8.3595 0.48220E+00 -0.3168 103 S3- 0.13060E-05 -5.8840 0.10692E-05 -5.9709 0.81867E+00 -0.0869 104 S4-2 0.46064E-07 -7.3366 0.22212E-07 -7.6534 0.48220E+00 -0.3168 105 S5-2 0.15612E-06 -6.8065 0.75281E-07 -7.1233 0.48220E+00 -0.3168 106 SO2,aq 0.14168E-10 -10.8487 0.14168E-10 -10.8487 0.10000E+01 0.0000 107 SO3-2 0.17996E-11 -11.7448 0.88305E-12 -12.0540 0.49070E+00 -0.3092 108 HSO3- 0.14575E-08 -8.8364 0.11932E-08 -8.9233 0.81867E+00 -0.0869 109 HSO4- 0.49087E-04 -4.3090 0.40328E-04 -4.3944 0.82156E+00 -0.0854 111 S2O3-2 0.94543E-06 -6.0244 0.45589E-06 -6.3411 0.48220E+00 -0.3168 112 HS2O3- 0.21487E-08 -8.6678 0.17591E-08 -8.7547 0.81867E+00 -0.0869 113 H2S2O3,aq 0.60857E-12 -12.2157 0.60857E-12 -12.2157 0.10000E+01 0.0000 121 S4O6-2 0.12185E-13 -13.9142 0.58757E-14 -14.2309 0.48220E+00 -0.3168 Charge balance for all species = -.5967E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2616722E-04 0.1367278E+00 0.1368071E+03 0.0000 2 H2O 0.1000000E+01 0.5539215E+02 0.9906199E+06 0.0000 3 Cl- 0.9818157E-02 0.9865419E-02 0.3472049E+03 2.5711 4 SO4-- 0.4010972E-02 0.4066547E-02 0.3877867E+03 6.6195 5 HCO3- 0.2984489E-02 0.1190767E+00 0.7212677E+04 2.0547 6 HS- 0.3655764E-03 0.2085546E-01 0.6846957E+03 1.1421 7 Al+++ 0.8327864E-12 0.5641603E-09 0.1511075E-04 1.2120 8 H4SiO4 0.1019602E-02 0.1019668E-02 0.9729024E+02 -2.9916 9 Ca++ 0.1678373E-06 0.2254415E-06 0.8969273E-02 2.2372 10 Mg++ 0.8562490E-10 0.9066401E-10 0.2188129E-05 -1.0575 11 Fe++ 0.1215369E-12 0.1242569E-12 0.6888706E-08 -3.9048 12 K+ 0.1485147E-03 0.1530105E-03 0.5939332E+01 0.7517 13 Na+ 0.2165401E-01 0.2170320E-01 0.4953091E+03 2.9145 14 Mn++ 0.1875488E-08 0.2439792E-08 0.1330586E-03 0.2840 15 F- 0.5814978E-03 0.6536493E-03 0.1232736E+02 1.3425 16 HPO4-- 0.1902246E-09 0.4516575E-07 0.4303312E-02 -0.7044 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1436384E+00 0.1262003E+00 0.1743805E-01 0.0000000E+00 2 H2O 0.5109082E+02 0.5112720E+02 -.3637705E-01 0.0000000E+00 3 Cl- 0.9105825E-02 0.9105825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7242967E-02 0.3753441E-02 0.3489527E-02 0.0000000E+00 5 HCO3- 0.1099083E+00 0.1099083E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.2971829E-01 0.1924968E-01 0.1046861E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.5207225E-09 0.4774831E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9411584E-03 0.1121186E-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 0.1146897E-12 0.3259216E-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- 0.6080960E-03 0.6033212E-03 0.4774831E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1713E-17 Mass of aqueous solution: 0.929793E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.5199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3487E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6735 -0.172 60.06 0.2543 sulfur 0.1396E-01 -1.855 0.4475 -0.349 39.90 0.2165 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3918E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.121404 g Volume = 0.470949 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: 1.5199900 moles log = 0.1818 Original solution: 1000.0103000 g Original solution / Rock added: 657.91 (Water/Rock Ratio), log = 2.8182 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 14.2729 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7639E-01 0.9204 0.1003E+01 0.1090E+01 CO2,gas 0.8830E+00 0.9605 0.1211E+02 0.1260E+02 CH4,gas 0.3730E-07 1.0123 0.5389E-06 0.5324E-06 H2,gas 0.3191E-06 1.0076 0.4590E-05 0.4555E-05 H2S,gas 0.4063E-01 0.9465 0.5488E+00 0.5798E+00 S2,gas 0.3761E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1040E-08 1.0000 0.1484E-07 0.1484E-07 SO3,gas 0.2398E-28 1.0000 0.3423E-27 0.3423E-27 SO2,gas 0.4293E-11 1.0000 0.6127E-10 0.6127E-10 HF,gas 0.1207E-07 1.0000 0.1722E-06 0.1722E-06 HCl,gas 0.3930E-11 1.0000 0.5609E-10 0.5609E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.30331E-11 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 0.28984E+04 0.002 2 CO2,gas -6.66 -7.28 -0.62 -0.205 0.10518E+04 1.083 3 CH4,gas 4.54 -3.42 -7.97 -1.992 0.13604E+05 -6.268 4 H2,gas 8.00 0.96 -7.04 -4.021 0.12016E+05 -5.338 5 H2S,gas -6.23 -8.19 -1.96 -0.980 0.33459E+04 -0.261 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.31 -9.53 -2.932 0.16268E+05 -7.828 8 SO3,gas 17.12 -12.04 -29.16 -7.291 0.49798E+05 -27.466 9 SO2,gas 0.83 -11.08 -11.91 -3.176 0.20339E+05 -10.213 10 HF,gas 0.47 -7.99 -8.46 -4.231 0.14450E+05 -6.764 11 HCl,gas 5.19 -6.76 -11.95 -5.975 0.20404E+05 -10.251 17 albite -0.38 -4.84 -4.46 -0.343 0.76154E+04 25 anhydrite -5.32 -9.81 -4.49 -2.245 0.76670E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.21 -1.66 -0.277 0.28409E+04 69 diamond -3.10 -5.35 -2.25 -0.642 0.38358E+04 86 gibbsite 4.08 1.21 -2.87 -0.410 0.49013E+04 89 graphite -3.55 -5.35 -1.80 -0.515 0.30781E+04 101 kaolinite -1.33 -3.56 -2.23 -0.202 0.38032E+04 119 microcline -2.49 -7.01 -4.52 -0.348 0.77181E+04 149 pyrophyllite -6.18 -9.54 -3.36 -0.210 0.57408E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.15 -4.83 -0.604 0.82550E+04 218 gypsum -4.96 -9.81 -4.85 -1.214 0.82882E+04 237 boehmite 4.41 1.21 -3.20 -0.533 0.54578E+04 240 fluorite -9.93 -13.74 -3.81 -1.270 0.65069E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.5199900 MOLES New total amount of reactant added: 1.5599900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.5599900 Water: Moles liquid = 0.5127E+02 kg liquid = 0.9237E+00 Moles total = 0.5112E+02 kg total = 0.9210E+00 Activity = 0.9975 Stoichiometric ionic strength = .9579846E-01 Osmotic coef. = 0.8795 True ionic strength = .2569663E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9342E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.26883E-04 -4.5705 0.22177E-04 -4.6541 0.82497E+00 -0.0836 2 H2O 0.99749E+00 -0.0011 0.99749E+00 -0.0011 3 Cl- 0.10065E-01 -1.9972 0.82431E-02 -2.0839 0.81896E+00 -0.0867 4 SO4-- 0.38824E-02 -2.4109 0.18798E-02 -2.7259 0.48419E+00 -0.3150 5 HCO3- 0.29784E-02 -2.5260 0.24435E-02 -2.6120 0.82041E+00 -0.0860 6 HS- 0.35281E-03 -3.4525 0.28899E-03 -3.5391 0.81910E+00 -0.0867 7 Al+++ 0.85664E-12 -12.0672 0.16905E-12 -12.7720 0.19734E+00 -0.7048 8 H4SiO4 0.10195E-02 -2.9916 0.10195E-02 -2.9916 0.10000E+01 0.0000 9 Ca++ 0.16876E-06 -6.7727 0.80981E-07 -7.0916 0.47986E+00 -0.3189 10 Mg++ 0.85521E-10 -10.0679 0.40810E-10 -10.3892 0.47720E+00 -0.3213 11 Fe++ 0.12917E-12 -12.8888 0.61721E-13 -13.2096 0.47783E+00 -0.3207 12 K+ 0.14854E-03 -3.8282 0.12190E-03 -3.9140 0.82064E+00 -0.0858 13 Na+ 0.21637E-01 -1.6648 0.17716E-01 -1.7516 0.81877E+00 -0.0868 14 Mn++ 0.18841E-08 -8.7249 0.90120E-09 -9.0452 0.47832E+00 -0.3203 15 F- 0.59470E-03 -3.2257 0.48582E-03 -3.3135 0.81692E+00 -0.0878 16 HPO4-- 0.18474E-09 -9.7334 0.89465E-10 -10.0483 0.48427E+00 -0.3149 17 SiF6-2 0.21541E-16 -16.6667 0.10403E-16 -16.9828 0.48295E+00 -0.3161 18 HSiO3- 0.52545E-07 -7.2795 0.43032E-07 -7.3662 0.81896E+00 -0.0867 19 Ca(HSiO3)+ 0.96682E-13 -13.0147 0.79362E-13 -13.1004 0.82085E+00 -0.0857 20 Mg(HSiO3)+ 0.60637E-16 -16.2173 0.49774E-16 -16.3030 0.82085E+00 -0.0857 21 NaHSiO3,aq 0.12330E-07 -7.9090 0.12330E-07 -7.9090 0.10000E+01 0.0000 22 AlO+ 0.56823E-10 -10.2455 0.46644E-10 -10.3312 0.82085E+00 -0.0857 23 AlOH+2 0.10756E-10 -10.9684 0.51508E-11 -11.2881 0.47888E+00 -0.3198 24 HAlO2,aq 0.41780E-09 -9.3790 0.41780E-09 -9.3790 0.10000E+01 0.0000 25 AlO2- 0.51033E-10 -10.2922 0.41702E-10 -10.3798 0.81717E+00 -0.0877 26 CH4,aq 0.37358E-09 -9.4276 0.36398E-09 -9.4389 0.97430E+00 -0.0113 31 CO,aq 0.10139E-10 -10.9940 0.10139E-10 -10.9940 0.10000E+01 0.0000 32 CO2,aq 0.11914E+00 -0.9239 0.11608E+00 -0.9352 0.97430E+00 -0.0113 33 CO3-2 0.19927E-07 -7.7006 0.96238E-08 -8.0167 0.48295E+00 -0.3161 34 CaCO3,aq 0.97721E-11 -11.0100 0.97721E-11 -11.0100 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61533E-08 -8.2109 0.50510E-08 -8.2966 0.82085E+00 -0.0857 36 CaCl+ 0.13160E-08 -8.8807 0.10803E-08 -8.9665 0.82085E+00 -0.0857 37 CaCl2,aq 0.21156E-11 -11.6746 0.21156E-11 -11.6746 0.10000E+01 0.0000 38 CaF+ 0.69976E-09 -9.1551 0.57440E-09 -9.2408 0.82085E+00 -0.0857 39 CaOH+ 0.31624E-12 -12.5000 0.25959E-12 -12.5857 0.82085E+00 -0.0857 40 CaSO4,aq 0.48340E-07 -7.3157 0.48340E-07 -7.3157 0.10000E+01 0.0000 41 HCl,aq 0.33499E-07 -7.4750 0.33499E-07 -7.4750 0.10000E+01 0.0000 45 HF,aq 0.73757E-04 -4.1322 0.73757E-04 -4.1322 0.10000E+01 0.0000 46 HF2- 0.14772E-07 -7.8305 0.12098E-07 -7.9173 0.81896E+00 -0.0867 48 FeCl+ 0.98106E-15 -15.0083 0.80531E-15 -15.0940 0.82085E+00 -0.0857 51 FeF+ 0.18667E-14 -14.7289 0.15323E-14 -14.8147 0.82085E+00 -0.0857 54 FeOH+ 0.11009E-15 -15.9583 0.90366E-16 -16.0440 0.82085E+00 -0.0857 60 H2,aq 0.35597E-08 -8.4486 0.34682E-08 -8.4599 0.97430E+00 -0.0113 61 KCl,aq 0.18212E-07 -7.7397 0.18212E-07 -7.7397 0.10000E+01 0.0000 62 KHSO4,aq 0.14368E-10 -10.8426 0.14368E-10 -10.8426 0.10000E+01 0.0000 63 KOH,aq 0.23415E-11 -11.6305 0.23415E-11 -11.6305 0.10000E+01 0.0000 64 KSO4- 0.43419E-05 -5.3623 0.35558E-05 -5.4491 0.81896E+00 -0.0867 65 MgCO3,aq 0.12344E-14 -14.9085 0.12344E-14 -14.9085 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31686E-11 -11.4991 0.26010E-11 -11.5849 0.82085E+00 -0.0857 67 MgCl+ 0.60111E-12 -12.2210 0.49342E-12 -12.3068 0.82085E+00 -0.0857 68 MgF+ 0.13063E-11 -11.8840 0.10723E-11 -11.9697 0.82085E+00 -0.0857 69 MgOH+ 0.88189E-15 -15.0546 0.72390E-15 -15.1403 0.82085E+00 -0.0857 71 MnF+ 0.89839E-11 -11.0465 0.73745E-11 -11.1323 0.82085E+00 -0.0857 72 MnO,aq 0.18928E-17 -17.7229 0.18928E-17 -17.7229 0.10000E+01 0.0000 73 MnOH+ 0.14932E-12 -12.8259 0.12257E-12 -12.9116 0.82085E+00 -0.0857 78 MnCl+ 0.55729E-10 -10.2539 0.45745E-10 -10.3397 0.82085E+00 -0.0857 79 MnSO4,aq 0.48907E-09 -9.3106 0.48907E-09 -9.3106 0.10000E+01 0.0000 80 NaCl,aq 0.48396E-04 -4.3152 0.48396E-04 -4.3152 0.10000E+01 0.0000 81 NaF,aq 0.20150E-05 -5.6957 0.20150E-05 -5.6957 0.10000E+01 0.0000 82 NaOH,aq 0.34235E-09 -9.4655 0.34235E-09 -9.4655 0.10000E+01 0.0000 84 OH- 0.31802E-07 -7.4976 0.25987E-07 -7.5852 0.81717E+00 -0.0877 91 H2PO3- 0.52640E-19 -19.2787 0.43110E-19 -19.3654 0.81896E+00 -0.0867 92 H3PO4,aq 0.30774E-09 -9.5118 0.30774E-09 -9.5118 0.10000E+01 0.0000 93 H2PO4- 0.44641E-07 -7.3503 0.36601E-07 -7.4365 0.81990E+00 -0.0862 94 PO4-3 0.15714E-16 -16.8037 0.32914E-17 -17.4826 0.20945E+00 -0.6789 96 H3P2O7- 0.87993E-18 -18.0556 0.72062E-18 -18.1423 0.81896E+00 -0.0867 97 H2P2O7-2 0.21805E-15 -15.6615 0.10530E-15 -15.9776 0.48295E+00 -0.3161 98 HP2O7-3 0.47981E-17 -17.3189 0.94812E-18 -18.0231 0.19761E+00 -0.7042 100 H2S,aq 0.20330E-01 -1.6919 0.19808E-01 -1.7032 0.97430E+00 -0.0113 101 S2-2 0.11048E-08 -8.9567 0.53356E-09 -9.2728 0.48295E+00 -0.3161 102 S3-2 0.85008E-08 -8.0705 0.41054E-08 -8.3866 0.48295E+00 -0.3161 103 S3- 0.12654E-05 -5.8978 0.10363E-05 -5.9845 0.81896E+00 -0.0867 104 S4-2 0.43207E-07 -7.3644 0.20867E-07 -7.6805 0.48295E+00 -0.3161 105 S5-2 0.14644E-06 -6.8343 0.70721E-07 -7.1505 0.48295E+00 -0.3161 106 SO2,aq 0.14392E-10 -10.8419 0.14392E-10 -10.8419 0.10000E+01 0.0000 107 SO3-2 0.17284E-11 -11.7624 0.84935E-12 -12.0709 0.49142E+00 -0.3085 108 HSO3- 0.14401E-08 -8.8416 0.11794E-08 -8.9283 0.81896E+00 -0.0867 109 HSO4- 0.48887E-04 -4.3108 0.40177E-04 -4.3960 0.82183E+00 -0.0852 111 S2O3-2 0.90794E-06 -6.0419 0.43849E-06 -6.3580 0.48295E+00 -0.3161 112 HS2O3- 0.21231E-08 -8.6730 0.17387E-08 -8.7598 0.81896E+00 -0.0867 113 H2S2O3,aq 0.61817E-12 -12.2089 0.61817E-12 -12.2089 0.10000E+01 0.0000 121 S4O6-2 0.11981E-13 -13.9215 0.57862E-14 -14.2376 0.48295E+00 -0.3161 Charge balance for all species = -.5963E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2688256E-04 0.1396281E+00 0.1396919E+03 0.0000 2 H2O 0.1000000E+01 0.5538910E+02 0.9904429E+06 0.0000 3 Cl- 0.1006538E-01 0.1011383E-01 0.3559034E+03 2.5702 4 SO4-- 0.3882390E-02 0.3937552E-02 0.3754393E+03 6.5823 5 HCO3- 0.2978384E-02 0.1221221E+00 0.7396225E+04 2.0421 6 HS- 0.3528097E-03 0.2068744E-01 0.6790955E+03 1.1150 7 Al+++ 0.8566406E-12 0.5372697E-09 0.1438872E-04 1.1903 8 H4SiO4 0.1019496E-02 0.1019560E-02 0.9726791E+02 -2.9916 9 Ca++ 0.1687580E-06 0.2252794E-06 0.8961714E-02 2.2166 10 Mg++ 0.8552058E-10 0.9059881E-10 0.2186285E-05 -1.0810 11 Fe++ 0.1291687E-12 0.1321266E-12 0.7324088E-08 -3.9014 12 K+ 0.1485404E-03 0.1529005E-03 0.5934327E+01 0.7401 13 Na+ 0.2163717E-01 0.2168759E-01 0.4948917E+03 2.9025 14 Mn++ 0.1884106E-08 0.2438038E-08 0.1329465E-03 0.2630 15 F- 0.5946994E-03 0.6705014E-03 0.1264361E+02 1.3406 16 HPO4-- 0.1847397E-09 0.4513327E-07 0.4299685E-02 -0.7402 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1479454E+00 0.1289701E+00 0.1897529E-01 0.0000000E+00 2 H2O 0.5112357E+02 0.5116118E+02 -.3760569E-01 0.0000000E+00 3 Cl- 0.9341825E-02 0.9341825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7433967E-02 0.3636993E-02 0.3796974E-02 0.0000000E+00 5 HCO3- 0.1128003E+00 0.1128003E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3049929E-01 0.1910834E-01 0.1139095E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4962592E-09 0.4774856E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9417360E-03 0.1121128E-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 0.1220412E-12 0.3259215E-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- 0.6240960E-03 0.6193211E-03 0.4774856E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1126E-17 Mass of aqueous solution: 0.930578E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.5599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3369E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6734 -0.172 58.01 0.2543 sulfur 0.1519E-01 -1.819 0.4869 -0.313 41.95 0.2356 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3785E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.160797 g Volume = 0.490010 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: 1.5599900 moles log = 0.1931 Original solution: 1000.0103000 g Original solution / Rock added: 641.04 (Water/Rock Ratio), log = 2.8069 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 14.6107 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7474E-01 0.9189 0.1003E+01 0.1092E+01 CO2,gas 0.8858E+00 0.9596 0.1242E+02 0.1294E+02 CH4,gas 0.3622E-07 1.0125 0.5357E-06 0.5291E-06 H2,gas 0.3092E-06 1.0078 0.4553E-05 0.4518E-05 H2S,gas 0.3942E-01 0.9453 0.5445E+00 0.5760E+00 S2,gas 0.3674E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1034E-08 1.0000 0.1511E-07 0.1511E-07 SO3,gas 0.2399E-28 1.0000 0.3505E-27 0.3505E-27 SO2,gas 0.4260E-11 1.0000 0.6224E-10 0.6224E-10 HF,gas 0.1239E-07 1.0000 0.1811E-06 0.1811E-06 HCl,gas 0.4046E-11 1.0000 0.5911E-10 0.5911E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 -0.30331E-11 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 0.28984E+04 0.001 2 CO2,gas -6.66 -7.26 -0.60 -0.202 0.10328E+04 1.094 3 CH4,gas 4.54 -3.43 -7.97 -1.993 0.13609E+05 -6.271 4 H2,gas 8.00 0.96 -7.04 -4.023 0.12022E+05 -5.342 5 H2S,gas -6.23 -8.19 -1.96 -0.981 0.33517E+04 -0.264 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.30 -9.52 -2.929 0.16255E+05 -7.821 8 SO3,gas 17.12 -12.03 -29.15 -7.289 0.49780E+05 -27.455 9 SO2,gas 0.83 -11.07 -11.90 -3.175 0.20327E+05 -10.206 10 HF,gas 0.47 -7.97 -8.44 -4.221 0.14413E+05 -6.742 11 HCl,gas 5.19 -6.74 -11.93 -5.964 0.20366E+05 -10.228 17 albite -0.38 -4.88 -4.49 -0.346 0.76732E+04 25 anhydrite -5.32 -9.82 -4.50 -2.250 0.76848E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.19 -1.69 -0.281 0.28781E+04 69 diamond -3.10 -5.34 -2.24 -0.641 0.38285E+04 86 gibbsite 4.08 1.19 -2.89 -0.413 0.49385E+04 89 graphite -3.55 -5.34 -1.80 -0.514 0.30707E+04 101 kaolinite -1.33 -3.60 -2.27 -0.206 0.38776E+04 119 microcline -2.49 -7.04 -4.55 -0.350 0.77752E+04 149 pyrophyllite -6.18 -9.58 -3.41 -0.213 0.58151E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.18 -4.86 -0.607 0.82937E+04 218 gypsum -4.96 -9.82 -4.86 -1.216 0.83061E+04 237 boehmite 4.41 1.19 -3.22 -0.536 0.54950E+04 240 fluorite -9.93 -13.72 -3.79 -1.263 0.64678E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.5599900 MOLES New total amount of reactant added: 1.5999900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.5999900 Water: Moles liquid = 0.5131E+02 kg liquid = 0.9243E+00 Moles total = 0.5116E+02 kg total = 0.9216E+00 Activity = 0.9974 Stoichiometric ionic strength = .9711430E-01 Osmotic coef. = 0.8804 True ionic strength = .2555334E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9578E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.27623E-04 -4.5587 0.22795E-04 -4.6422 0.82523E+00 -0.0834 2 H2O 0.99744E+00 -0.0011 0.99744E+00 -0.0011 3 Cl- 0.10312E-01 -1.9866 0.84482E-02 -2.0732 0.81924E+00 -0.0866 4 SO4-- 0.37552E-02 -2.4254 0.18210E-02 -2.7397 0.48493E+00 -0.3143 5 HCO3- 0.29697E-02 -2.5273 0.24372E-02 -2.6131 0.82069E+00 -0.0858 6 HS- 0.34046E-03 -3.4679 0.27896E-03 -3.5545 0.81938E+00 -0.0865 7 Al+++ 0.88224E-12 -12.0544 0.17472E-12 -12.7576 0.19805E+00 -0.7032 8 H4SiO4 0.10194E-02 -2.9917 0.10194E-02 -2.9917 0.10000E+01 0.0000 9 Ca++ 0.16969E-06 -6.7703 0.81555E-07 -7.0886 0.48061E+00 -0.3182 10 Mg++ 0.85419E-10 -10.0684 0.40827E-10 -10.3891 0.47796E+00 -0.3206 11 Fe++ 0.13732E-12 -12.8623 0.65721E-13 -13.1823 0.47859E+00 -0.3200 12 K+ 0.14857E-03 -3.8281 0.12196E-03 -3.9138 0.82092E+00 -0.0857 13 Na+ 0.21620E-01 -1.6651 0.17708E-01 -1.7518 0.81905E+00 -0.0867 14 Mn++ 0.18928E-08 -8.7229 0.90676E-09 -9.0425 0.47907E+00 -0.3196 15 F- 0.60774E-03 -3.2163 0.49665E-03 -3.3040 0.81721E+00 -0.0877 16 HPO4-- 0.17938E-09 -9.7462 0.86999E-10 -10.0605 0.48501E+00 -0.3142 17 SiF6-2 0.27406E-16 -16.5622 0.13256E-16 -16.8776 0.48368E+00 -0.3154 18 HSiO3- 0.51100E-07 -7.2916 0.41863E-07 -7.3782 0.81924E+00 -0.0866 19 Ca(HSiO3)+ 0.94690E-13 -13.0237 0.77753E-13 -13.1093 0.82113E+00 -0.0856 20 Mg(HSiO3)+ 0.58993E-16 -16.2292 0.48441E-16 -16.3148 0.82113E+00 -0.0856 21 NaHSiO3,aq 0.11990E-07 -7.9212 0.11990E-07 -7.9212 0.10000E+01 0.0000 22 AlO+ 0.55566E-10 -10.2552 0.45627E-10 -10.3408 0.82113E+00 -0.0856 23 AlOH+2 0.10798E-10 -10.9667 0.51790E-11 -11.2858 0.47963E+00 -0.3191 24 HAlO2,aq 0.39759E-09 -9.4006 0.39759E-09 -9.4006 0.10000E+01 0.0000 25 AlO2- 0.47230E-10 -10.3258 0.38608E-10 -10.4133 0.81746E+00 -0.0875 26 CH4,aq 0.37141E-09 -9.4302 0.36175E-09 -9.4416 0.97400E+00 -0.0114 31 CO,aq 0.10315E-10 -10.9865 0.10315E-10 -10.9865 0.10000E+01 0.0000 32 CO2,aq 0.12219E+00 -0.9130 0.11902E+00 -0.9244 0.97400E+00 -0.0114 33 CO3-2 0.19307E-07 -7.7143 0.93387E-08 -8.0297 0.48368E+00 -0.3154 34 CaCO3,aq 0.95498E-11 -11.0200 0.95498E-11 -11.0200 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61789E-08 -8.2091 0.50737E-08 -8.2947 0.82113E+00 -0.0856 36 CaCl+ 0.13579E-08 -8.8671 0.11150E-08 -8.9527 0.82113E+00 -0.0856 37 CaCl2,aq 0.22379E-11 -11.6502 0.22379E-11 -11.6502 0.10000E+01 0.0000 38 CaF+ 0.72018E-09 -9.1426 0.59136E-09 -9.2281 0.82113E+00 -0.0856 39 CaOH+ 0.30973E-12 -12.5090 0.25433E-12 -12.5946 0.82113E+00 -0.0856 40 CaSO4,aq 0.47159E-07 -7.3264 0.47159E-07 -7.3264 0.10000E+01 0.0000 41 HCl,aq 0.35290E-07 -7.4524 0.35290E-07 -7.4524 0.10000E+01 0.0000 45 HF,aq 0.77502E-04 -4.1107 0.77502E-04 -4.1107 0.10000E+01 0.0000 46 HF2- 0.15863E-07 -7.7996 0.12996E-07 -7.8862 0.81924E+00 -0.0866 48 FeCl+ 0.10703E-14 -14.9705 0.87883E-15 -15.0561 0.82113E+00 -0.0856 51 FeF+ 0.20313E-14 -14.6922 0.16680E-14 -14.7778 0.82113E+00 -0.0856 54 FeOH+ 0.11400E-15 -15.9431 0.93607E-16 -16.0287 0.82113E+00 -0.0856 60 H2,aq 0.35331E-08 -8.4518 0.34413E-08 -8.4633 0.97400E+00 -0.0114 61 KCl,aq 0.18674E-07 -7.7288 0.18674E-07 -7.7288 0.10000E+01 0.0000 62 KHSO4,aq 0.14314E-10 -10.8442 0.14314E-10 -10.8442 0.10000E+01 0.0000 63 KOH,aq 0.22790E-11 -11.6423 0.22790E-11 -11.6423 0.10000E+01 0.0000 64 KSO4- 0.42067E-05 -5.3761 0.34463E-05 -5.4627 0.81924E+00 -0.0866 65 MgCO3,aq 0.11983E-14 -14.9214 0.11983E-14 -14.9214 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31607E-11 -11.5002 0.25953E-11 -11.5858 0.82113E+00 -0.0856 67 MgCl+ 0.61610E-12 -12.2103 0.50590E-12 -12.2959 0.82113E+00 -0.0856 68 MgF+ 0.13355E-11 -11.8744 0.10966E-11 -11.9599 0.82113E+00 -0.0856 69 MgOH+ 0.85797E-15 -15.0665 0.70451E-15 -15.1521 0.82113E+00 -0.0856 71 MnF+ 0.92377E-11 -11.0344 0.75854E-11 -11.1200 0.82113E+00 -0.0856 72 MnO,aq 0.18025E-17 -17.7441 0.18025E-17 -17.7441 0.10000E+01 0.0000 73 MnOH+ 0.14611E-12 -12.8353 0.11998E-12 -12.9209 0.82113E+00 -0.0856 78 MnCl+ 0.57449E-10 -10.2407 0.47173E-10 -10.3263 0.82113E+00 -0.0856 79 MnSO4,aq 0.47669E-09 -9.3218 0.47669E-09 -9.3218 0.10000E+01 0.0000 80 NaCl,aq 0.49578E-04 -4.3047 0.49578E-04 -4.3047 0.10000E+01 0.0000 81 NaF,aq 0.20590E-05 -5.6863 0.20590E-05 -5.6863 0.10000E+01 0.0000 82 NaOH,aq 0.33291E-09 -9.4777 0.33291E-09 -9.4777 0.10000E+01 0.0000 84 OH- 0.30926E-07 -7.5097 0.25281E-07 -7.5972 0.81746E+00 -0.0875 91 H2PO3- 0.52192E-19 -19.2824 0.42758E-19 -19.3690 0.81924E+00 -0.0866 92 H3PO4,aq 0.31618E-09 -9.5001 0.31618E-09 -9.5001 0.10000E+01 0.0000 93 H2PO4- 0.44605E-07 -7.3506 0.36584E-07 -7.4367 0.82018E+00 -0.0861 94 PO4-3 0.14818E-16 -16.8292 0.31139E-17 -17.5067 0.21015E+00 -0.6775 96 H3P2O7- 0.90337E-18 -18.0441 0.74008E-18 -18.1307 0.81924E+00 -0.0866 97 H2P2O7-2 0.21753E-15 -15.6625 0.10521E-15 -15.9779 0.48368E+00 -0.3154 98 HP2O7-3 0.46474E-17 -17.3328 0.92162E-18 -18.0354 0.19831E+00 -0.7027 100 H2S,aq 0.20178E-01 -1.6951 0.19654E-01 -1.7066 0.97400E+00 -0.0114 101 S2-2 0.10360E-08 -8.9847 0.50108E-09 -9.3001 0.48368E+00 -0.3154 102 S3-2 0.79712E-08 -8.0985 0.38556E-08 -8.4139 0.48368E+00 -0.3154 103 S3- 0.12259E-05 -5.9116 0.10043E-05 -5.9981 0.81924E+00 -0.0866 104 S4-2 0.40515E-07 -7.3924 0.19597E-07 -7.7078 0.48368E+00 -0.3154 105 S5-2 0.13731E-06 -6.8623 0.66417E-07 -7.1777 0.48368E+00 -0.3154 106 SO2,aq 0.14617E-10 -10.8351 0.14617E-10 -10.8351 0.10000E+01 0.0000 107 SO3-2 0.16589E-11 -11.7802 0.81642E-12 -12.0881 0.49214E+00 -0.3079 108 HSO3- 0.14224E-08 -8.8470 0.11653E-08 -8.9336 0.81924E+00 -0.0866 109 HSO4- 0.48661E-04 -4.3128 0.40004E-04 -4.3979 0.82211E+00 -0.0851 111 S2O3-2 0.87141E-06 -6.0598 0.42149E-06 -6.3752 0.48368E+00 -0.3154 112 HS2O3- 0.20970E-08 -8.6784 0.17179E-08 -8.7650 0.81924E+00 -0.0866 113 H2S2O3,aq 0.62780E-12 -12.2022 0.62780E-12 -12.2022 0.10000E+01 0.0000 121 S4O6-2 0.11769E-13 -13.9292 0.56927E-14 -14.2447 0.48368E+00 -0.3154 Charge balance for all species = -.5958E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2762323E-04 0.1425301E+00 0.1425776E+03 0.0000 2 H2O 0.1000000E+01 0.5538605E+02 0.9902659E+06 0.0000 3 Cl- 0.1031224E-01 0.1036188E-01 0.3645872E+03 2.5689 4 SO4-- 0.3755190E-02 0.3809917E-02 0.3632246E+03 6.5446 5 HCO3- 0.2969693E-02 0.1251631E+00 0.7579463E+04 2.0290 6 HS- 0.3404560E-03 0.2052318E-01 0.6736202E+03 1.0877 7 Al+++ 0.8822393E-12 0.5120644E-09 0.1371199E-04 1.1688 8 H4SiO4 0.1019389E-02 0.1019452E-02 0.9724558E+02 -2.9917 9 Ca++ 0.1696894E-06 0.2251175E-06 0.8954167E-02 2.1958 10 Mg++ 0.8541934E-10 0.9053370E-10 0.2184444E-05 -1.1048 11 Fe++ 0.1373230E-12 0.1405386E-12 0.7789425E-08 -3.8980 12 K+ 0.1485653E-03 0.1527906E-03 0.5929330E+01 0.7284 13 Na+ 0.2162036E-01 0.2167201E-01 0.4944749E+03 2.8903 14 Mn++ 0.1892763E-08 0.2436286E-08 0.1328345E-03 0.2418 15 F- 0.6077355E-03 0.6873293E-03 0.1295933E+02 1.3382 16 HPO4-- 0.1793756E-09 0.4510084E-07 0.4296064E-02 -0.7762 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1522524E+00 0.1317453E+00 0.2050710E-01 0.0000000E+00 2 H2O 0.5115632E+02 0.5119515E+02 -.3882998E-01 0.0000000E+00 3 Cl- 0.9577825E-02 0.9577825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7624967E-02 0.3521632E-02 0.4103336E-02 0.0000000E+00 5 HCO3- 0.1156923E+00 0.1156923E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3128029E-01 0.1897025E-01 0.1231004E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4733179E-09 0.4774879E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9423135E-03 0.1121071E-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 0.1299045E-12 0.3259214E-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- 0.6400960E-03 0.6353211E-03 0.4774879E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1194E-18 Mass of aqueous solution: 0.931362E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3259E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6734 -0.172 56.11 0.2543 sulfur 0.1641E-01 -1.785 0.5262 -0.279 43.85 0.2546 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3661E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.200050 g Volume = 0.509004 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: 1.5999900 moles log = 0.2041 Original solution: 1000.0103000 g Original solution / Rock added: 625.01 (Water/Rock Ratio), log = 2.7959 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 14.9488 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7317E-01 0.9174 0.1003E+01 0.1094E+01 CO2,gas 0.8886E+00 0.9586 0.1273E+02 0.1328E+02 CH4,gas 0.3517E-07 1.0127 0.5325E-06 0.5258E-06 H2,gas 0.2998E-06 1.0080 0.4518E-05 0.4482E-05 H2S,gas 0.3828E-01 0.9441 0.5403E+00 0.5723E+00 S2,gas 0.3591E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1028E-08 1.0000 0.1537E-07 0.1537E-07 SO3,gas 0.2400E-28 1.0000 0.3587E-27 0.3587E-27 SO2,gas 0.4228E-11 1.0000 0.6321E-10 0.6321E-10 HF,gas 0.1273E-07 1.0000 0.1903E-06 0.1903E-06 HCl,gas 0.4166E-11 1.0000 0.6227E-10 0.6227E-10 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 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.75827E-12 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 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 -1.698 0.28984E+04 0.001 2 CO2,gas -6.66 -7.25 -0.59 -0.198 0.10143E+04 1.105 3 CH4,gas 4.54 -3.43 -7.97 -1.993 0.13613E+05 -6.274 4 H2,gas 8.00 0.96 -7.04 -4.025 0.12027E+05 -5.345 5 H2S,gas -6.23 -8.20 -1.97 -0.983 0.33575E+04 -0.267 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.30 -9.51 -2.927 0.16242E+05 -7.813 8 SO3,gas 17.12 -12.02 -29.14 -7.286 0.49763E+05 -27.445 9 SO2,gas 0.83 -11.07 -11.90 -3.173 0.20316E+05 -10.199 10 HF,gas 0.47 -7.95 -8.42 -4.210 0.14376E+05 -6.721 11 HCl,gas 5.19 -6.72 -11.90 -5.952 0.20327E+05 -10.206 17 albite -0.38 -4.91 -4.53 -0.348 0.77306E+04 25 anhydrite -5.32 -9.83 -4.51 -2.256 0.77032E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.17 -1.71 -0.285 0.29149E+04 69 diamond -3.10 -5.34 -2.24 -0.639 0.38214E+04 86 gibbsite 4.08 1.17 -2.91 -0.416 0.49753E+04 89 graphite -3.55 -5.34 -1.79 -0.513 0.30637E+04 101 kaolinite -1.33 -3.65 -2.31 -0.210 0.39512E+04 119 microcline -2.49 -7.07 -4.59 -0.353 0.78319E+04 149 pyrophyllite -6.18 -9.62 -3.45 -0.216 0.58887E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.20 -4.88 -0.610 0.83327E+04 218 gypsum -4.96 -9.83 -4.88 -1.219 0.83245E+04 237 boehmite 4.41 1.17 -3.24 -0.540 0.55318E+04 240 fluorite -9.93 -13.70 -3.77 -1.255 0.64299E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.5999900 MOLES New total amount of reactant added: 1.6399900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.6399900 Water: Moles liquid = 0.5134E+02 kg liquid = 0.9250E+00 Moles total = 0.5119E+02 kg total = 0.9222E+00 Activity = 0.9974 Stoichiometric ionic strength = .9843248E-01 Osmotic coef. = 0.8812 True ionic strength = .2541147E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9814E-06 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.28391E-04 -4.5468 0.23436E-04 -4.6301 0.82549E+00 -0.0833 2 H2O 0.99739E+00 -0.0011 0.99739E+00 -0.0011 3 Cl- 0.10559E-01 -1.9764 0.86531E-02 -2.0628 0.81952E+00 -0.0864 4 SO4-- 0.36294E-02 -2.4402 0.17626E-02 -2.7538 0.48566E+00 -0.3137 5 HCO3- 0.29585E-02 -2.5289 0.24288E-02 -2.6146 0.82097E+00 -0.0857 6 HS- 0.32850E-03 -3.4835 0.26926E-03 -3.5698 0.81967E+00 -0.0864 7 Al+++ 0.90971E-12 -12.0411 0.18080E-12 -12.7428 0.19875E+00 -0.7017 8 H4SiO4 0.10193E-02 -2.9917 0.10193E-02 -2.9917 0.10000E+01 0.0000 9 Ca++ 0.17063E-06 -6.7679 0.82134E-07 -7.0855 0.48136E+00 -0.3175 10 Mg++ 0.85321E-10 -10.0689 0.40844E-10 -10.3889 0.47871E+00 -0.3199 11 Fe++ 0.14604E-12 -12.8355 0.70004E-13 -13.1549 0.47934E+00 -0.3194 12 K+ 0.14859E-03 -3.8280 0.12202E-03 -3.9136 0.82119E+00 -0.0856 13 Na+ 0.21604E-01 -1.6655 0.17701E-01 -1.7520 0.81933E+00 -0.0865 14 Mn++ 0.19015E-08 -8.7209 0.91235E-09 -9.0398 0.47982E+00 -0.3189 15 F- 0.62060E-03 -3.2072 0.50734E-03 -3.2947 0.81750E+00 -0.0875 16 HPO4-- 0.17413E-09 -9.7591 0.84581E-10 -10.0727 0.48574E+00 -0.3136 17 SiF6-2 0.34745E-16 -16.4591 0.16831E-16 -16.7739 0.48442E+00 -0.3148 18 HSiO3- 0.49683E-07 -7.3038 0.40716E-07 -7.3902 0.81952E+00 -0.0864 19 Ca(HSiO3)+ 0.92720E-13 -13.0328 0.76160E-13 -13.1183 0.82141E+00 -0.0854 20 Mg(HSiO3)+ 0.57382E-16 -16.2412 0.47134E-16 -16.3267 0.82141E+00 -0.0854 21 NaHSiO3,aq 0.11656E-07 -7.9334 0.11656E-07 -7.9334 0.10000E+01 0.0000 22 AlO+ 0.54376E-10 -10.2646 0.44665E-10 -10.3500 0.82141E+00 -0.0854 23 AlOH+2 0.10850E-10 -10.9646 0.52123E-11 -11.2830 0.48038E+00 -0.3184 24 HAlO2,aq 0.37855E-09 -9.4219 0.37855E-09 -9.4219 0.10000E+01 0.0000 25 AlO2- 0.43723E-10 -10.3593 0.35754E-10 -10.4467 0.81775E+00 -0.0874 26 CH4,aq 0.36917E-09 -9.4328 0.35946E-09 -9.4443 0.97370E+00 -0.0116 31 CO,aq 0.10489E-10 -10.9793 0.10489E-10 -10.9793 0.10000E+01 0.0000 32 CO2,aq 0.12524E+00 -0.9023 0.12195E+00 -0.9138 0.97370E+00 -0.0116 33 CO3-2 0.18686E-07 -7.7285 0.90521E-08 -8.0433 0.48442E+00 -0.3148 34 CaCO3,aq 0.93225E-11 -11.0305 0.93225E-11 -11.0305 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61993E-08 -8.2077 0.50922E-08 -8.2931 0.82141E+00 -0.0854 36 CaCl+ 0.14002E-08 -8.8538 0.11502E-08 -8.9392 0.82141E+00 -0.0854 37 CaCl2,aq 0.23645E-11 -11.6263 0.23645E-11 -11.6263 0.10000E+01 0.0000 38 CaF+ 0.74067E-09 -9.1304 0.60839E-09 -9.2158 0.82141E+00 -0.0854 39 CaOH+ 0.30328E-12 -12.5182 0.24912E-12 -12.6036 0.82141E+00 -0.0854 40 CaSO4,aq 0.45972E-07 -7.3375 0.45972E-07 -7.3375 0.10000E+01 0.0000 41 HCl,aq 0.37162E-07 -7.4299 0.37162E-07 -7.4299 0.10000E+01 0.0000 45 HF,aq 0.81396E-04 -4.0894 0.81396E-04 -4.0894 0.10000E+01 0.0000 46 HF2- 0.17013E-07 -7.7692 0.13942E-07 -7.8557 0.81952E+00 -0.0864 48 FeCl+ 0.11673E-14 -14.9328 0.95881E-15 -15.0183 0.82141E+00 -0.0854 51 FeF+ 0.22095E-14 -14.6557 0.18149E-14 -14.7411 0.82141E+00 -0.0854 54 FeOH+ 0.11806E-15 -15.9279 0.96977E-16 -16.0133 0.82141E+00 -0.0854 60 H2,aq 0.35071E-08 -8.4550 0.34149E-08 -8.4666 0.97370E+00 -0.0116 61 KCl,aq 0.19137E-07 -7.7181 0.19137E-07 -7.7181 0.10000E+01 0.0000 62 KHSO4,aq 0.14252E-10 -10.8461 0.14252E-10 -10.8461 0.10000E+01 0.0000 63 KOH,aq 0.22177E-11 -11.6541 0.22177E-11 -11.6541 0.10000E+01 0.0000 64 KSO4- 0.40725E-05 -5.3901 0.33375E-05 -5.4766 0.81952E+00 -0.0864 65 MgCO3,aq 0.11620E-14 -14.9348 0.11620E-14 -14.9348 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31500E-11 -11.5017 0.25875E-11 -11.5871 0.82141E+00 -0.0854 67 MgCl+ 0.63110E-12 -12.1999 0.51839E-12 -12.2853 0.82141E+00 -0.0854 68 MgF+ 0.13644E-11 -11.8651 0.11207E-11 -11.9505 0.82141E+00 -0.0854 69 MgOH+ 0.83454E-15 -15.0786 0.68550E-15 -15.1640 0.82141E+00 -0.0854 71 MnF+ 0.94916E-11 -11.0227 0.77964E-11 -11.1081 0.82141E+00 -0.0854 72 MnO,aq 0.17157E-17 -17.7656 0.17157E-17 -17.7656 0.10000E+01 0.0000 73 MnOH+ 0.14294E-12 -12.8449 0.11741E-12 -12.9303 0.82141E+00 -0.0854 78 MnCl+ 0.59185E-10 -10.2278 0.48615E-10 -10.3132 0.82141E+00 -0.0854 79 MnSO4,aq 0.46426E-09 -9.3332 0.46426E-09 -9.3332 0.10000E+01 0.0000 80 NaCl,aq 0.50759E-04 -4.2945 0.50759E-04 -4.2945 0.10000E+01 0.0000 81 NaF,aq 0.21024E-05 -5.6773 0.21024E-05 -5.6773 0.10000E+01 0.0000 82 NaOH,aq 0.32365E-09 -9.4899 0.32365E-09 -9.4899 0.10000E+01 0.0000 84 OH- 0.30069E-07 -7.5219 0.24589E-07 -7.6093 0.81775E+00 -0.0874 91 H2PO3- 0.51753E-19 -19.2861 0.42413E-19 -19.3725 0.81952E+00 -0.0864 92 H3PO4,aq 0.32492E-09 -9.4882 0.32492E-09 -9.4882 0.10000E+01 0.0000 93 H2PO4- 0.44569E-07 -7.3510 0.36567E-07 -7.4369 0.82046E+00 -0.0859 94 PO4-3 0.13966E-16 -16.8549 0.29445E-17 -17.5310 0.21084E+00 -0.6761 96 H3P2O7- 0.92763E-18 -18.0326 0.76021E-18 -18.1191 0.81952E+00 -0.0864 97 H2P2O7-2 0.21701E-15 -15.6635 0.10512E-15 -15.9783 0.48442E+00 -0.3148 98 HP2O7-3 0.45005E-17 -17.3467 0.89564E-18 -18.0479 0.19901E+00 -0.7011 100 H2S,aq 0.20030E-01 -1.6983 0.19503E-01 -1.7099 0.97370E+00 -0.0116 101 S2-2 0.97111E-09 -9.0127 0.47043E-09 -9.3275 0.48442E+00 -0.3148 102 S3-2 0.74721E-08 -8.1266 0.36197E-08 -8.4413 0.48442E+00 -0.3148 103 S3- 0.11874E-05 -5.9254 0.97308E-06 -6.0119 0.81952E+00 -0.0864 104 S4-2 0.37979E-07 -7.4205 0.18398E-07 -7.7352 0.48442E+00 -0.3148 105 S5-2 0.12872E-06 -6.8904 0.62353E-07 -7.2051 0.48442E+00 -0.3148 106 SO2,aq 0.14842E-10 -10.8285 0.14842E-10 -10.8285 0.10000E+01 0.0000 107 SO3-2 0.15912E-11 -11.7983 0.78424E-12 -12.1056 0.49285E+00 -0.3073 108 HSO3- 0.14042E-08 -8.8526 0.11508E-08 -8.9390 0.81952E+00 -0.0864 109 HSO4- 0.48409E-04 -4.3151 0.39811E-04 -4.4000 0.82238E+00 -0.0849 111 S2O3-2 0.83579E-06 -6.0779 0.40487E-06 -6.3927 0.48442E+00 -0.3148 112 HS2O3- 0.20702E-08 -8.6840 0.16966E-08 -8.7704 0.81952E+00 -0.0864 113 H2S2O3,aq 0.63743E-12 -12.1956 0.63743E-12 -12.1956 0.10000E+01 0.0000 121 S4O6-2 0.11550E-13 -13.9374 0.55951E-14 -14.2522 0.48442E+00 -0.3148 Charge balance for all species = -.5954E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2839081E-04 0.1454338E+00 0.1454642E+03 0.0000 2 H2O 0.1000000E+01 0.5538300E+02 0.9900890E+06 0.0000 3 Cl- 0.1055876E-01 0.1060957E-01 0.3732563E+03 2.5673 4 SO4-- 0.3629355E-02 0.3683624E-02 0.3511408E+03 6.5064 5 HCO3- 0.2958476E-02 0.1281997E+00 0.7762391E+04 2.0155 6 HS- 0.3284972E-03 0.2036264E-01 0.6682682E+03 1.0603 7 Al+++ 0.9097077E-12 0.4884079E-09 0.1307690E-04 1.1475 8 H4SiO4 0.1019283E-02 0.1019345E-02 0.9722326E+02 -2.9917 9 Ca++ 0.1706315E-06 0.2249558E-06 0.8946631E-02 2.1748 10 Mg++ 0.8532113E-10 0.9046869E-10 0.2182605E-05 -1.1286 11 Fe++ 0.1460438E-12 0.1495387E-12 0.8287238E-08 -3.8947 12 K+ 0.1485893E-03 0.1526809E-03 0.5924339E+01 0.7165 13 Na+ 0.2160357E-01 0.2165645E-01 0.4940588E+03 2.8781 14 Mn++ 0.1901461E-08 0.2434536E-08 0.1327227E-03 0.2204 15 F- 0.6205995E-03 0.7041331E-03 0.1327452E+02 1.3354 16 HPO4-- 0.1741274E-09 0.4506845E-07 0.4292449E-02 -0.8125 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1565594E+00 0.1345258E+00 0.2203355E-01 0.0000000E+00 2 H2O 0.5118907E+02 0.5122912E+02 -.4004999E-01 0.0000000E+00 3 Cl- 0.9813825E-02 0.9813825E-02 0.0000000E+00 0.0000000E+00 4 SO4-- 0.7815967E-02 0.3407341E-02 0.4408626E-02 0.0000000E+00 5 HCO3- 0.1185843E+00 0.1185843E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3206129E-01 0.1883538E-01 0.1322591E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4517759E-09 0.4774900E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9428907E-03 0.1121013E-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 0.1383229E-12 0.3259213E-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- 0.6560960E-03 0.6513211E-03 0.4774900E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1445E-17 Mass of aqueous solution: 0.932146E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.6399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3156E-03 0.7802E-06 quartz 0.1121E-01 -1.950 0.6734 -0.172 54.34 0.2543 sulfur 0.1763E-01 -1.754 0.5654 -0.248 45.62 0.2735 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3546E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.239166 g Volume = 0.527932 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: 1.6399900 moles log = 0.2148 Original solution: 1000.0103000 g Original solution / Rock added: 609.77 (Water/Rock Ratio), log = 2.7852 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 15.2873 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7166E-01 0.9159 0.1003E+01 0.1096E+01 CO2,gas 0.8911E+00 0.9577 0.1305E+02 0.1362E+02 CH4,gas 0.3417E-07 1.0129 0.5291E-06 0.5224E-06 H2,gas 0.2909E-06 1.0082 0.4483E-05 0.4447E-05 H2S,gas 0.3720E-01 0.9429 0.5361E+00 0.5686E+00 S2,gas 0.3511E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1022E-08 1.0000 0.1563E-07 0.1563E-07 SO3,gas 0.2401E-28 1.0000 0.3670E-27 0.3670E-27 SO2,gas 0.4199E-11 1.0000 0.6418E-10 0.6418E-10 HF,gas 0.1307E-07 1.0000 0.1999E-06 0.1999E-06 HCl,gas 0.4289E-11 1.0000 0.6557E-10 0.6557E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 -0.30331E-11 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 -1.698 0.28985E+04 0.001 2 CO2,gas -6.66 -7.24 -0.58 -0.194 0.99624E+03 1.116 3 CH4,gas 4.54 -3.43 -7.98 -1.994 0.13618E+05 -6.276 4 H2,gas 8.00 0.95 -7.05 -4.027 0.12033E+05 -5.348 5 H2S,gas -6.23 -8.20 -1.97 -0.985 0.33632E+04 -0.271 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.29 -9.51 -2.925 0.16230E+05 -7.806 8 SO3,gas 17.12 -12.01 -29.13 -7.284 0.49746E+05 -27.435 9 SO2,gas 0.83 -11.06 -11.89 -3.171 0.20304E+05 -10.193 10 HF,gas 0.47 -7.92 -8.40 -4.199 0.14340E+05 -6.699 11 HCl,gas 5.19 -6.69 -11.88 -5.941 0.20289E+05 -10.183 17 albite -0.38 -4.94 -4.56 -0.351 0.77879E+04 25 anhydrite -5.32 -9.84 -4.52 -2.261 0.77221E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.15 -1.73 -0.288 0.29512E+04 69 diamond -3.10 -5.34 -2.23 -0.638 0.38147E+04 86 gibbsite 4.08 1.14 -2.94 -0.419 0.50117E+04 89 graphite -3.55 -5.34 -1.79 -0.512 0.30570E+04 101 kaolinite -1.33 -3.69 -2.36 -0.214 0.40240E+04 119 microcline -2.49 -7.11 -4.62 -0.355 0.78885E+04 149 pyrophyllite -6.18 -9.67 -3.49 -0.218 0.59615E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.22 -4.90 -0.613 0.83720E+04 218 gypsum -4.96 -9.84 -4.89 -1.222 0.83435E+04 237 boehmite 4.41 1.15 -3.26 -0.544 0.55682E+04 240 fluorite -9.93 -13.67 -3.74 -1.248 0.63930E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.6399900 MOLES New total amount of reactant added: 1.6799900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.6799900 Water: Moles liquid = 0.5138E+02 kg liquid = 0.9257E+00 Moles total = 0.5122E+02 kg total = 0.9228E+00 Activity = 0.9973 Stoichiometric ionic strength = .9975292E-01 Osmotic coef. = 0.8821 True ionic strength = .2527100E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1005E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.29187E-04 -4.5348 0.24101E-04 -4.6180 0.82574E+00 -0.0832 2 H2O 0.99734E+00 -0.0012 0.99734E+00 -0.0012 3 Cl- 0.10805E-01 -1.9664 0.88579E-02 -2.0527 0.81980E+00 -0.0863 4 SO4-- 0.35049E-02 -2.4553 0.17047E-02 -2.7683 0.48639E+00 -0.3130 5 HCO3- 0.29448E-02 -2.5309 0.24184E-02 -2.6165 0.82124E+00 -0.0855 6 HS- 0.31692E-03 -3.4991 0.25985E-03 -3.5853 0.81995E+00 -0.0862 7 Al+++ 0.93919E-12 -12.0272 0.18732E-12 -12.7274 0.19945E+00 -0.7002 8 H4SiO4 0.10192E-02 -2.9918 0.10192E-02 -2.9918 0.10000E+01 0.0000 9 Ca++ 0.17158E-06 -6.7655 0.82720E-07 -7.0824 0.48210E+00 -0.3169 10 Mg++ 0.85226E-10 -10.0694 0.40862E-10 -10.3887 0.47945E+00 -0.3193 11 Fe++ 0.15538E-12 -12.8086 0.74595E-13 -13.1273 0.48008E+00 -0.3187 12 K+ 0.14861E-03 -3.8279 0.12208E-03 -3.9134 0.82147E+00 -0.0854 13 Na+ 0.21587E-01 -1.6658 0.17693E-01 -1.7522 0.81961E+00 -0.0864 14 Mn++ 0.19102E-08 -8.7189 0.91797E-09 -9.0372 0.48056E+00 -0.3183 15 F- 0.63328E-03 -3.1984 0.51789E-03 -3.2858 0.81779E+00 -0.0874 16 HPO4-- 0.16899E-09 -9.7721 0.82209E-10 -10.0851 0.48647E+00 -0.3129 17 SiF6-2 0.43905E-16 -16.3575 0.21301E-16 -16.6716 0.48515E+00 -0.3141 18 HSiO3- 0.48294E-07 -7.3161 0.39591E-07 -7.4024 0.81980E+00 -0.0863 19 Ca(HSiO3)+ 0.90770E-13 -13.0421 0.74584E-13 -13.1274 0.82168E+00 -0.0853 20 Mg(HSiO3)+ 0.55802E-16 -16.2533 0.45851E-16 -16.3386 0.82168E+00 -0.0853 21 NaHSiO3,aq 0.11329E-07 -7.9458 0.11329E-07 -7.9458 0.10000E+01 0.0000 22 AlO+ 0.53251E-10 -10.2737 0.43755E-10 -10.3590 0.82168E+00 -0.0853 23 AlOH+2 0.10914E-10 -10.9620 0.52510E-11 -11.2798 0.48112E+00 -0.3177 24 HAlO2,aq 0.36059E-09 -9.4430 0.36059E-09 -9.4430 0.10000E+01 0.0000 25 AlO2- 0.40486E-10 -10.3927 0.33119E-10 -10.4799 0.81804E+00 -0.0872 26 CH4,aq 0.36689E-09 -9.4355 0.35713E-09 -9.4472 0.97340E+00 -0.0117 31 CO,aq 0.10660E-10 -10.9722 0.10660E-10 -10.9722 0.10000E+01 0.0000 32 CO2,aq 0.12829E+00 -0.8918 0.12487E+00 -0.9035 0.97340E+00 -0.0117 33 CO3-2 0.18066E-07 -7.7431 0.87646E-08 -8.0573 0.48515E+00 -0.3141 34 CaCO3,aq 0.90909E-11 -11.0414 0.90909E-11 -11.0414 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.62147E-08 -8.2066 0.51065E-08 -8.2919 0.82168E+00 -0.0853 36 CaCl+ 0.14431E-08 -8.8407 0.11858E-08 -8.9260 0.82168E+00 -0.0853 37 CaCl2,aq 0.24954E-11 -11.6029 0.24954E-11 -11.6029 0.10000E+01 0.0000 38 CaF+ 0.76121E-09 -9.1185 0.62547E-09 -9.2038 0.82168E+00 -0.0853 39 CaOH+ 0.29691E-12 -12.5274 0.24396E-12 -12.6127 0.82168E+00 -0.0853 40 CaSO4,aq 0.44779E-07 -7.3489 0.44779E-07 -7.3489 0.10000E+01 0.0000 41 HCl,aq 0.39120E-07 -7.4076 0.39120E-07 -7.4076 0.10000E+01 0.0000 45 HF,aq 0.85446E-04 -4.0683 0.85446E-04 -4.0683 0.10000E+01 0.0000 46 HF2- 0.18225E-07 -7.7393 0.14941E-07 -7.8256 0.81980E+00 -0.0863 48 FeCl+ 0.12728E-14 -14.8952 0.10459E-14 -14.9805 0.82168E+00 -0.0853 51 FeF+ 0.24026E-14 -14.6193 0.19742E-14 -14.7046 0.82168E+00 -0.0853 54 FeOH+ 0.12229E-15 -15.9126 0.10048E-15 -15.9979 0.82168E+00 -0.0853 60 H2,aq 0.34817E-08 -8.4582 0.33891E-08 -8.4699 0.97340E+00 -0.0117 61 KCl,aq 0.19599E-07 -7.7078 0.19599E-07 -7.7078 0.10000E+01 0.0000 62 KHSO4,aq 0.14181E-10 -10.8483 0.14181E-10 -10.8483 0.10000E+01 0.0000 63 KOH,aq 0.21574E-11 -11.6661 0.21574E-11 -11.6661 0.10000E+01 0.0000 64 KSO4- 0.39393E-05 -5.4046 0.32294E-05 -5.4909 0.81980E+00 -0.0863 65 MgCO3,aq 0.11256E-14 -14.9486 0.11256E-14 -14.9486 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31369E-11 -11.5035 0.25775E-11 -11.5888 0.82168E+00 -0.0853 67 MgCl+ 0.64610E-12 -12.1897 0.53089E-12 -12.2750 0.82168E+00 -0.0853 68 MgF+ 0.13929E-11 -11.8561 0.11445E-11 -11.9414 0.82168E+00 -0.0853 69 MgOH+ 0.81157E-15 -15.0907 0.66685E-15 -15.1760 0.82168E+00 -0.0853 71 MnF+ 0.97454E-11 -11.0112 0.80076E-11 -11.0965 0.82168E+00 -0.0853 72 MnO,aq 0.16323E-17 -17.7872 0.16323E-17 -17.7872 0.10000E+01 0.0000 73 MnOH+ 0.13980E-12 -12.8545 0.11487E-12 -12.9398 0.82168E+00 -0.0853 78 MnCl+ 0.60938E-10 -10.2151 0.50072E-10 -10.3004 0.82168E+00 -0.0853 79 MnSO4,aq 0.45177E-09 -9.3451 0.45177E-09 -9.3451 0.10000E+01 0.0000 80 NaCl,aq 0.51938E-04 -4.2845 0.51938E-04 -4.2845 0.10000E+01 0.0000 81 NaF,aq 0.21452E-05 -5.6685 0.21452E-05 -5.6685 0.10000E+01 0.0000 82 NaOH,aq 0.31457E-09 -9.5023 0.31457E-09 -9.5023 0.10000E+01 0.0000 84 OH- 0.29228E-07 -7.5342 0.23909E-07 -7.6214 0.81804E+00 -0.0872 91 H2PO3- 0.51323E-19 -19.2897 0.42075E-19 -19.3760 0.81980E+00 -0.0863 92 H3PO4,aq 0.33397E-09 -9.4763 0.33397E-09 -9.4763 0.10000E+01 0.0000 93 H2PO4- 0.44533E-07 -7.3513 0.36550E-07 -7.4371 0.82073E+00 -0.0858 94 PO4-3 0.13157E-16 -16.8808 0.27830E-17 -17.5555 0.21153E+00 -0.6746 96 H3P2O7- 0.95276E-18 -18.0210 0.78107E-18 -18.1073 0.81980E+00 -0.0863 97 H2P2O7-2 0.21648E-15 -15.6646 0.10503E-15 -15.9787 0.48515E+00 -0.3141 98 HP2O7-3 0.43571E-17 -17.3608 0.87015E-18 -18.0604 0.19971E+00 -0.6996 100 H2S,aq 0.19885E-01 -1.7015 0.19356E-01 -1.7132 0.97340E+00 -0.0117 101 S2-2 0.90997E-09 -9.0410 0.44147E-09 -9.3551 0.48515E+00 -0.3141 102 S3-2 0.70017E-08 -8.1548 0.33969E-08 -8.4689 0.48515E+00 -0.3141 103 S3- 0.11499E-05 -5.9394 0.94266E-06 -6.0256 0.81980E+00 -0.0863 104 S4-2 0.35588E-07 -7.4487 0.17265E-07 -7.7628 0.48515E+00 -0.3141 105 S5-2 0.12061E-06 -6.9186 0.58516E-07 -7.2327 0.48515E+00 -0.3141 106 SO2,aq 0.15067E-10 -10.8220 0.15067E-10 -10.8220 0.10000E+01 0.0000 107 SO3-2 0.15252E-11 -11.8167 0.75279E-12 -12.1233 0.49356E+00 -0.3067 108 HSO3- 0.13857E-08 -8.8583 0.11360E-08 -8.9446 0.81980E+00 -0.0863 109 HSO4- 0.48131E-04 -4.3176 0.39595E-04 -4.4024 0.82265E+00 -0.0848 111 S2O3-2 0.80106E-06 -6.0963 0.38863E-06 -6.4105 0.48515E+00 -0.3141 112 HS2O3- 0.20429E-08 -8.6898 0.16747E-08 -8.7761 0.81980E+00 -0.0863 113 H2S2O3,aq 0.64707E-12 -12.1891 0.64707E-12 -12.1891 0.10000E+01 0.0000 121 S4O6-2 0.11323E-13 -13.9460 0.54934E-14 -14.2602 0.48515E+00 -0.3141 Charge balance for all species = -.5950E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2918700E-04 0.1483390E+00 0.1483517E+03 0.0000 2 H2O 0.1000000E+01 0.5537996E+02 0.9899121E+06 0.0000 3 Cl- 0.1080492E-01 0.1085691E-01 0.3819108E+03 2.5653 4 SO4-- 0.3504867E-02 0.3558655E-02 0.3391863E+03 6.4676 5 HCO3- 0.2944793E-02 0.1312320E+00 0.7945010E+04 2.0015 6 HS- 0.3169157E-03 0.2020576E-01 0.6630376E+03 1.0327 7 Al+++ 0.9391882E-12 0.4661777E-09 0.1248016E-04 1.1265 8 H4SiO4 0.1019177E-02 0.1019237E-02 0.9720094E+02 -2.9918 9 Ca++ 0.1715846E-06 0.2247944E-06 0.8939107E-02 2.1535 10 Mg++ 0.8522591E-10 0.9040378E-10 0.2180770E-05 -1.1528 11 Fe++ 0.1553798E-12 0.1591776E-12 0.8820317E-08 -3.8914 12 K+ 0.1486125E-03 0.1525714E-03 0.5919357E+01 0.7046 13 Na+ 0.2158681E-01 0.2164091E-01 0.4936432E+03 2.8658 14 Mn++ 0.1910198E-08 0.2432790E-08 0.1326111E-03 0.1988 15 F- 0.6332842E-03 0.7209128E-03 0.1358918E+02 1.3322 16 HPO4-- 0.1689905E-09 0.4503612E-07 0.4288839E-02 -0.8492 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1608664E+00 0.1373117E+00 0.2355471E-01 0.0000000E+00 2 H2O 0.5122182E+02 0.5126308E+02 -.4126576E-01 0.0000000E+00 3 Cl- 0.1004983E-01 0.1004983E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8006967E-02 0.3294109E-02 0.4712858E-02 0.0000000E+00 5 HCO3- 0.1214763E+00 0.1214763E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3284229E-01 0.1870369E-01 0.1413861E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4315226E-09 0.4774920E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9434678E-03 0.1120955E-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 0.1473445E-12 0.3259212E-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- 0.6720960E-03 0.6673211E-03 0.4774920E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1307E-17 Mass of aqueous solution: 0.932931E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.6799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.3059E-03 0.7802E-06 quartz 0.1121E-01 -1.951 0.6733 -0.172 52.68 0.2543 sulfur 0.1885E-01 -1.725 0.6044 -0.219 47.29 0.2924 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3438E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.278146 g Volume = 0.546794 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: 1.6799900 moles log = 0.2253 Original solution: 1000.0103000 g Original solution / Rock added: 595.25 (Water/Rock Ratio), log = 2.7747 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 15.6261 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7022E-01 0.9143 0.1003E+01 0.1097E+01 CO2,gas 0.8936E+00 0.9568 0.1336E+02 0.1396E+02 CH4,gas 0.3320E-07 1.0131 0.5257E-06 0.5189E-06 H2,gas 0.2824E-06 1.0084 0.4450E-05 0.4413E-05 H2S,gas 0.3616E-01 0.9416 0.5321E+00 0.5651E+00 S2,gas 0.3435E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1017E-08 1.0000 0.1589E-07 0.1589E-07 SO3,gas 0.2402E-28 1.0000 0.3754E-27 0.3754E-27 SO2,gas 0.4170E-11 1.0000 0.6516E-10 0.6516E-10 HF,gas 0.1343E-07 1.0000 0.2098E-06 0.2098E-06 HCl,gas 0.4417E-11 1.0000 0.6903E-10 0.6903E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 0.12132E-10 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 -1.698 0.28985E+04 0.001 2 CO2,gas -6.66 -7.23 -0.57 -0.191 0.97865E+03 1.126 3 CH4,gas 4.54 -3.43 -7.98 -1.995 0.13623E+05 -6.279 4 H2,gas 8.00 0.95 -7.05 -4.029 0.12039E+05 -5.352 5 H2S,gas -6.23 -8.20 -1.97 -0.986 0.33688E+04 -0.274 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.28 -9.50 -2.922 0.16218E+05 -7.799 8 SO3,gas 17.12 -12.00 -29.12 -7.281 0.49729E+05 -27.426 9 SO2,gas 0.83 -11.05 -11.89 -3.169 0.20293E+05 -10.186 10 HF,gas 0.47 -7.90 -8.38 -4.189 0.14304E+05 -6.678 11 HCl,gas 5.19 -6.67 -11.86 -5.930 0.20251E+05 -10.161 17 albite -0.38 -4.98 -4.59 -0.353 0.78450E+04 25 anhydrite -5.32 -9.85 -4.53 -2.267 0.77416E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.12 -1.75 -0.292 0.29873E+04 69 diamond -3.10 -5.33 -2.23 -0.637 0.38083E+04 86 gibbsite 4.08 1.12 -2.96 -0.422 0.50478E+04 89 graphite -3.55 -5.33 -1.79 -0.510 0.30505E+04 101 kaolinite -1.33 -3.73 -2.40 -0.218 0.40961E+04 119 microcline -2.49 -7.14 -4.65 -0.358 0.79449E+04 149 pyrophyllite -6.18 -9.71 -3.53 -0.221 0.60336E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.24 -4.93 -0.616 0.84116E+04 218 gypsum -4.96 -9.85 -4.90 -1.224 0.83631E+04 237 boehmite 4.41 1.12 -3.28 -0.547 0.56042E+04 240 fluorite -9.93 -13.65 -3.72 -1.241 0.63572E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.6799900 MOLES New total amount of reactant added: 1.7199900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.7199900 Water: Moles liquid = 0.5142E+02 kg liquid = 0.9263E+00 Moles total = 0.5125E+02 kg total = 0.9234E+00 Activity = 0.9973 Stoichiometric ionic strength = .1010756E+00 Osmotic coef. = 0.8829 True ionic strength = .2513192E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1029E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.30014E-04 -4.5227 0.24791E-04 -4.6057 0.82600E+00 -0.0830 2 H2O 0.99729E+00 -0.0012 0.99729E+00 -0.0012 3 Cl- 0.11051E-01 -1.9566 0.90625E-02 -2.0428 0.82008E+00 -0.0861 4 SO4-- 0.33817E-02 -2.4709 0.16473E-02 -2.7832 0.48711E+00 -0.3124 5 HCO3- 0.29287E-02 -2.5333 0.24060E-02 -2.6187 0.82151E+00 -0.0854 6 HS- 0.30569E-03 -3.5147 0.25074E-03 -3.6008 0.82022E+00 -0.0861 7 Al+++ 0.97084E-12 -12.0129 0.19431E-12 -12.7115 0.20014E+00 -0.6987 8 H4SiO4 0.10191E-02 -2.9918 0.10191E-02 -2.9918 0.10000E+01 0.0000 9 Ca++ 0.17255E-06 -6.7631 0.83312E-07 -7.0793 0.48283E+00 -0.3162 10 Mg++ 0.85134E-10 -10.0699 0.40881E-10 -10.3885 0.48020E+00 -0.3186 11 Fe++ 0.16538E-12 -12.7815 0.79521E-13 -13.0995 0.48083E+00 -0.3180 12 K+ 0.14863E-03 -3.8279 0.12214E-03 -3.9131 0.82174E+00 -0.0853 13 Na+ 0.21570E-01 -1.6661 0.17685E-01 -1.7524 0.81989E+00 -0.0862 14 Mn++ 0.19190E-08 -8.7169 0.92361E-09 -9.0345 0.48130E+00 -0.3176 15 F- 0.64578E-03 -3.1899 0.52830E-03 -3.2771 0.81808E+00 -0.0872 16 HPO4-- 0.16396E-09 -9.7853 0.79881E-10 -10.0976 0.48720E+00 -0.3123 17 SiF6-2 0.55309E-16 -16.2572 0.26874E-16 -16.5707 0.48588E+00 -0.3135 18 HSiO3- 0.46931E-07 -7.3285 0.38487E-07 -7.4147 0.82008E+00 -0.0861 19 Ca(HSiO3)+ 0.88840E-13 -13.0514 0.73022E-13 -13.1365 0.82195E+00 -0.0852 20 Mg(HSiO3)+ 0.54253E-16 -16.2656 0.44593E-16 -16.3507 0.82195E+00 -0.0852 21 NaHSiO3,aq 0.11009E-07 -7.9583 0.11009E-07 -7.9583 0.10000E+01 0.0000 22 AlO+ 0.52185E-10 -10.2825 0.42893E-10 -10.3676 0.82195E+00 -0.0852 23 AlOH+2 0.10989E-10 -10.9591 0.52950E-11 -11.2761 0.48186E+00 -0.3171 24 HAlO2,aq 0.34363E-09 -9.4639 0.34363E-09 -9.4639 0.10000E+01 0.0000 25 AlO2- 0.37494E-10 -10.4260 0.30682E-10 -10.5131 0.81832E+00 -0.0871 26 CH4,aq 0.36458E-09 -9.4382 0.35477E-09 -9.4500 0.97310E+00 -0.0118 31 CO,aq 0.10829E-10 -10.9654 0.10829E-10 -10.9654 0.10000E+01 0.0000 32 CO2,aq 0.13133E+00 -0.8816 0.12780E+00 -0.8935 0.97310E+00 -0.0118 33 CO3-2 0.17446E-07 -7.7583 0.84768E-08 -8.0718 0.48588E+00 -0.3135 34 CaCO3,aq 0.88553E-11 -11.0528 0.88553E-11 -11.0528 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.62249E-08 -8.2059 0.51166E-08 -8.2910 0.82195E+00 -0.0852 36 CaCl+ 0.14865E-08 -8.8278 0.12219E-08 -8.9130 0.82195E+00 -0.0852 37 CaCl2,aq 0.26307E-11 -11.5799 0.26307E-11 -11.5799 0.10000E+01 0.0000 38 CaF+ 0.78180E-09 -9.1069 0.64260E-09 -9.1921 0.82195E+00 -0.0852 39 CaOH+ 0.29059E-12 -12.5367 0.23885E-12 -12.6219 0.82195E+00 -0.0852 40 CaSO4,aq 0.43580E-07 -7.3607 0.43580E-07 -7.3607 0.10000E+01 0.0000 41 HCl,aq 0.41170E-07 -7.3854 0.41170E-07 -7.3854 0.10000E+01 0.0000 45 HF,aq 0.89659E-04 -4.0474 0.89659E-04 -4.0474 0.10000E+01 0.0000 46 HF2- 0.19501E-07 -7.7099 0.15992E-07 -7.7961 0.82008E+00 -0.0861 48 FeCl+ 0.13878E-14 -14.8577 0.11407E-14 -14.9428 0.82195E+00 -0.0852 51 FeF+ 0.26119E-14 -14.5830 0.21468E-14 -14.6682 0.82195E+00 -0.0852 54 FeOH+ 0.12668E-15 -15.8973 0.10413E-15 -15.9824 0.82195E+00 -0.0852 60 H2,aq 0.34569E-08 -8.4613 0.33639E-08 -8.4732 0.97310E+00 -0.0118 61 KCl,aq 0.20061E-07 -7.6976 0.20061E-07 -7.6976 0.10000E+01 0.0000 62 KHSO4,aq 0.14103E-10 -10.8507 0.14103E-10 -10.8507 0.10000E+01 0.0000 63 KOH,aq 0.20983E-11 -11.6781 0.20983E-11 -11.6781 0.10000E+01 0.0000 64 KSO4- 0.38070E-05 -5.4194 0.31221E-05 -5.5056 0.82008E+00 -0.0861 65 MgCO3,aq 0.10892E-14 -14.9629 0.10892E-14 -14.9629 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31212E-11 -11.5057 0.25655E-11 -11.5908 0.82195E+00 -0.0852 67 MgCl+ 0.66112E-12 -12.1797 0.54341E-12 -12.2649 0.82195E+00 -0.0852 68 MgF+ 0.14211E-11 -11.8474 0.11681E-11 -11.9325 0.82195E+00 -0.0852 69 MgOH+ 0.78904E-15 -15.1029 0.64855E-15 -15.1881 0.82195E+00 -0.0852 71 MnF+ 0.99990E-11 -11.0000 0.82187E-11 -11.0852 0.82195E+00 -0.0852 72 MnO,aq 0.15520E-17 -17.8091 0.15520E-17 -17.8091 0.10000E+01 0.0000 73 MnOH+ 0.13669E-12 -12.8643 0.11235E-12 -12.9494 0.82195E+00 -0.0852 78 MnCl+ 0.62708E-10 -10.2027 0.51543E-10 -10.2878 0.82195E+00 -0.0852 79 MnSO4,aq 0.43923E-09 -9.3573 0.43923E-09 -9.3573 0.10000E+01 0.0000 80 NaCl,aq 0.53114E-04 -4.2748 0.53114E-04 -4.2748 0.10000E+01 0.0000 81 NaF,aq 0.21874E-05 -5.6601 0.21874E-05 -5.6601 0.10000E+01 0.0000 82 NaOH,aq 0.30566E-09 -9.5148 0.30566E-09 -9.5148 0.10000E+01 0.0000 84 OH- 0.28402E-07 -7.5466 0.23242E-07 -7.6337 0.81832E+00 -0.0871 91 H2PO3- 0.50901E-19 -19.2933 0.41743E-19 -19.3794 0.82008E+00 -0.0861 92 H3PO4,aq 0.34337E-09 -9.4642 0.34337E-09 -9.4642 0.10000E+01 0.0000 93 H2PO4- 0.44496E-07 -7.3517 0.36532E-07 -7.4373 0.82101E+00 -0.0857 94 PO4-3 0.12388E-16 -16.9070 0.26289E-17 -17.5802 0.21221E+00 -0.6732 96 H3P2O7- 0.97881E-18 -18.0093 0.80270E-18 -18.0954 0.82008E+00 -0.0861 97 H2P2O7-2 0.21596E-15 -15.6656 0.10493E-15 -15.9791 0.48588E+00 -0.3135 98 HP2O7-3 0.42172E-17 -17.3750 0.84514E-18 -18.0731 0.20040E+00 -0.6981 100 H2S,aq 0.19743E-01 -1.7046 0.19212E-01 -1.7164 0.97310E+00 -0.0118 101 S2-2 0.85232E-09 -9.0694 0.41413E-09 -9.3829 0.48588E+00 -0.3135 102 S3-2 0.65581E-08 -8.1832 0.31865E-08 -8.4967 0.48588E+00 -0.3135 103 S3- 0.11133E-05 -5.9534 0.91299E-06 -6.0395 0.82008E+00 -0.0861 104 S4-2 0.33333E-07 -7.4771 0.16196E-07 -7.7906 0.48588E+00 -0.3135 105 S5-2 0.11297E-06 -6.9470 0.54891E-07 -7.2605 0.48588E+00 -0.3135 106 SO2,aq 0.15293E-10 -10.8155 0.15293E-10 -10.8155 0.10000E+01 0.0000 107 SO3-2 0.14608E-11 -11.8354 0.72204E-12 -12.1414 0.49426E+00 -0.3060 108 HSO3- 0.13667E-08 -8.8643 0.11208E-08 -8.9505 0.82008E+00 -0.0861 109 HSO4- 0.47826E-04 -4.3203 0.39356E-04 -4.4050 0.82291E+00 -0.0846 111 S2O3-2 0.76719E-06 -6.1151 0.37276E-06 -6.4286 0.48588E+00 -0.3135 112 HS2O3- 0.20149E-08 -8.6958 0.16524E-08 -8.7819 0.82008E+00 -0.0861 113 H2S2O3,aq 0.65670E-12 -12.1826 0.65670E-12 -12.1826 0.10000E+01 0.0000 121 S4O6-2 0.11088E-13 -13.9551 0.53876E-14 -14.2686 0.48588E+00 -0.3135 Charge balance for all species = -.5946E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3001370E-04 0.1512457E+00 0.1512400E+03 0.0000 2 H2O 0.1000000E+01 0.5537691E+02 0.9897354E+06 0.0000 3 Cl- 0.1105072E-01 0.1110390E-01 0.3905507E+03 2.5629 4 SO4-- 0.3381715E-02 0.3434998E-02 0.3273597E+03 6.4282 5 HCO3- 0.2928695E-02 0.1342599E+00 0.8127321E+04 1.9870 6 HS- 0.3056950E-03 0.2005250E-01 0.6579271E+03 1.0049 7 Al+++ 0.9708420E-12 0.4452634E-09 0.1191878E-04 1.1056 8 H4SiO4 0.1019071E-02 0.1019129E-02 0.9717863E+02 -2.9918 9 Ca++ 0.1725486E-06 0.2246333E-06 0.8931594E-02 2.1321 10 Mg++ 0.8513365E-10 0.9033897E-10 0.2178937E-05 -1.1771 11 Fe++ 0.1653849E-12 0.1695113E-12 0.9391767E-08 -3.8881 12 K+ 0.1486349E-03 0.1524620E-03 0.5914382E+01 0.6926 13 Na+ 0.2157008E-01 0.2162539E-01 0.4932283E+03 2.8533 14 Mn++ 0.1918975E-08 0.2431045E-08 0.1324997E-03 0.1769 15 F- 0.6457819E-03 0.7376685E-03 0.1390330E+02 1.3286 16 HPO4-- 0.1639604E-09 0.4500383E-07 0.4285234E-02 -0.8862 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1651734E+00 0.1401028E+00 0.2507062E-01 0.0000000E+00 2 H2O 0.5125456E+02 0.5129704E+02 -.4247734E-01 0.0000000E+00 3 Cl- 0.1028583E-01 0.1028583E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8197967E-02 0.3181926E-02 0.5016041E-02 0.0000000E+00 5 HCO3- 0.1243683E+00 0.1243683E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3362329E-01 0.1857514E-01 0.1504816E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4124588E-09 0.4774940E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9440447E-03 0.1120898E-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 0.1570226E-12 0.3259211E-07 0.0000000E+00 12 K+ 0.1412294E-03 0.1412294E-03 0.0000000E+00 0.0000000E+00 13 Na+ 0.2003215E-01 0.2003215E-01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.2251939E-08 0.2251939E-08 0.0000000E+00 0.0000000E+00 15 F- 0.6880960E-03 0.6833211E-03 0.4774940E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1456E-17 Mass of aqueous solution: 0.933716E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.7199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2969E-03 0.7802E-06 quartz 0.1121E-01 -1.951 0.6733 -0.172 51.12 0.2543 sulfur 0.2006E-01 -1.698 0.6433 -0.192 48.84 0.3112 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3336E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.316991 g Volume = 0.565591 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: 1.7199900 moles log = 0.2355 Original solution: 1000.0103000 g Original solution / Rock added: 581.40 (Water/Rock Ratio), log = 2.7645 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 15.9653 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6884E-01 0.9128 0.1003E+01 0.1099E+01 CO2,gas 0.8960E+00 0.9558 0.1367E+02 0.1430E+02 CH4,gas 0.3228E-07 1.0133 0.5222E-06 0.5153E-06 H2,gas 0.2743E-06 1.0085 0.4416E-05 0.4379E-05 H2S,gas 0.3517E-01 0.9404 0.5281E+00 0.5616E+00 S2,gas 0.3362E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1011E-08 1.0000 0.1614E-07 0.1614E-07 SO3,gas 0.2404E-28 1.0000 0.3838E-27 0.3838E-27 SO2,gas 0.4142E-11 1.0000 0.6613E-10 0.6613E-10 HF,gas 0.1379E-07 1.0000 0.2201E-06 0.2201E-06 HCl,gas 0.4550E-11 1.0000 0.7265E-10 0.7265E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 -1.698 0.28986E+04 0.001 2 CO2,gas -6.66 -7.22 -0.56 -0.188 0.96149E+03 1.136 3 CH4,gas 4.54 -3.44 -7.98 -1.995 0.13628E+05 -6.282 4 H2,gas 8.00 0.95 -7.05 -4.031 0.12044E+05 -5.355 5 H2S,gas -6.23 -8.21 -1.98 -0.988 0.33744E+04 -0.277 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.28 -9.49 -2.920 0.16206E+05 -7.792 8 SO3,gas 17.12 -11.99 -29.11 -7.279 0.49713E+05 -27.416 9 SO2,gas 0.83 -11.05 -11.88 -3.168 0.20282E+05 -10.180 10 HF,gas 0.47 -7.88 -8.36 -4.178 0.14268E+05 -6.657 11 HCl,gas 5.19 -6.65 -11.84 -5.919 0.20213E+05 -10.139 17 albite -0.38 -5.01 -4.63 -0.356 0.79020E+04 25 anhydrite -5.32 -9.86 -4.55 -2.273 0.77617E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.10 -1.77 -0.295 0.30230E+04 69 diamond -3.10 -5.33 -2.23 -0.636 0.38021E+04 86 gibbsite 4.08 1.10 -2.98 -0.425 0.50836E+04 89 graphite -3.55 -5.33 -1.78 -0.509 0.30444E+04 101 kaolinite -1.33 -3.77 -2.44 -0.222 0.41676E+04 119 microcline -2.49 -7.17 -4.69 -0.360 0.80013E+04 149 pyrophyllite -6.18 -9.75 -3.58 -0.223 0.61050E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.27 -4.95 -0.619 0.84514E+04 218 gypsum -4.96 -9.86 -4.91 -1.227 0.83833E+04 237 boehmite 4.41 1.10 -3.30 -0.551 0.56399E+04 240 fluorite -9.93 -13.63 -3.70 -1.234 0.63224E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.7199900 MOLES New total amount of reactant added: 1.7599900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.7599900 Water: Moles liquid = 0.5146E+02 kg liquid = 0.9270E+00 Moles total = 0.5129E+02 kg total = 0.9240E+00 Activity = 0.9972 Stoichiometric ionic strength = .1024005E+00 Osmotic coef. = 0.8838 True ionic strength = .2499422E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1052E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.30873E-04 -4.5104 0.25509E-04 -4.5933 0.82625E+00 -0.0829 2 H2O 0.99723E+00 -0.0012 0.99723E+00 -0.0012 3 Cl- 0.11296E-01 -1.9471 0.92669E-02 -2.0331 0.82036E+00 -0.0860 4 SO4-- 0.32599E-02 -2.4868 0.15903E-02 -2.7985 0.48783E+00 -0.3117 5 HCO3- 0.29102E-02 -2.5361 0.23916E-02 -2.6213 0.82178E+00 -0.0852 6 HS- 0.29482E-03 -3.5304 0.24190E-03 -3.6164 0.82050E+00 -0.0859 7 Al+++ 0.10049E-11 -11.9979 0.20181E-12 -12.6950 0.20084E+00 -0.6972 8 H4SiO4 0.10190E-02 -2.9918 0.10190E-02 -2.9918 0.10000E+01 0.0000 9 Ca++ 0.17352E-06 -6.7606 0.83910E-07 -7.0762 0.48357E+00 -0.3155 10 Mg++ 0.85044E-10 -10.0704 0.40901E-10 -10.3883 0.48094E+00 -0.3179 11 Fe++ 0.17612E-12 -12.7542 0.84813E-13 -13.0715 0.48157E+00 -0.3173 12 K+ 0.14866E-03 -3.8278 0.12220E-03 -3.9129 0.82201E+00 -0.0851 13 Na+ 0.21553E-01 -1.6665 0.17677E-01 -1.7526 0.82017E+00 -0.0861 14 Mn++ 0.19278E-08 -8.7149 0.92927E-09 -9.0319 0.48204E+00 -0.3169 15 F- 0.65808E-03 -3.1817 0.53855E-03 -3.2688 0.81836E+00 -0.0871 16 HPO4-- 0.15903E-09 -9.7985 0.77595E-10 -10.1102 0.48792E+00 -0.3117 17 SiF6-2 0.69477E-16 -16.1582 0.33808E-16 -16.4710 0.48661E+00 -0.3128 18 HSiO3- 0.45593E-07 -7.3411 0.37402E-07 -7.4271 0.82036E+00 -0.0860 19 Ca(HSiO3)+ 0.86928E-13 -13.0608 0.71474E-13 -13.1459 0.82222E+00 -0.0850 20 Mg(HSiO3)+ 0.52733E-16 -16.2779 0.43358E-16 -16.3629 0.82222E+00 -0.0850 21 NaHSiO3,aq 0.10694E-07 -7.9709 0.10694E-07 -7.9709 0.10000E+01 0.0000 22 AlO+ 0.51175E-10 -10.2909 0.42077E-10 -10.3760 0.82222E+00 -0.0850 23 AlOH+2 0.11074E-10 -10.9557 0.53445E-11 -11.2721 0.48260E+00 -0.3164 24 HAlO2,aq 0.32759E-09 -9.4847 0.32759E-09 -9.4847 0.10000E+01 0.0000 25 AlO2- 0.34726E-10 -10.4593 0.28427E-10 -10.5463 0.81860E+00 -0.0869 26 CH4,aq 0.36225E-09 -9.4410 0.35240E-09 -9.4530 0.97280E+00 -0.0120 31 CO,aq 0.10996E-10 -10.9588 0.10996E-10 -10.9588 0.10000E+01 0.0000 32 CO2,aq 0.13437E+00 -0.8717 0.13072E+00 -0.8837 0.97280E+00 -0.0120 33 CO3-2 0.16829E-07 -7.7739 0.81891E-08 -8.0868 0.48661E+00 -0.3128 34 CaCO3,aq 0.86161E-11 -11.0647 0.86161E-11 -11.0647 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.62301E-08 -8.2055 0.51225E-08 -8.2905 0.82222E+00 -0.0850 36 CaCl+ 0.15305E-08 -8.8152 0.12584E-08 -8.9002 0.82222E+00 -0.0850 37 CaCl2,aq 0.27705E-11 -11.5574 0.27705E-11 -11.5574 0.10000E+01 0.0000 38 CaF+ 0.80243E-09 -9.0956 0.65978E-09 -9.1806 0.82222E+00 -0.0850 39 CaOH+ 0.28434E-12 -12.5462 0.23379E-12 -12.6312 0.82222E+00 -0.0850 40 CaSO4,aq 0.42374E-07 -7.3729 0.42374E-07 -7.3729 0.10000E+01 0.0000 41 HCl,aq 0.43317E-07 -7.3633 0.43317E-07 -7.3633 0.10000E+01 0.0000 45 HF,aq 0.94045E-04 -4.0267 0.94045E-04 -4.0267 0.10000E+01 0.0000 46 HF2- 0.20845E-07 -7.6810 0.17100E-07 -7.7670 0.82036E+00 -0.0860 48 FeCl+ 0.15130E-14 -14.8202 0.12440E-14 -14.9052 0.82222E+00 -0.0850 51 FeF+ 0.28388E-14 -14.5469 0.23341E-14 -14.6319 0.82222E+00 -0.0850 54 FeOH+ 0.13126E-15 -15.8819 0.10793E-15 -15.9669 0.82222E+00 -0.0850 60 H2,aq 0.34326E-08 -8.4644 0.33392E-08 -8.4764 0.97280E+00 -0.0120 61 KCl,aq 0.20524E-07 -7.6877 0.20524E-07 -7.6877 0.10000E+01 0.0000 62 KHSO4,aq 0.14016E-10 -10.8534 0.14016E-10 -10.8534 0.10000E+01 0.0000 63 KOH,aq 0.20401E-11 -11.6903 0.20401E-11 -11.6903 0.10000E+01 0.0000 64 KSO4- 0.36758E-05 -5.4346 0.30155E-05 -5.5206 0.82036E+00 -0.0860 65 MgCO3,aq 0.10527E-14 -14.9777 0.10527E-14 -14.9777 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31030E-11 -11.5082 0.25514E-11 -11.5932 0.82222E+00 -0.0850 67 MgCl+ 0.67614E-12 -12.1700 0.55594E-12 -12.2550 0.82222E+00 -0.0850 68 MgF+ 0.14489E-11 -11.8390 0.11913E-11 -11.9240 0.82222E+00 -0.0850 69 MgOH+ 0.76693E-15 -15.1152 0.63059E-15 -15.2003 0.82222E+00 -0.0850 71 MnF+ 0.10252E-10 -10.9892 0.84295E-11 -11.0742 0.82222E+00 -0.0850 72 MnO,aq 0.14749E-17 -17.8312 0.14749E-17 -17.8312 0.10000E+01 0.0000 73 MnOH+ 0.13361E-12 -12.8742 0.10985E-12 -12.9592 0.82222E+00 -0.0850 78 MnCl+ 0.64495E-10 -10.1905 0.53029E-10 -10.2755 0.82222E+00 -0.0850 79 MnSO4,aq 0.42663E-09 -9.3699 0.42663E-09 -9.3699 0.10000E+01 0.0000 80 NaCl,aq 0.54289E-04 -4.2653 0.54289E-04 -4.2653 0.10000E+01 0.0000 81 NaF,aq 0.22288E-05 -5.6519 0.22288E-05 -5.6519 0.10000E+01 0.0000 82 NaOH,aq 0.29692E-09 -9.5274 0.29692E-09 -9.5274 0.10000E+01 0.0000 84 OH- 0.27592E-07 -7.5592 0.22587E-07 -7.6461 0.81860E+00 -0.0869 91 H2PO3- 0.50489E-19 -19.2968 0.41419E-19 -19.3828 0.82036E+00 -0.0860 92 H3PO4,aq 0.35313E-09 -9.4521 0.35313E-09 -9.4521 0.10000E+01 0.0000 93 H2PO4- 0.44459E-07 -7.3520 0.36514E-07 -7.4375 0.82128E+00 -0.0855 94 PO4-3 0.11657E-16 -16.9334 0.24818E-17 -17.6052 0.21290E+00 -0.6718 96 H3P2O7- 0.10058E-17 -17.9975 0.82515E-18 -18.0835 0.82036E+00 -0.0860 97 H2P2O7-2 0.21543E-15 -15.6667 0.10483E-15 -15.9795 0.48661E+00 -0.3128 98 HP2O7-3 0.40805E-17 -17.3893 0.82058E-18 -18.0859 0.20110E+00 -0.6966 100 H2S,aq 0.19604E-01 -1.7077 0.19071E-01 -1.7196 0.97280E+00 -0.0120 101 S2-2 0.79795E-09 -9.0980 0.38829E-09 -9.4108 0.48661E+00 -0.3128 102 S3-2 0.61398E-08 -8.2118 0.29876E-08 -8.5247 0.48661E+00 -0.3128 103 S3- 0.10776E-05 -5.9675 0.88405E-06 -6.0535 0.82036E+00 -0.0860 104 S4-2 0.31207E-07 -7.5058 0.15185E-07 -7.8186 0.48661E+00 -0.3128 105 S5-2 0.10577E-06 -6.9757 0.51466E-07 -7.2885 0.48661E+00 -0.3128 106 SO2,aq 0.15518E-10 -10.8092 0.15518E-10 -10.8092 0.10000E+01 0.0000 107 SO3-2 0.13981E-11 -11.8545 0.69199E-12 -12.1599 0.49497E+00 -0.3054 108 HSO3- 0.13472E-08 -8.8706 0.11052E-08 -8.9565 0.82036E+00 -0.0860 109 HSO4- 0.47492E-04 -4.3234 0.39094E-04 -4.4079 0.82318E+00 -0.0845 111 S2O3-2 0.73416E-06 -6.1342 0.35725E-06 -6.4470 0.48661E+00 -0.3128 112 HS2O3- 0.19862E-08 -8.7020 0.16294E-08 -8.7880 0.82036E+00 -0.0860 113 H2S2O3,aq 0.66633E-12 -12.1763 0.66633E-12 -12.1763 0.10000E+01 0.0000 121 S4O6-2 0.10846E-13 -13.9647 0.52777E-14 -14.2776 0.48661E+00 -0.3128 Charge balance for all species = -.5941E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3087294E-04 0.1541539E+00 0.1541290E+03 0.0000 2 H2O 0.1000000E+01 0.5537387E+02 0.9895587E+06 0.0000 3 Cl- 0.1129618E-01 0.1135053E-01 0.3991760E+03 2.5602 4 SO4-- 0.3259888E-02 0.3312640E-02 0.3156598E+03 6.3881 5 HCO3- 0.2910231E-02 0.1372835E+00 0.8309325E+04 1.9720 6 HS- 0.2948193E-03 0.1990282E-01 0.6529355E+03 0.9769 7 Al+++ 0.1004852E-11 0.4255654E-09 0.1139010E-04 1.0849 8 H4SiO4 0.1018964E-02 0.1019021E-02 0.9715633E+02 -2.9918 9 Ca++ 0.1735238E-06 0.2244723E-06 0.8924092E-02 2.1104 10 Mg++ 0.8504430E-10 0.9027425E-10 0.2177107E-05 -1.2016 11 Fe++ 0.1761195E-12 0.1806025E-12 0.1000504E-07 -3.8849 12 K+ 0.1486564E-03 0.1523528E-03 0.5909414E+01 0.6804 13 Na+ 0.2155337E-01 0.2160990E-01 0.4928141E+03 2.8407 14 Mn++ 0.1927792E-08 0.2429304E-08 0.1323884E-03 0.1548 15 F- 0.6580841E-03 0.7544002E-03 0.1421690E+02 1.3245 16 HPO4-- 0.1590329E-09 0.4497159E-07 0.4281635E-02 -0.9235 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1694804E+00 0.1428990E+00 0.2658134E-01 0.0000000E+00 2 H2O 0.5128731E+02 0.5133100E+02 -.4368476E-01 0.0000000E+00 3 Cl- 0.1052183E-01 0.1052183E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8388967E-02 0.3070783E-02 0.5318184E-02 0.0000000E+00 5 HCO3- 0.1272603E+00 0.1272603E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3440429E-01 0.1844971E-01 0.1595459E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3944946E-09 0.4774958E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9446214E-03 0.1120840E-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 0.1674167E-12 0.3259210E-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- 0.7040960E-03 0.6993210E-03 0.4774958E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.6734E-18 Mass of aqueous solution: 0.934501E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.7599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2884E-03 0.7802E-06 quartz 0.1121E-01 -1.951 0.6733 -0.172 49.66 0.2543 sulfur 0.2127E-01 -1.672 0.6820 -0.166 50.31 0.3299 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3241E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.355703 g Volume = 0.584323 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: 1.7599900 moles log = 0.2455 Original solution: 1000.0103000 g Original solution / Rock added: 568.19 (Water/Rock Ratio), log = 2.7545 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 16.3047 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6752E-01 0.9113 0.1003E+01 0.1101E+01 CO2,gas 0.8982E+00 0.9549 0.1399E+02 0.1465E+02 CH4,gas 0.3139E-07 1.0136 0.5187E-06 0.5118E-06 H2,gas 0.2666E-06 1.0087 0.4384E-05 0.4346E-05 H2S,gas 0.3423E-01 0.9392 0.5242E+00 0.5582E+00 S2,gas 0.3292E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1005E-08 1.0000 0.1639E-07 0.1639E-07 SO3,gas 0.2406E-28 1.0000 0.3923E-27 0.3923E-27 SO2,gas 0.4116E-11 1.0000 0.6710E-10 0.6710E-10 HF,gas 0.1416E-07 1.0000 0.2309E-06 0.2309E-06 HCl,gas 0.4688E-11 1.0000 0.7643E-10 0.7643E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.30331E-11 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 -1.698 0.28986E+04 0.001 2 CO2,gas -6.66 -7.21 -0.55 -0.184 0.94474E+03 1.146 3 CH4,gas 4.54 -3.44 -7.98 -1.996 0.13633E+05 -6.285 4 H2,gas 8.00 0.94 -7.06 -4.033 0.12050E+05 -5.358 5 H2S,gas -6.23 -8.21 -1.98 -0.990 0.33798E+04 -0.280 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.27 -9.48 -2.918 0.16195E+05 -7.786 8 SO3,gas 17.12 -11.98 -29.11 -7.276 0.49697E+05 -27.406 9 SO2,gas 0.83 -11.04 -11.87 -3.166 0.20271E+05 -10.173 10 HF,gas 0.47 -7.86 -8.34 -4.168 0.14233E+05 -6.637 11 HCl,gas 5.19 -6.63 -11.82 -5.908 0.20175E+05 -10.117 17 albite -0.38 -5.05 -4.66 -0.359 0.79589E+04 25 anhydrite -5.32 -9.87 -4.56 -2.279 0.77825E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.08 -1.79 -0.299 0.30585E+04 69 diamond -3.10 -5.33 -2.22 -0.635 0.37962E+04 86 gibbsite 4.08 1.08 -3.00 -0.428 0.51191E+04 89 graphite -3.55 -5.33 -1.78 -0.508 0.30385E+04 101 kaolinite -1.33 -3.82 -2.48 -0.226 0.42386E+04 119 microcline -2.49 -7.21 -4.72 -0.363 0.80575E+04 149 pyrophyllite -6.18 -9.79 -3.62 -0.226 0.61759E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.29 -4.97 -0.622 0.84917E+04 218 gypsum -4.96 -9.88 -4.92 -1.231 0.84042E+04 237 boehmite 4.41 1.08 -3.32 -0.554 0.56754E+04 240 fluorite -9.93 -13.61 -3.68 -1.228 0.62886E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.7599900 MOLES New total amount of reactant added: 1.7999900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.7999900 Water: Moles liquid = 0.5149E+02 kg liquid = 0.9277E+00 Moles total = 0.5132E+02 kg total = 0.9245E+00 Activity = 0.9972 Stoichiometric ionic strength = .1037275E+00 Osmotic coef. = 0.8847 True ionic strength = .2485790E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1076E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.31767E-04 -4.4980 0.26256E-04 -4.5808 0.82651E+00 -0.0828 2 H2O 0.99718E+00 -0.0012 0.99718E+00 -0.0012 3 Cl- 0.11541E-01 -1.9377 0.94712E-02 -2.0236 0.82063E+00 -0.0859 4 SO4-- 0.31394E-02 -2.5032 0.15337E-02 -2.8142 0.48855E+00 -0.3111 5 HCO3- 0.28894E-02 -2.5392 0.23753E-02 -2.6243 0.82205E+00 -0.0851 6 HS- 0.28427E-03 -3.5463 0.23332E-03 -3.6320 0.82077E+00 -0.0858 7 Al+++ 0.10414E-11 -11.9824 0.20988E-12 -12.6780 0.20153E+00 -0.6957 8 H4SiO4 0.10189E-02 -2.9919 0.10189E-02 -2.9919 0.10000E+01 0.0000 9 Ca++ 0.17451E-06 -6.7582 0.84515E-07 -7.0731 0.48430E+00 -0.3149 10 Mg++ 0.84958E-10 -10.0708 0.40922E-10 -10.3880 0.48168E+00 -0.3172 11 Fe++ 0.18765E-12 -12.7266 0.90504E-13 -13.0433 0.48230E+00 -0.3167 12 K+ 0.14868E-03 -3.8278 0.12225E-03 -3.9127 0.82228E+00 -0.0850 13 Na+ 0.21537E-01 -1.6668 0.17670E-01 -1.7528 0.82045E+00 -0.0859 14 Mn++ 0.19366E-08 -8.7129 0.93496E-09 -9.0292 0.48277E+00 -0.3163 15 F- 0.67018E-03 -3.1738 0.54864E-03 -3.2607 0.81864E+00 -0.0869 16 HPO4-- 0.15420E-09 -9.8119 0.75349E-10 -10.1229 0.48863E+00 -0.3110 17 SiF6-2 0.87043E-16 -16.0603 0.42418E-16 -16.3724 0.48733E+00 -0.3122 18 HSiO3- 0.44279E-07 -7.3538 0.36337E-07 -7.4397 0.82063E+00 -0.0859 19 Ca(HSiO3)+ 0.85032E-13 -13.0704 0.69938E-13 -13.1553 0.82249E+00 -0.0849 20 Mg(HSiO3)+ 0.51240E-16 -16.2904 0.42144E-16 -16.3753 0.82249E+00 -0.0849 21 NaHSiO3,aq 0.10384E-07 -7.9836 0.10384E-07 -7.9836 0.10000E+01 0.0000 22 AlO+ 0.50217E-10 -10.2991 0.41303E-10 -10.3840 0.82249E+00 -0.0849 23 AlOH+2 0.11172E-10 -10.9519 0.53998E-11 -11.2676 0.48333E+00 -0.3158 24 HAlO2,aq 0.31240E-09 -9.5053 0.31240E-09 -9.5053 0.10000E+01 0.0000 25 AlO2- 0.32163E-10 -10.4926 0.26338E-10 -10.5794 0.81889E+00 -0.0868 26 CH4,aq 0.35991E-09 -9.4438 0.35001E-09 -9.4559 0.97250E+00 -0.0121 31 CO,aq 0.11160E-10 -10.9523 0.11160E-10 -10.9523 0.10000E+01 0.0000 32 CO2,aq 0.13741E+00 -0.8620 0.13363E+00 -0.8741 0.97250E+00 -0.0121 33 CO3-2 0.16215E-07 -7.7901 0.79020E-08 -8.1023 0.48733E+00 -0.3122 34 CaCO3,aq 0.83739E-11 -11.0771 0.83739E-11 -11.0771 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.62302E-08 -8.2055 0.51242E-08 -8.2904 0.82249E+00 -0.0849 36 CaCl+ 0.15750E-08 -8.8027 0.12954E-08 -8.8876 0.82249E+00 -0.0849 37 CaCl2,aq 0.29148E-11 -11.5354 0.29148E-11 -11.5354 0.10000E+01 0.0000 38 CaF+ 0.82308E-09 -9.0846 0.67698E-09 -9.1694 0.82249E+00 -0.0849 39 CaOH+ 0.27814E-12 -12.5557 0.22876E-12 -12.6406 0.82249E+00 -0.0849 40 CaSO4,aq 0.41162E-07 -7.3855 0.41162E-07 -7.3855 0.10000E+01 0.0000 41 HCl,aq 0.45568E-07 -7.3413 0.45568E-07 -7.3413 0.10000E+01 0.0000 45 HF,aq 0.98611E-04 -4.0061 0.98611E-04 -4.0061 0.10000E+01 0.0000 46 HF2- 0.22259E-07 -7.6525 0.18266E-07 -7.7384 0.82063E+00 -0.0859 48 FeCl+ 0.16496E-14 -14.7826 0.13568E-14 -14.8675 0.82249E+00 -0.0849 51 FeF+ 0.30850E-14 -14.5107 0.25374E-14 -14.5956 0.82249E+00 -0.0849 54 FeOH+ 0.13604E-15 -15.8663 0.11189E-15 -15.9512 0.82249E+00 -0.0849 60 H2,aq 0.34089E-08 -8.4674 0.33152E-08 -8.4795 0.97250E+00 -0.0121 61 KCl,aq 0.20986E-07 -7.6781 0.20986E-07 -7.6781 0.10000E+01 0.0000 62 KHSO4,aq 0.13919E-10 -10.8564 0.13919E-10 -10.8564 0.10000E+01 0.0000 63 KOH,aq 0.19829E-11 -11.7027 0.19829E-11 -11.7027 0.10000E+01 0.0000 64 KSO4- 0.35456E-05 -5.4503 0.29097E-05 -5.5362 0.82063E+00 -0.0859 65 MgCO3,aq 0.10163E-14 -14.9930 0.10163E-14 -14.9930 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30825E-11 -11.5111 0.25353E-11 -11.5960 0.82249E+00 -0.0849 67 MgCl+ 0.69117E-12 -12.1604 0.56848E-12 -12.2453 0.82249E+00 -0.0849 68 MgF+ 0.14763E-11 -11.8308 0.12142E-11 -11.9157 0.82249E+00 -0.0849 69 MgOH+ 0.74522E-15 -15.1277 0.61294E-15 -15.2126 0.82249E+00 -0.0849 71 MnF+ 0.10505E-10 -10.9786 0.86400E-11 -11.0635 0.82249E+00 -0.0849 72 MnO,aq 0.14006E-17 -17.8537 0.14006E-17 -17.8537 0.10000E+01 0.0000 73 MnOH+ 0.13055E-12 -12.8842 0.10738E-12 -12.9691 0.82249E+00 -0.0849 78 MnCl+ 0.66298E-10 -10.1785 0.54530E-10 -10.2634 0.82249E+00 -0.0849 79 MnSO4,aq 0.41398E-09 -9.3830 0.41398E-09 -9.3830 0.10000E+01 0.0000 80 NaCl,aq 0.55461E-04 -4.2560 0.55461E-04 -4.2560 0.10000E+01 0.0000 81 NaF,aq 0.22696E-05 -5.6440 0.22696E-05 -5.6440 0.10000E+01 0.0000 82 NaOH,aq 0.28833E-09 -9.5401 0.28833E-09 -9.5401 0.10000E+01 0.0000 84 OH- 0.26797E-07 -7.5719 0.21944E-07 -7.6587 0.81889E+00 -0.0868 91 H2PO3- 0.50085E-19 -19.3003 0.41101E-19 -19.3861 0.82063E+00 -0.0859 92 H3PO4,aq 0.36328E-09 -9.4398 0.36328E-09 -9.4398 0.10000E+01 0.0000 93 H2PO4- 0.44422E-07 -7.3524 0.36495E-07 -7.4378 0.82155E+00 -0.0854 94 PO4-3 0.10963E-16 -16.9601 0.23415E-17 -17.6305 0.21358E+00 -0.6704 96 H3P2O7- 0.10339E-17 -17.9855 0.84848E-18 -18.0714 0.82063E+00 -0.0859 97 H2P2O7-2 0.21490E-15 -15.6678 0.10473E-15 -15.9799 0.48733E+00 -0.3122 98 HP2O7-3 0.39470E-17 -17.4037 0.79647E-18 -18.0988 0.20179E+00 -0.6951 100 H2S,aq 0.19469E-01 -1.7107 0.18933E-01 -1.7228 0.97250E+00 -0.0121 101 S2-2 0.74667E-09 -9.1269 0.36387E-09 -9.4391 0.48733E+00 -0.3122 102 S3-2 0.57452E-08 -8.2407 0.27998E-08 -8.5529 0.48733E+00 -0.3122 103 S3- 0.10429E-05 -5.9818 0.85581E-06 -6.0676 0.82063E+00 -0.0859 104 S4-2 0.29201E-07 -7.5346 0.14231E-07 -7.8468 0.48733E+00 -0.3122 105 S5-2 0.98968E-07 -7.0045 0.48230E-07 -7.3167 0.48733E+00 -0.3122 106 SO2,aq 0.15742E-10 -10.8029 0.15742E-10 -10.8029 0.10000E+01 0.0000 107 SO3-2 0.13368E-11 -11.8739 0.66261E-12 -12.1787 0.49567E+00 -0.3048 108 HSO3- 0.13274E-08 -8.8770 0.10893E-08 -8.9629 0.82063E+00 -0.0859 109 HSO4- 0.47129E-04 -4.3267 0.38808E-04 -4.4111 0.82344E+00 -0.0844 111 S2O3-2 0.70195E-06 -6.1537 0.34208E-06 -6.4659 0.48733E+00 -0.3122 112 HS2O3- 0.19569E-08 -8.7084 0.16059E-08 -8.7943 0.82063E+00 -0.0859 113 H2S2O3,aq 0.67594E-12 -12.1701 0.67594E-12 -12.1701 0.10000E+01 0.0000 121 S4O6-2 0.10596E-13 -13.9749 0.51638E-14 -14.2870 0.48733E+00 -0.3122 Charge balance for all species = -.5937E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3176700E-04 0.1570635E+00 0.1570187E+03 0.0000 2 H2O 0.1000000E+01 0.5537083E+02 0.9893820E+06 0.0000 3 Cl- 0.1154128E-01 0.1159681E-01 0.4077868E+03 2.5572 4 SO4-- 0.3139376E-02 0.3191572E-02 0.3040857E+03 6.3473 5 HCO3- 0.2889444E-02 0.1403028E+00 0.8491022E+04 1.9565 6 HS- 0.2842734E-03 0.1975671E-01 0.6480619E+03 0.9487 7 Al+++ 0.1041425E-11 0.4069934E-09 0.1089168E-04 1.0643 8 H4SiO4 0.1018858E-02 0.1018913E-02 0.9713403E+02 -2.9919 9 Ca++ 0.1745101E-06 0.2243117E-06 0.8916601E-02 2.0885 10 Mg++ 0.8495786E-10 0.9020963E-10 0.2175279E-05 -1.2265 11 Fe++ 0.1876507E-12 0.1925213E-12 0.1066400E-07 -3.8818 12 K+ 0.1486771E-03 0.1522437E-03 0.5904454E+01 0.6680 13 Na+ 0.2153669E-01 0.2159443E-01 0.4924004E+03 2.8280 14 Mn++ 0.1936648E-08 0.2427565E-08 0.1322772E-03 0.1324 15 F- 0.6701818E-03 0.7711080E-03 0.1452996E+02 1.3201 16 HPO4-- 0.1542036E-09 0.4493940E-07 0.4278041E-02 -0.9614 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1737874E+00 0.1457005E+00 0.2808689E-01 0.0000000E+00 2 H2O 0.5132006E+02 0.5136495E+02 -.4488804E-01 0.0000000E+00 3 Cl- 0.1075783E-01 0.1075783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8579967E-02 0.2960673E-02 0.5619294E-02 0.0000000E+00 5 HCO3- 0.1301523E+00 0.1301523E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3518529E-01 0.1832738E-01 0.1685791E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3775489E-09 0.4774974E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9451979E-03 0.1120782E-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 0.1785931E-12 0.3259209E-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- 0.7200960E-03 0.7153210E-03 0.4774974E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.5277E-18 Mass of aqueous solution: 0.935286E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2805E-03 0.7802E-06 quartz 0.1121E-01 -1.951 0.6732 -0.172 48.28 0.2542 sulfur 0.2248E-01 -1.648 0.7206 -0.142 51.68 0.3486 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3151E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.394283 g Volume = 0.602991 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: 1.7999900 moles log = 0.2553 Original solution: 1000.0103000 g Original solution / Rock added: 555.56 (Water/Rock Ratio), log = 2.7447 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 16.6446 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6625E-01 0.9097 0.1003E+01 0.1103E+01 CO2,gas 0.9004E+00 0.9540 0.1430E+02 0.1499E+02 CH4,gas 0.3053E-07 1.0138 0.5152E-06 0.5082E-06 H2,gas 0.2592E-06 1.0089 0.4352E-05 0.4314E-05 H2S,gas 0.3334E-01 0.9380 0.5205E+00 0.5549E+00 S2,gas 0.3225E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.9992E-09 1.0000 0.1663E-07 0.1663E-07 SO3,gas 0.2409E-28 1.0000 0.4009E-27 0.4009E-27 SO2,gas 0.4090E-11 1.0000 0.6808E-10 0.6808E-10 HF,gas 0.1455E-07 1.0000 0.2421E-06 0.2421E-06 HCl,gas 0.4831E-11 1.0000 0.8041E-10 0.8041E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.30331E-11 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 -1.698 0.28986E+04 0.001 2 CO2,gas -6.66 -7.20 -0.54 -0.181 0.92837E+03 1.155 3 CH4,gas 4.54 -3.44 -7.99 -1.997 0.13638E+05 -6.288 4 H2,gas 8.00 0.94 -7.06 -4.034 0.12055E+05 -5.361 5 H2S,gas -6.23 -8.21 -1.98 -0.991 0.33852E+04 -0.284 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.26 -9.48 -2.916 0.16184E+05 -7.779 8 SO3,gas 17.12 -11.97 -29.10 -7.274 0.49681E+05 -27.397 9 SO2,gas 0.83 -11.03 -11.87 -3.164 0.20261E+05 -10.167 10 HF,gas 0.47 -7.84 -8.31 -4.157 0.14198E+05 -6.616 11 HCl,gas 5.19 -6.60 -11.79 -5.897 0.20137E+05 -10.095 17 albite -0.38 -5.08 -4.69 -0.361 0.80159E+04 25 anhydrite -5.32 -9.89 -4.57 -2.285 0.78040E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.06 -1.81 -0.302 0.30937E+04 69 diamond -3.10 -5.32 -2.22 -0.634 0.37905E+04 86 gibbsite 4.08 1.06 -3.02 -0.431 0.51543E+04 89 graphite -3.55 -5.32 -1.78 -0.507 0.30328E+04 101 kaolinite -1.33 -3.86 -2.52 -0.229 0.43090E+04 119 microcline -2.49 -7.24 -4.75 -0.366 0.81138E+04 149 pyrophyllite -6.18 -9.83 -3.66 -0.229 0.62463E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 203 dawsonite 1.68 -3.32 -5.00 -0.625 0.85323E+04 218 gypsum -4.96 -9.89 -4.93 -1.234 0.84258E+04 237 boehmite 4.41 1.06 -3.34 -0.557 0.57106E+04 240 fluorite -9.93 -13.59 -3.66 -1.221 0.62558E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.7999900 MOLES New total amount of reactant added: 1.8399900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.8399900 Water: Moles liquid = 0.5153E+02 kg liquid = 0.9283E+00 Moles total = 0.5135E+02 kg total = 0.9251E+00 Activity = 0.9971 Stoichiometric ionic strength = .1050567E+00 Osmotic coef. = 0.8857 True ionic strength = .2472296E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1099E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.32698E-04 -4.4855 0.27034E-04 -4.5681 0.82676E+00 -0.0826 2 H2O 0.99713E+00 -0.0012 0.99713E+00 -0.0012 3 Cl- 0.11786E-01 -1.9286 0.96752E-02 -2.0143 0.82091E+00 -0.0857 4 SO4-- 0.30202E-02 -2.5200 0.14777E-02 -2.8304 0.48927E+00 -0.3105 5 HCO3- 0.28664E-02 -2.5427 0.23571E-02 -2.6276 0.82232E+00 -0.0850 6 HS- 0.27404E-03 -3.5622 0.22500E-03 -3.6478 0.82105E+00 -0.0856 7 Al+++ 0.10808E-11 -11.9663 0.21856E-12 -12.6604 0.20222E+00 -0.6942 8 H4SiO4 0.10188E-02 -2.9919 0.10188E-02 -2.9919 0.10000E+01 0.0000 9 Ca++ 0.17551E-06 -6.7557 0.85125E-07 -7.0699 0.48502E+00 -0.3142 10 Mg++ 0.84874E-10 -10.0712 0.40944E-10 -10.3878 0.48241E+00 -0.3166 11 Fe++ 0.20005E-12 -12.6989 0.96632E-13 -13.0149 0.48303E+00 -0.3160 12 K+ 0.14870E-03 -3.8277 0.12231E-03 -3.9125 0.82255E+00 -0.0848 13 Na+ 0.21520E-01 -1.6672 0.17662E-01 -1.7530 0.82072E+00 -0.0858 14 Mn++ 0.19455E-08 -8.7110 0.94068E-09 -9.0266 0.48350E+00 -0.3156 15 F- 0.68207E-03 -3.1662 0.55856E-03 -3.2529 0.81892E+00 -0.0868 16 HPO4-- 0.14947E-09 -9.8255 0.73142E-10 -10.1358 0.48935E+00 -0.3104 17 SiF6-2 0.10878E-15 -15.9634 0.53090E-16 -16.2750 0.48804E+00 -0.3115 18 HSiO3- 0.42988E-07 -7.3667 0.35289E-07 -7.4524 0.82091E+00 -0.0857 19 Ca(HSiO3)+ 0.83150E-13 -13.0801 0.68412E-13 -13.1649 0.82275E+00 -0.0847 20 Mg(HSiO3)+ 0.49773E-16 -16.3030 0.40951E-16 -16.3877 0.82275E+00 -0.0847 21 NaHSiO3,aq 0.10081E-07 -7.9965 0.10081E-07 -7.9965 0.10000E+01 0.0000 22 AlO+ 0.49309E-10 -10.3071 0.40570E-10 -10.3918 0.82275E+00 -0.0847 23 AlOH+2 0.11282E-10 -10.9476 0.54611E-11 -11.2627 0.48406E+00 -0.3151 24 HAlO2,aq 0.29801E-09 -9.5258 0.29801E-09 -9.5258 0.10000E+01 0.0000 25 AlO2- 0.29788E-10 -10.5260 0.24402E-10 -10.6126 0.81917E+00 -0.0866 26 CH4,aq 0.35758E-09 -9.4466 0.34764E-09 -9.4589 0.97220E+00 -0.0122 31 CO,aq 0.11323E-10 -10.9460 0.11323E-10 -10.9460 0.10000E+01 0.0000 32 CO2,aq 0.14045E+00 -0.8525 0.13655E+00 -0.8647 0.97220E+00 -0.0122 33 CO3-2 0.15605E-07 -7.8067 0.76158E-08 -8.1183 0.48804E+00 -0.3115 34 CaCO3,aq 0.81289E-11 -11.0900 0.81289E-11 -11.0900 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.62251E-08 -8.2059 0.51217E-08 -8.2906 0.82275E+00 -0.0847 36 CaCl+ 0.16200E-08 -8.7905 0.13329E-08 -8.8752 0.82275E+00 -0.0847 37 CaCl2,aq 0.30637E-11 -11.5137 0.30637E-11 -11.5137 0.10000E+01 0.0000 38 CaF+ 0.84375E-09 -9.0738 0.69420E-09 -9.1585 0.82275E+00 -0.0847 39 CaOH+ 0.27198E-12 -12.5655 0.22377E-12 -12.6502 0.82275E+00 -0.0847 40 CaSO4,aq 0.39943E-07 -7.3986 0.39943E-07 -7.3986 0.10000E+01 0.0000 41 HCl,aq 0.47929E-07 -7.3194 0.47929E-07 -7.3194 0.10000E+01 0.0000 45 HF,aq 0.10337E-03 -3.9856 0.10337E-03 -3.9856 0.10000E+01 0.0000 46 HF2- 0.23746E-07 -7.6244 0.19494E-07 -7.7101 0.82091E+00 -0.0857 48 FeCl+ 0.17987E-14 -14.7451 0.14799E-14 -14.8298 0.82275E+00 -0.0847 51 FeF+ 0.33524E-14 -14.4746 0.27582E-14 -14.5594 0.82275E+00 -0.0847 54 FeOH+ 0.14102E-15 -15.8507 0.11602E-15 -15.9355 0.82275E+00 -0.0847 60 H2,aq 0.33857E-08 -8.4703 0.32916E-08 -8.4826 0.97220E+00 -0.0122 61 KCl,aq 0.21448E-07 -7.6686 0.21448E-07 -7.6686 0.10000E+01 0.0000 62 KHSO4,aq 0.13814E-10 -10.8597 0.13814E-10 -10.8597 0.10000E+01 0.0000 63 KOH,aq 0.19266E-11 -11.7152 0.19266E-11 -11.7152 0.10000E+01 0.0000 64 KSO4- 0.34164E-05 -5.4664 0.28046E-05 -5.5521 0.82091E+00 -0.0857 65 MgCO3,aq 0.98004E-15 -15.0088 0.98004E-15 -15.0088 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30595E-11 -11.5143 0.25172E-11 -11.5991 0.82275E+00 -0.0847 67 MgCl+ 0.70622E-12 -12.1511 0.58104E-12 -12.2358 0.82275E+00 -0.0847 68 MgF+ 0.15033E-11 -11.8229 0.12369E-11 -11.9077 0.82275E+00 -0.0847 69 MgOH+ 0.72389E-15 -15.1403 0.59559E-15 -15.2251 0.82275E+00 -0.0847 71 MnF+ 0.10757E-10 -10.9683 0.88500E-11 -11.0531 0.82275E+00 -0.0847 72 MnO,aq 0.13292E-17 -17.8764 0.13292E-17 -17.8764 0.10000E+01 0.0000 73 MnOH+ 0.12752E-12 -12.8944 0.10492E-12 -12.9791 0.82275E+00 -0.0847 78 MnCl+ 0.68119E-10 -10.1667 0.56045E-10 -10.2515 0.82275E+00 -0.0847 79 MnSO4,aq 0.40128E-09 -9.3965 0.40128E-09 -9.3965 0.10000E+01 0.0000 80 NaCl,aq 0.56631E-04 -4.2469 0.56631E-04 -4.2469 0.10000E+01 0.0000 81 NaF,aq 0.23096E-05 -5.6365 0.23096E-05 -5.6365 0.10000E+01 0.0000 82 NaOH,aq 0.27990E-09 -9.5530 0.27990E-09 -9.5530 0.10000E+01 0.0000 84 OH- 0.26016E-07 -7.5848 0.21311E-07 -7.6714 0.81917E+00 -0.0866 91 H2PO3- 0.49689E-19 -19.3037 0.40790E-19 -19.3894 0.82091E+00 -0.0857 92 H3PO4,aq 0.37385E-09 -9.4273 0.37385E-09 -9.4273 0.10000E+01 0.0000 93 H2PO4- 0.44384E-07 -7.3528 0.36476E-07 -7.4380 0.82182E+00 -0.0852 94 PO4-3 0.10303E-16 -16.9870 0.22075E-17 -17.6561 0.21426E+00 -0.6691 96 H3P2O7- 0.10631E-17 -17.9734 0.87274E-18 -18.0591 0.82091E+00 -0.0857 97 H2P2O7-2 0.21437E-15 -15.6688 0.10462E-15 -15.9804 0.48804E+00 -0.3115 98 HP2O7-3 0.38165E-17 -17.4183 0.77277E-18 -18.1119 0.20248E+00 -0.6936 100 H2S,aq 0.19337E-01 -1.7136 0.18799E-01 -1.7259 0.97220E+00 -0.0122 101 S2-2 0.69829E-09 -9.1560 0.34079E-09 -9.4675 0.48804E+00 -0.3115 102 S3-2 0.53729E-08 -8.2698 0.26222E-08 -8.5813 0.48804E+00 -0.3115 103 S3- 0.10089E-05 -5.9961 0.82822E-06 -6.0819 0.82091E+00 -0.0857 104 S4-2 0.27309E-07 -7.5637 0.13328E-07 -7.8752 0.48804E+00 -0.3115 105 S5-2 0.92556E-07 -7.0336 0.45171E-07 -7.3451 0.48804E+00 -0.3115 106 SO2,aq 0.15966E-10 -10.7968 0.15966E-10 -10.7968 0.10000E+01 0.0000 107 SO3-2 0.12771E-11 -11.8938 0.63389E-12 -12.1980 0.49636E+00 -0.3042 108 HSO3- 0.13070E-08 -8.8837 0.10729E-08 -8.9694 0.82091E+00 -0.0857 109 HSO4- 0.46737E-04 -4.3303 0.38497E-04 -4.4146 0.82370E+00 -0.0842 111 S2O3-2 0.67054E-06 -6.1736 0.32725E-06 -6.4851 0.48804E+00 -0.3115 112 HS2O3- 0.19269E-08 -8.7151 0.15818E-08 -8.8008 0.82091E+00 -0.0857 113 H2S2O3,aq 0.68553E-12 -12.1640 0.68553E-12 -12.1640 0.10000E+01 0.0000 121 S4O6-2 0.10339E-13 -13.9855 0.50458E-14 -14.2971 0.48804E+00 -0.3115 Charge balance for all species = -.5933E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3269837E-04 0.1599745E+00 0.1599091E+03 0.0000 2 H2O 0.1000000E+01 0.5536780E+02 0.9892055E+06 0.0000 3 Cl- 0.1178604E-01 0.1184274E-01 0.4163831E+03 2.5538 4 SO4-- 0.3020175E-02 0.3071787E-02 0.2926367E+03 6.3058 5 HCO3- 0.2866374E-02 0.1433177E+00 0.8672413E+04 1.9405 6 HS- 0.2740428E-03 0.1961413E-01 0.6433056E+03 0.9203 7 Al+++ 0.1080796E-11 0.3894658E-09 0.1042133E-04 1.0439 8 H4SiO4 0.1018752E-02 0.1018805E-02 0.9711173E+02 -2.9919 9 Ca++ 0.1755076E-06 0.2241512E-06 0.8909122E-02 2.0663 10 Mg++ 0.8487430E-10 0.9014510E-10 0.2173455E-05 -1.2516 11 Fe++ 0.2000539E-12 0.2053460E-12 0.1137297E-07 -3.8787 12 K+ 0.1486969E-03 0.1521348E-03 0.5899502E+01 0.6556 13 Na+ 0.2152003E-01 0.2157898E-01 0.4919874E+03 2.8151 14 Mn++ 0.1945541E-08 0.2425828E-08 0.1321663E-03 0.1096 15 F- 0.6820651E-03 0.7877919E-03 0.1484250E+02 1.3152 16 HPO4-- 0.1494686E-09 0.4490725E-07 0.4274452E-02 -0.9996 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1780944E+00 0.1485071E+00 0.2958728E-01 0.0000000E+00 2 H2O 0.5135281E+02 0.5139890E+02 -.4608721E-01 0.0000000E+00 3 Cl- 0.1099383E-01 0.1099383E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8770967E-02 0.2851594E-02 0.5919373E-02 0.0000000E+00 5 HCO3- 0.1330443E+00 0.1330443E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3596629E-01 0.1820814E-01 0.1775815E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3615480E-09 0.4774990E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9457743E-03 0.1120725E-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 0.1906263E-12 0.3259208E-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- 0.7360960E-03 0.7313210E-03 0.4774990E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4155E-17 Mass of aqueous solution: 0.936071E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.8399900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2729E-03 0.7802E-06 quartz 0.1120E-01 -1.951 0.6732 -0.172 46.99 0.2542 sulfur 0.2368E-01 -1.626 0.7591 -0.120 52.98 0.3672 topaz 0.2387E-05 -5.622 0.4394E-03 -3.357 0.3067E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.432731 g Volume = 0.621596 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: 1.8399900 moles log = 0.2648 Original solution: 1000.0103000 g Original solution / Rock added: 543.49 (Water/Rock Ratio), log = 2.7352 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 16.9847 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6503E-01 0.9082 0.1003E+01 0.1105E+01 CO2,gas 0.9025E+00 0.9531 0.1461E+02 0.1533E+02 CH4,gas 0.2971E-07 1.0140 0.5117E-06 0.5046E-06 H2,gas 0.2521E-06 1.0091 0.4322E-05 0.4283E-05 H2S,gas 0.3248E-01 0.9368 0.5168E+00 0.5516E+00 S2,gas 0.3160E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.9935E-09 1.0000 0.1687E-07 0.1687E-07 SO3,gas 0.2411E-28 1.0000 0.4095E-27 0.4095E-27 SO2,gas 0.4065E-11 1.0000 0.6905E-10 0.6905E-10 HF,gas 0.1494E-07 1.0000 0.2538E-06 0.2538E-06 HCl,gas 0.4979E-11 1.0000 0.8457E-10 0.8457E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 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 -1.698 0.28987E+04 0.001 2 CO2,gas -6.66 -7.19 -0.53 -0.178 0.91238E+03 1.165 3 CH4,gas 4.54 -3.45 -7.99 -1.997 0.13643E+05 -6.291 4 H2,gas 8.00 0.94 -7.06 -4.036 0.12060E+05 -5.364 5 H2S,gas -6.23 -8.22 -1.99 -0.993 0.33905E+04 -0.287 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.26 -9.47 -2.914 0.16173E+05 -7.773 8 SO3,gas 17.12 -11.97 -29.09 -7.272 0.49665E+05 -27.388 9 SO2,gas 0.83 -11.03 -11.86 -3.163 0.20250E+05 -10.161 10 HF,gas 0.47 -7.82 -8.29 -4.147 0.14163E+05 -6.595 11 HCl,gas 5.19 -6.58 -11.77 -5.886 0.20100E+05 -10.073 17 albite -0.38 -5.11 -4.73 -0.364 0.80728E+04 25 anhydrite -5.32 -9.90 -4.58 -2.292 0.78263E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.04 -1.83 -0.305 0.31286E+04 69 diamond -3.10 -5.32 -2.22 -0.633 0.37850E+04 86 gibbsite 4.08 1.04 -3.04 -0.434 0.51893E+04 89 graphite -3.55 -5.32 -1.77 -0.507 0.30273E+04 101 kaolinite -1.33 -3.90 -2.56 -0.233 0.43790E+04 119 microcline -2.49 -7.27 -4.78 -0.368 0.81701E+04 149 pyrophyllite -6.18 -9.87 -3.70 -0.231 0.63163E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 218 gypsum -4.96 -9.90 -4.95 -1.237 0.84481E+04 237 boehmite 4.41 1.04 -3.36 -0.561 0.57456E+04 240 fluorite -9.93 -13.58 -3.65 -1.215 0.62239E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.8399900 MOLES New total amount of reactant added: 1.8799900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.8799900 Water: Moles liquid = 0.5157E+02 kg liquid = 0.9290E+00 Moles total = 0.5139E+02 kg total = 0.9257E+00 Activity = 0.9971 Stoichiometric ionic strength = .1063880E+00 Osmotic coef. = 0.8866 True ionic strength = .2458939E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1123E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.33670E-04 -4.4728 0.27845E-04 -4.5553 0.82700E+00 -0.0825 2 H2O 0.99708E+00 -0.0013 0.99708E+00 -0.0013 3 Cl- 0.12030E-01 -1.9197 0.98791E-02 -2.0053 0.82118E+00 -0.0856 4 SO4-- 0.29023E-02 -2.5373 0.14221E-02 -2.8471 0.48998E+00 -0.3098 5 HCO3- 0.28411E-02 -2.5465 0.23370E-02 -2.6313 0.82259E+00 -0.0848 6 HS- 0.26411E-03 -3.5782 0.21692E-03 -3.6637 0.82132E+00 -0.0855 7 Al+++ 0.11232E-11 -11.9495 0.22792E-12 -12.6422 0.20291E+00 -0.6927 8 H4SiO4 0.10186E-02 -2.9920 0.10186E-02 -2.9920 0.10000E+01 0.0000 9 Ca++ 0.17652E-06 -6.7532 0.85742E-07 -7.0668 0.48575E+00 -0.3136 10 Mg++ 0.84794E-10 -10.0716 0.40967E-10 -10.3876 0.48314E+00 -0.3159 11 Fe++ 0.21341E-12 -12.6708 0.10324E-12 -12.9861 0.48376E+00 -0.3154 12 K+ 0.14872E-03 -3.8276 0.12236E-03 -3.9123 0.82281E+00 -0.0847 13 Na+ 0.21503E-01 -1.6675 0.17654E-01 -1.7532 0.82099E+00 -0.0857 14 Mn++ 0.19545E-08 -8.7090 0.94641E-09 -9.0239 0.48423E+00 -0.3149 15 F- 0.69372E-03 -3.1588 0.56830E-03 -3.2454 0.81920E+00 -0.0866 16 HPO4-- 0.14482E-09 -9.8392 0.70972E-10 -10.1489 0.49006E+00 -0.3098 17 SiF6-2 0.13564E-15 -15.8676 0.66296E-16 -16.1785 0.48876E+00 -0.3109 18 HSiO3- 0.41719E-07 -7.3797 0.34259E-07 -7.4652 0.82118E+00 -0.0856 19 Ca(HSiO3)+ 0.81282E-13 -13.0900 0.66896E-13 -13.1746 0.82302E+00 -0.0846 20 Mg(HSiO3)+ 0.48332E-16 -16.3158 0.39778E-16 -16.4004 0.82302E+00 -0.0846 21 NaHSiO3,aq 0.97820E-08 -8.0096 0.97820E-08 -8.0096 0.10000E+01 0.0000 22 AlO+ 0.48449E-10 -10.3147 0.39874E-10 -10.3993 0.82302E+00 -0.0846 23 AlOH+2 0.11404E-10 -10.9429 0.55286E-11 -11.2574 0.48478E+00 -0.3145 24 HAlO2,aq 0.28435E-09 -9.5462 0.28435E-09 -9.5462 0.10000E+01 0.0000 25 AlO2- 0.27585E-10 -10.5593 0.22605E-10 -10.6458 0.81944E+00 -0.0865 26 CH4,aq 0.35526E-09 -9.4495 0.34528E-09 -9.4618 0.97190E+00 -0.0124 31 CO,aq 0.11485E-10 -10.9399 0.11485E-10 -10.9399 0.10000E+01 0.0000 32 CO2,aq 0.14349E+00 -0.8432 0.13946E+00 -0.8556 0.97190E+00 -0.0124 33 CO3-2 0.14999E-07 -7.8239 0.73309E-08 -8.1348 0.48876E+00 -0.3109 34 CaCO3,aq 0.78815E-11 -11.1034 0.78815E-11 -11.1034 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.62148E-08 -8.2066 0.51149E-08 -8.2912 0.82302E+00 -0.0846 36 CaCl+ 0.16656E-08 -8.7784 0.13708E-08 -8.8630 0.82302E+00 -0.0846 37 CaCl2,aq 0.32174E-11 -11.4925 0.32174E-11 -11.4925 0.10000E+01 0.0000 38 CaF+ 0.86440E-09 -9.0633 0.71142E-09 -9.1479 0.82302E+00 -0.0846 39 CaOH+ 0.26587E-12 -12.5753 0.21882E-12 -12.6599 0.82302E+00 -0.0846 40 CaSO4,aq 0.38718E-07 -7.4121 0.38718E-07 -7.4121 0.10000E+01 0.0000 41 HCl,aq 0.50408E-07 -7.2975 0.50408E-07 -7.2975 0.10000E+01 0.0000 45 HF,aq 0.10833E-03 -3.9653 0.10833E-03 -3.9653 0.10000E+01 0.0000 46 HF2- 0.25311E-07 -7.5967 0.20785E-07 -7.6822 0.82118E+00 -0.0856 48 FeCl+ 0.19615E-14 -14.7074 0.16144E-14 -14.7920 0.82302E+00 -0.0846 51 FeF+ 0.36430E-14 -14.4385 0.29982E-14 -14.5231 0.82302E+00 -0.0846 54 FeOH+ 0.14621E-15 -15.8350 0.12034E-15 -15.9196 0.82302E+00 -0.0846 60 H2,aq 0.33632E-08 -8.4733 0.32687E-08 -8.4856 0.97190E+00 -0.0124 61 KCl,aq 0.21910E-07 -7.6594 0.21910E-07 -7.6594 0.10000E+01 0.0000 62 KHSO4,aq 0.13699E-10 -10.8633 0.13699E-10 -10.8633 0.10000E+01 0.0000 63 KOH,aq 0.18712E-11 -11.7279 0.18712E-11 -11.7279 0.10000E+01 0.0000 64 KSO4- 0.32882E-05 -5.4830 0.27002E-05 -5.5686 0.82118E+00 -0.0856 65 MgCO3,aq 0.94391E-15 -15.0251 0.94391E-15 -15.0251 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30342E-11 -11.5180 0.24972E-11 -11.6025 0.82302E+00 -0.0846 67 MgCl+ 0.72127E-12 -12.1419 0.59362E-12 -12.2265 0.82302E+00 -0.0846 68 MgF+ 0.15299E-11 -11.8153 0.12591E-11 -11.8999 0.82302E+00 -0.0846 69 MgOH+ 0.70293E-15 -15.1531 0.57852E-15 -15.2377 0.82302E+00 -0.0846 71 MnF+ 0.11007E-10 -10.9583 0.90592E-11 -11.0429 0.82302E+00 -0.0846 72 MnO,aq 0.12604E-17 -17.8995 0.12604E-17 -17.8995 0.10000E+01 0.0000 73 MnOH+ 0.12451E-12 -12.9048 0.10248E-12 -12.9894 0.82302E+00 -0.0846 78 MnCl+ 0.69956E-10 -10.1552 0.57575E-10 -10.2398 0.82302E+00 -0.0846 79 MnSO4,aq 0.38854E-09 -9.4106 0.38854E-09 -9.4106 0.10000E+01 0.0000 80 NaCl,aq 0.57799E-04 -4.2381 0.57799E-04 -4.2381 0.10000E+01 0.0000 81 NaF,aq 0.23489E-05 -5.6291 0.23489E-05 -5.6291 0.10000E+01 0.0000 82 NaOH,aq 0.27161E-09 -9.5661 0.27161E-09 -9.5661 0.10000E+01 0.0000 84 OH- 0.25248E-07 -7.5978 0.20689E-07 -7.6843 0.81944E+00 -0.0865 91 H2PO3- 0.49302E-19 -19.3071 0.40486E-19 -19.3927 0.82118E+00 -0.0856 92 H3PO4,aq 0.38486E-09 -9.4147 0.38486E-09 -9.4147 0.10000E+01 0.0000 93 H2PO4- 0.44345E-07 -7.3532 0.36456E-07 -7.4382 0.82209E+00 -0.0851 94 PO4-3 0.96750E-17 -17.0143 0.20796E-17 -17.6820 0.21494E+00 -0.6677 96 H3P2O7- 0.10936E-17 -17.9612 0.89802E-18 -18.0467 0.82118E+00 -0.0856 97 H2P2O7-2 0.21384E-15 -15.6699 0.10452E-15 -15.9808 0.48876E+00 -0.3109 98 HP2O7-3 0.36889E-17 -17.4331 0.74948E-18 -18.1252 0.20317E+00 -0.6921 100 H2S,aq 0.19208E-01 -1.7165 0.18668E-01 -1.7289 0.97190E+00 -0.0124 101 S2-2 0.65263E-09 -9.1853 0.31898E-09 -9.4962 0.48876E+00 -0.3109 102 S3-2 0.50216E-08 -8.2992 0.24544E-08 -8.6101 0.48876E+00 -0.3109 103 S3- 0.97577E-06 -6.0107 0.80128E-06 -6.0962 0.82118E+00 -0.0856 104 S4-2 0.25524E-07 -7.5931 0.12475E-07 -7.9040 0.48876E+00 -0.3109 105 S5-2 0.86504E-07 -7.0630 0.42280E-07 -7.3739 0.48876E+00 -0.3109 106 SO2,aq 0.16190E-10 -10.7908 0.16190E-10 -10.7908 0.10000E+01 0.0000 107 SO3-2 0.12188E-11 -11.9141 0.60580E-12 -12.2177 0.49705E+00 -0.3036 108 HSO3- 0.12862E-08 -8.8907 0.10562E-08 -8.9763 0.82118E+00 -0.0856 109 HSO4- 0.46313E-04 -4.3343 0.38160E-04 -4.4184 0.82396E+00 -0.0841 111 S2O3-2 0.63989E-06 -6.1939 0.31275E-06 -6.5048 0.48876E+00 -0.3109 112 HS2O3- 0.18962E-08 -8.7221 0.15571E-08 -8.8077 0.82118E+00 -0.0856 113 H2S2O3,aq 0.69508E-12 -12.1580 0.69508E-12 -12.1580 0.10000E+01 0.0000 121 S4O6-2 0.10074E-13 -13.9968 0.49238E-14 -14.3077 0.48876E+00 -0.3109 Charge balance for all species = -.5929E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3366981E-04 0.1628868E+00 0.1628001E+03 0.0000 2 H2O 0.1000000E+01 0.5536476E+02 0.9890290E+06 0.0000 3 Cl- 0.1203045E-01 0.1208832E-01 0.4249649E+03 2.5500 4 SO4-- 0.2902280E-02 0.2953281E-02 0.2813123E+03 6.2634 5 HCO3- 0.2841055E-02 0.1463284E+00 0.8853498E+04 1.9239 6 HS- 0.2641136E-03 0.1947508E-01 0.6386661E+03 0.8916 7 Al+++ 0.1123236E-11 0.3729085E-09 0.9977059E-05 1.0235 8 H4SiO4 0.1018645E-02 0.1018697E-02 0.9708944E+02 -2.9920 9 Ca++ 0.1765165E-06 0.2239910E-06 0.8901654E-02 2.0437 10 Mg++ 0.8479361E-10 0.9008067E-10 0.2171633E-05 -1.2771 11 Fe++ 0.2134140E-12 0.2191648E-12 0.1213681E-07 -3.8756 12 K+ 0.1487159E-03 0.1520261E-03 0.5894556E+01 0.6429 13 Na+ 0.2150340E-01 0.2156356E-01 0.4915750E+03 2.8021 14 Mn++ 0.1954471E-08 0.2424094E-08 0.1320555E-03 0.0866 15 F- 0.6937232E-03 0.8044519E-03 0.1515452E+02 1.3098 16 HPO4-- 0.1448237E-09 0.4487515E-07 0.4270870E-02 -1.0384 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1824014E+00 0.1513188E+00 0.3108254E-01 0.0000000E+00 2 H2O 0.5138556E+02 0.5143284E+02 -.4728226E-01 0.0000000E+00 3 Cl- 0.1122983E-01 0.1122983E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.8961967E-02 0.2743543E-02 0.6218424E-02 0.0000000E+00 5 HCO3- 0.1359363E+00 0.1359363E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3674729E-01 0.1809199E-01 0.1865530E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3464252E-09 0.4775006E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9463504E-03 0.1120667E-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 0.2036000E-12 0.3259207E-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- 0.7520960E-03 0.7473210E-03 0.4775006E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.5005E-17 Mass of aqueous solution: 0.936856E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.8799900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2658E-03 0.7802E-06 quartz 0.1120E-01 -1.951 0.6732 -0.172 45.76 0.2542 sulfur 0.2487E-01 -1.604 0.7974 -0.098 54.21 0.3858 topaz 0.2388E-05 -5.622 0.4394E-03 -3.357 0.2987E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.471046 g Volume = 0.640136 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: 1.8799900 moles log = 0.2742 Original solution: 1000.0103000 g Original solution / Rock added: 531.92 (Water/Rock Ratio), log = 2.7258 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 17.3252 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6386E-01 0.9066 0.1003E+01 0.1106E+01 CO2,gas 0.9045E+00 0.9521 0.1492E+02 0.1567E+02 CH4,gas 0.2892E-07 1.0142 0.5082E-06 0.5011E-06 H2,gas 0.2454E-06 1.0093 0.4291E-05 0.4252E-05 H2S,gas 0.3166E-01 0.9356 0.5132E+00 0.5485E+00 S2,gas 0.3098E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.9878E-09 1.0000 0.1711E-07 0.1711E-07 SO3,gas 0.2413E-28 1.0000 0.4181E-27 0.4181E-27 SO2,gas 0.4041E-11 1.0000 0.7001E-10 0.7001E-10 HF,gas 0.1535E-07 1.0000 0.2660E-06 0.2660E-06 HCl,gas 0.5134E-11 1.0000 0.8895E-10 0.8895E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 -0.30331E-11 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 -1.698 0.28987E+04 0.001 2 CO2,gas -6.66 -7.19 -0.53 -0.175 0.89675E+03 1.174 3 CH4,gas 4.54 -3.45 -7.99 -1.998 0.13648E+05 -6.294 4 H2,gas 8.00 0.93 -7.07 -4.038 0.12066E+05 -5.367 5 H2S,gas -6.23 -8.22 -1.99 -0.994 0.33957E+04 -0.290 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.25 -9.47 -2.912 0.16162E+05 -7.767 8 SO3,gas 17.12 -11.96 -29.08 -7.269 0.49649E+05 -27.379 9 SO2,gas 0.83 -11.02 -11.85 -3.161 0.20240E+05 -10.155 10 HF,gas 0.47 -7.80 -8.27 -4.137 0.14128E+05 -6.575 11 HCl,gas 5.19 -6.56 -11.75 -5.875 0.20063E+05 -10.051 17 albite -0.38 -5.15 -4.76 -0.366 0.81299E+04 25 anhydrite -5.32 -9.91 -4.60 -2.299 0.78494E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.02 -1.85 -0.309 0.31634E+04 69 diamond -3.10 -5.32 -2.21 -0.632 0.37797E+04 86 gibbsite 4.08 1.02 -3.06 -0.437 0.52242E+04 89 graphite -3.55 -5.32 -1.77 -0.506 0.30219E+04 101 kaolinite -1.33 -3.94 -2.61 -0.237 0.44486E+04 119 microcline -2.49 -7.30 -4.82 -0.371 0.82264E+04 149 pyrophyllite -6.18 -9.92 -3.74 -0.234 0.63859E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 218 gypsum -4.96 -9.92 -4.96 -1.240 0.84713E+04 237 boehmite 4.41 1.02 -3.39 -0.564 0.57804E+04 240 fluorite -9.93 -13.56 -3.63 -1.209 0.61929E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.8799900 MOLES New total amount of reactant added: 1.9199900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.9199900 Water: Moles liquid = 0.5160E+02 kg liquid = 0.9296E+00 Moles total = 0.5142E+02 kg total = 0.9263E+00 Activity = 0.9970 Stoichiometric ionic strength = .1077215E+00 Osmotic coef. = 0.8876 True ionic strength = .2445719E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1147E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.34684E-04 -4.4599 0.28693E-04 -4.5422 0.82725E+00 -0.0824 2 H2O 0.99703E+00 -0.0013 0.99703E+00 -0.0013 3 Cl- 0.12275E-01 -1.9110 0.10083E-01 -1.9964 0.82145E+00 -0.0854 4 SO4-- 0.27857E-02 -2.5551 0.13669E-02 -2.8643 0.49068E+00 -0.3092 5 HCO3- 0.28135E-02 -2.5508 0.23151E-02 -2.6354 0.82285E+00 -0.0847 6 HS- 0.25447E-03 -3.5944 0.20907E-03 -3.6797 0.82159E+00 -0.0853 7 Al+++ 0.11690E-11 -11.9322 0.23802E-12 -12.6234 0.20360E+00 -0.6912 8 H4SiO4 0.10185E-02 -2.9920 0.10185E-02 -2.9920 0.10000E+01 0.0000 9 Ca++ 0.17754E-06 -6.7507 0.86365E-07 -7.0637 0.48646E+00 -0.3129 10 Mg++ 0.84716E-10 -10.0720 0.40991E-10 -10.3873 0.48386E+00 -0.3153 11 Fe++ 0.22783E-12 -12.6424 0.11038E-12 -12.9571 0.48448E+00 -0.3147 12 K+ 0.14873E-03 -3.8276 0.12242E-03 -3.9122 0.82307E+00 -0.0846 13 Na+ 0.21487E-01 -1.6678 0.17646E-01 -1.7533 0.82126E+00 -0.0855 14 Mn++ 0.19634E-08 -8.7070 0.95217E-09 -9.0213 0.48495E+00 -0.3143 15 F- 0.70514E-03 -3.1517 0.57785E-03 -3.2382 0.81948E+00 -0.0865 16 HPO4-- 0.14027E-09 -9.8531 0.68837E-10 -10.1622 0.49077E+00 -0.3091 17 SiF6-2 0.16878E-15 -15.7727 0.82614E-16 -16.0829 0.48947E+00 -0.3103 18 HSiO3- 0.40471E-07 -7.3929 0.33245E-07 -7.4783 0.82145E+00 -0.0854 19 Ca(HSiO3)+ 0.79424E-13 -13.1000 0.65388E-13 -13.1845 0.82328E+00 -0.0845 20 Mg(HSiO3)+ 0.46914E-16 -16.3287 0.38623E-16 -16.4132 0.82328E+00 -0.0845 21 NaHSiO3,aq 0.94883E-08 -8.0228 0.94883E-08 -8.0228 0.10000E+01 0.0000 22 AlO+ 0.47633E-10 -10.3221 0.39215E-10 -10.4065 0.82328E+00 -0.0845 23 AlOH+2 0.11540E-10 -10.9378 0.56027E-11 -11.2516 0.48551E+00 -0.3138 24 HAlO2,aq 0.27137E-09 -9.5664 0.27137E-09 -9.5664 0.10000E+01 0.0000 25 AlO2- 0.25540E-10 -10.5928 0.20936E-10 -10.6791 0.81972E+00 -0.0863 26 CH4,aq 0.35297E-09 -9.4523 0.34295E-09 -9.4648 0.97161E+00 -0.0125 31 CO,aq 0.11644E-10 -10.9339 0.11644E-10 -10.9339 0.10000E+01 0.0000 32 CO2,aq 0.14652E+00 -0.8341 0.14236E+00 -0.8466 0.97161E+00 -0.0125 33 CO3-2 0.14399E-07 -7.8417 0.70476E-08 -8.1520 0.48947E+00 -0.3103 34 CaCO3,aq 0.76320E-11 -11.1174 0.76320E-11 -11.1174 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61993E-08 -8.2077 0.51038E-08 -8.2921 0.82328E+00 -0.0845 36 CaCl+ 0.17117E-08 -8.7666 0.14092E-08 -8.8510 0.82328E+00 -0.0845 37 CaCl2,aq 0.33758E-11 -11.4716 0.33758E-11 -11.4716 0.10000E+01 0.0000 38 CaF+ 0.88504E-09 -9.0530 0.72863E-09 -9.1375 0.82328E+00 -0.0845 39 CaOH+ 0.25979E-12 -12.5854 0.21388E-12 -12.6698 0.82328E+00 -0.0845 40 CaSO4,aq 0.37487E-07 -7.4261 0.37487E-07 -7.4261 0.10000E+01 0.0000 41 HCl,aq 0.53014E-07 -7.2756 0.53014E-07 -7.2756 0.10000E+01 0.0000 45 HF,aq 0.11350E-03 -3.9450 0.11350E-03 -3.9450 0.10000E+01 0.0000 46 HF2- 0.26957E-07 -7.5693 0.22144E-07 -7.6547 0.82145E+00 -0.0854 48 FeCl+ 0.21397E-14 -14.6696 0.17616E-14 -14.7541 0.82328E+00 -0.0845 51 FeF+ 0.39590E-14 -14.4024 0.32594E-14 -14.4869 0.82328E+00 -0.0845 54 FeOH+ 0.15165E-15 -15.8192 0.12485E-15 -15.9036 0.82328E+00 -0.0845 60 H2,aq 0.33411E-08 -8.4761 0.32463E-08 -8.4886 0.97161E+00 -0.0125 61 KCl,aq 0.22371E-07 -7.6503 0.22371E-07 -7.6503 0.10000E+01 0.0000 62 KHSO4,aq 0.13575E-10 -10.8673 0.13575E-10 -10.8673 0.10000E+01 0.0000 63 KOH,aq 0.18166E-11 -11.7407 0.18166E-11 -11.7407 0.10000E+01 0.0000 64 KSO4- 0.31610E-05 -5.5002 0.25966E-05 -5.5856 0.82145E+00 -0.0854 65 MgCO3,aq 0.90796E-15 -15.0419 0.90796E-15 -15.0419 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.30065E-11 -11.5219 0.24752E-11 -11.6064 0.82328E+00 -0.0845 67 MgCl+ 0.73634E-12 -12.1329 0.60621E-12 -12.2174 0.82328E+00 -0.0845 68 MgF+ 0.15560E-11 -11.8080 0.12810E-11 -11.8924 0.82328E+00 -0.0845 69 MgOH+ 0.68231E-15 -15.1660 0.56173E-15 -15.2505 0.82328E+00 -0.0845 71 MnF+ 0.11257E-10 -10.9486 0.92676E-11 -11.0330 0.82328E+00 -0.0845 72 MnO,aq 0.11942E-17 -17.9229 0.11942E-17 -17.9229 0.10000E+01 0.0000 73 MnOH+ 0.12153E-12 -12.9153 0.10005E-12 -12.9998 0.82328E+00 -0.0845 78 MnCl+ 0.71810E-10 -10.1438 0.59120E-10 -10.2283 0.82328E+00 -0.0845 79 MnSO4,aq 0.37574E-09 -9.4251 0.37574E-09 -9.4251 0.10000E+01 0.0000 80 NaCl,aq 0.58965E-04 -4.2294 0.58965E-04 -4.2294 0.10000E+01 0.0000 81 NaF,aq 0.23873E-05 -5.6221 0.23873E-05 -5.6221 0.10000E+01 0.0000 82 NaOH,aq 0.26345E-09 -9.5793 0.26345E-09 -9.5793 0.10000E+01 0.0000 84 OH- 0.24492E-07 -7.6110 0.20077E-07 -7.6973 0.81972E+00 -0.0863 91 H2PO3- 0.48924E-19 -19.3105 0.40188E-19 -19.3959 0.82145E+00 -0.0854 92 H3PO4,aq 0.39636E-09 -9.4019 0.39636E-09 -9.4019 0.10000E+01 0.0000 93 H2PO4- 0.44306E-07 -7.3535 0.36436E-07 -7.4385 0.82235E+00 -0.0849 94 PO4-3 0.90782E-17 -17.0420 0.19574E-17 -17.7083 0.21562E+00 -0.6663 96 H3P2O7- 0.11253E-17 -17.9487 0.92437E-18 -18.0342 0.82145E+00 -0.0854 97 H2P2O7-2 0.21330E-15 -15.6710 0.10440E-15 -15.9813 0.48947E+00 -0.3103 98 HP2O7-3 0.35641E-17 -17.4481 0.72657E-18 -18.1387 0.20386E+00 -0.6907 100 H2S,aq 0.19082E-01 -1.7194 0.18540E-01 -1.7319 0.97161E+00 -0.0125 101 S2-2 0.60955E-09 -9.2150 0.29835E-09 -9.5253 0.48947E+00 -0.3103 102 S3-2 0.46901E-08 -8.3288 0.22957E-08 -8.6391 0.48947E+00 -0.3103 103 S3- 0.94339E-06 -6.0253 0.77494E-06 -6.1107 0.82145E+00 -0.0854 104 S4-2 0.23839E-07 -7.6227 0.11668E-07 -7.9330 0.48947E+00 -0.3103 105 S5-2 0.80794E-07 -7.0926 0.39546E-07 -7.4029 0.48947E+00 -0.3103 106 SO2,aq 0.16412E-10 -10.7848 0.16412E-10 -10.7848 0.10000E+01 0.0000 107 SO3-2 0.11619E-11 -11.9348 0.57835E-12 -12.2378 0.49774E+00 -0.3030 108 HSO3- 0.12649E-08 -8.8980 0.10390E-08 -8.9834 0.82145E+00 -0.0854 109 HSO4- 0.45858E-04 -4.3386 0.37797E-04 -4.4225 0.82422E+00 -0.0840 111 S2O3-2 0.61001E-06 -6.2147 0.29858E-06 -6.5249 0.48947E+00 -0.3103 112 HS2O3- 0.18648E-08 -8.7294 0.15318E-08 -8.8148 0.82145E+00 -0.0854 113 H2S2O3,aq 0.70460E-12 -12.1521 0.70460E-12 -12.1521 0.10000E+01 0.0000 121 S4O6-2 0.98022E-14 -14.0087 0.47979E-14 -14.3190 0.48947E+00 -0.3103 Charge balance for all species = -.5924E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3468436E-04 0.1658006E+00 0.1656918E+03 0.0000 2 H2O 0.1000000E+01 0.5536173E+02 0.9888526E+06 0.0000 3 Cl- 0.1227450E-01 0.1233355E-01 0.4335322E+03 2.5458 4 SO4-- 0.2785692E-02 0.2836051E-02 0.2701122E+03 6.2202 5 HCO3- 0.2813517E-02 0.1493347E+00 0.9034280E+04 1.9068 6 HS- 0.2544725E-03 0.1933955E-01 0.6341431E+03 0.8625 7 Al+++ 0.1169049E-11 0.3572542E-09 0.9557050E-05 1.0033 8 H4SiO4 0.1018539E-02 0.1018589E-02 0.9706716E+02 -2.9920 9 Ca++ 0.1775366E-06 0.2238310E-06 0.8894198E-02 2.0208 10 Mg++ 0.8471580E-10 0.9001634E-10 0.2169814E-05 -1.3029 11 Fe++ 0.2278266E-12 0.2340769E-12 0.1296101E-07 -3.8727 12 K+ 0.1487341E-03 0.1519175E-03 0.5889619E+01 0.6301 13 Na+ 0.2148680E-01 0.2154816E-01 0.4911632E+03 2.7889 14 Mn++ 0.1963436E-08 0.2422363E-08 0.1319449E-03 0.0632 15 F- 0.7051442E-03 0.8210883E-03 0.1546601E+02 1.3040 16 HPO4-- 0.1402650E-09 0.4484311E-07 0.4267292E-02 -1.0777 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1867084E+00 0.1541357E+00 0.3257265E-01 0.0000000E+00 2 H2O 0.5141830E+02 0.5146678E+02 -.4847319E-01 0.0000000E+00 3 Cl- 0.1146583E-01 0.1146583E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9152967E-02 0.2636522E-02 0.6516446E-02 0.0000000E+00 5 HCO3- 0.1388283E+00 0.1388283E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3752829E-01 0.1797892E-01 0.1954937E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3321197E-09 0.4775020E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9469264E-03 0.1120609E-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 0.2176086E-12 0.3259205E-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- 0.7680960E-03 0.7633210E-03 0.4775020E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.6483E-17 Mass of aqueous solution: 0.937642E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.9199900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2591E-03 0.7802E-06 quartz 0.1120E-01 -1.951 0.6731 -0.172 44.60 0.2542 sulfur 0.2607E-01 -1.584 0.8357 -0.078 55.37 0.4043 topaz 0.2388E-05 -5.622 0.4394E-03 -3.357 0.2911E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.509230 g Volume = 0.658613 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: 1.9199900 moles log = 0.2833 Original solution: 1000.0103000 g Original solution / Rock added: 520.84 (Water/Rock Ratio), log = 2.7167 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 17.6660 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6273E-01 0.9050 0.1003E+01 0.1108E+01 CO2,gas 0.9064E+00 0.9512 0.1523E+02 0.1601E+02 CH4,gas 0.2817E-07 1.0144 0.5048E-06 0.4976E-06 H2,gas 0.2390E-06 1.0095 0.4262E-05 0.4222E-05 H2S,gas 0.3088E-01 0.9344 0.5097E+00 0.5454E+00 S2,gas 0.3038E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.9822E-09 1.0000 0.1735E-07 0.1735E-07 SO3,gas 0.2416E-28 1.0000 0.4268E-27 0.4268E-27 SO2,gas 0.4017E-11 1.0000 0.7097E-10 0.7097E-10 HF,gas 0.1578E-07 1.0000 0.2787E-06 0.2787E-06 HCl,gas 0.5295E-11 1.0000 0.9354E-10 0.9354E-10 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 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.75827E-12 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 -0.60662E-11 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 -1.698 0.28987E+04 0.001 2 CO2,gas -6.66 -7.18 -0.52 -0.172 0.88146E+03 1.183 3 CH4,gas 4.54 -3.45 -8.00 -1.999 0.13653E+05 -6.297 4 H2,gas 8.00 0.93 -7.07 -4.040 0.12071E+05 -5.370 5 H2S,gas -6.23 -8.22 -1.99 -0.996 0.34008E+04 -0.293 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.24 -9.46 -2.911 0.16152E+05 -7.761 8 SO3,gas 17.12 -11.95 -29.07 -7.267 0.49634E+05 -27.370 9 SO2,gas 0.83 -11.02 -11.85 -3.159 0.20230E+05 -10.149 10 HF,gas 0.47 -7.78 -8.25 -4.127 0.14093E+05 -6.555 11 HCl,gas 5.19 -6.54 -11.73 -5.864 0.20025E+05 -10.029 17 albite -0.38 -5.18 -4.79 -0.369 0.81871E+04 25 anhydrite -5.32 -9.93 -4.61 -2.306 0.78734E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 1.00 -1.87 -0.312 0.31981E+04 69 diamond -3.10 -5.31 -2.21 -0.632 0.37745E+04 86 gibbsite 4.08 1.00 -3.08 -0.440 0.52588E+04 89 graphite -3.55 -5.31 -1.77 -0.505 0.30168E+04 101 kaolinite -1.33 -3.98 -2.65 -0.241 0.45179E+04 119 microcline -2.49 -7.34 -4.85 -0.373 0.82830E+04 149 pyrophyllite -6.18 -9.96 -3.78 -0.236 0.64551E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 218 gypsum -4.96 -9.93 -4.98 -1.244 0.84954E+04 237 boehmite 4.41 1.00 -3.41 -0.568 0.58150E+04 240 fluorite -9.93 -13.54 -3.61 -1.203 0.61628E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.9199900 MOLES New total amount of reactant added: 1.9599900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.9599900 Water: Moles liquid = 0.5164E+02 kg liquid = 0.9303E+00 Moles total = 0.5145E+02 kg total = 0.9269E+00 Activity = 0.9970 Stoichiometric ionic strength = .1090571E+00 Osmotic coef. = 0.8886 True ionic strength = .2432638E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1170E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.35745E-04 -4.4468 0.29579E-04 -4.5290 0.82750E+00 -0.0822 2 H2O 0.99697E+00 -0.0013 0.99697E+00 -0.0013 3 Cl- 0.12518E-01 -1.9025 0.10286E-01 -1.9877 0.82171E+00 -0.0853 4 SO4-- 0.26704E-02 -2.5734 0.13122E-02 -2.8820 0.49139E+00 -0.3086 5 HCO3- 0.27838E-02 -2.5554 0.22914E-02 -2.6399 0.82311E+00 -0.0845 6 HS- 0.24511E-03 -3.6106 0.20144E-03 -3.6959 0.82185E+00 -0.0852 7 Al+++ 0.12186E-11 -11.9141 0.24894E-12 -12.6039 0.20429E+00 -0.6898 8 H4SiO4 0.10184E-02 -2.9921 0.10184E-02 -2.9921 0.10000E+01 0.0000 9 Ca++ 0.17857E-06 -6.7482 0.86995E-07 -7.0605 0.48718E+00 -0.3123 10 Mg++ 0.84641E-10 -10.0724 0.41016E-10 -10.3870 0.48459E+00 -0.3146 11 Fe++ 0.24340E-12 -12.6137 0.11810E-12 -12.9278 0.48520E+00 -0.3141 12 K+ 0.14875E-03 -3.8275 0.12247E-03 -3.9120 0.82333E+00 -0.0844 13 Na+ 0.21470E-01 -1.6682 0.17638E-01 -1.7535 0.82153E+00 -0.0854 14 Mn++ 0.19724E-08 -8.7050 0.95795E-09 -9.0187 0.48567E+00 -0.3137 15 F- 0.71632E-03 -3.1449 0.58720E-03 -3.2312 0.81975E+00 -0.0863 16 HPO4-- 0.13579E-09 -9.8671 0.66736E-10 -10.1756 0.49147E+00 -0.3085 17 SiF6-2 0.20962E-15 -15.6786 0.10275E-15 -15.9882 0.49017E+00 -0.3096 18 HSiO3- 0.39244E-07 -7.4062 0.32247E-07 -7.4915 0.82171E+00 -0.0853 19 Ca(HSiO3)+ 0.77577E-13 -13.1103 0.63887E-13 -13.1946 0.82354E+00 -0.0843 20 Mg(HSiO3)+ 0.45519E-16 -16.3418 0.37486E-16 -16.4261 0.82354E+00 -0.0843 21 NaHSiO3,aq 0.91993E-08 -8.0362 0.91993E-08 -8.0362 0.10000E+01 0.0000 22 AlO+ 0.46859E-10 -10.3292 0.38591E-10 -10.4135 0.82354E+00 -0.0843 23 AlOH+2 0.11690E-10 -10.9322 0.56839E-11 -11.2454 0.48622E+00 -0.3132 24 HAlO2,aq 0.25903E-09 -9.5866 0.25903E-09 -9.5866 0.10000E+01 0.0000 25 AlO2- 0.23640E-10 -10.6263 0.19385E-10 -10.7125 0.81999E+00 -0.0862 26 CH4,aq 0.35072E-09 -9.4550 0.34065E-09 -9.4677 0.97131E+00 -0.0126 31 CO,aq 0.11802E-10 -10.9280 0.11802E-10 -10.9280 0.10000E+01 0.0000 32 CO2,aq 0.14955E+00 -0.8252 0.14526E+00 -0.8378 0.97131E+00 -0.0126 33 CO3-2 0.13804E-07 -7.8600 0.67663E-08 -8.1696 0.49017E+00 -0.3096 34 CaCO3,aq 0.73808E-11 -11.1319 0.73808E-11 -11.1319 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61785E-08 -8.2091 0.50883E-08 -8.2934 0.82354E+00 -0.0843 36 CaCl+ 0.17585E-08 -8.7549 0.14482E-08 -8.8392 0.82354E+00 -0.0843 37 CaCl2,aq 0.35390E-11 -11.4511 0.35390E-11 -11.4511 0.10000E+01 0.0000 38 CaF+ 0.90562E-09 -9.0431 0.74582E-09 -9.1274 0.82354E+00 -0.0843 39 CaOH+ 0.25375E-12 -12.5956 0.20897E-12 -12.6799 0.82354E+00 -0.0843 40 CaSO4,aq 0.36249E-07 -7.4407 0.36249E-07 -7.4407 0.10000E+01 0.0000 41 HCl,aq 0.55755E-07 -7.2537 0.55755E-07 -7.2537 0.10000E+01 0.0000 45 HF,aq 0.11890E-03 -3.9248 0.11890E-03 -3.9248 0.10000E+01 0.0000 46 HF2- 0.28687E-07 -7.5423 0.23573E-07 -7.6276 0.82171E+00 -0.0853 48 FeCl+ 0.23348E-14 -14.6317 0.19228E-14 -14.7161 0.82354E+00 -0.0843 51 FeF+ 0.43031E-14 -14.3662 0.35438E-14 -14.4505 0.82354E+00 -0.0843 54 FeOH+ 0.15733E-15 -15.8032 0.12957E-15 -15.8875 0.82354E+00 -0.0843 60 H2,aq 0.33197E-08 -8.4789 0.32245E-08 -8.4915 0.97131E+00 -0.0126 61 KCl,aq 0.22833E-07 -7.6414 0.22833E-07 -7.6414 0.10000E+01 0.0000 62 KHSO4,aq 0.13440E-10 -10.8716 0.13440E-10 -10.8716 0.10000E+01 0.0000 63 KOH,aq 0.17629E-11 -11.7538 0.17629E-11 -11.7538 0.10000E+01 0.0000 64 KSO4- 0.30349E-05 -5.5179 0.24938E-05 -5.6031 0.82171E+00 -0.0853 65 MgCO3,aq 0.87225E-15 -15.0594 0.87225E-15 -15.0594 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.29766E-11 -11.5263 0.24513E-11 -11.6106 0.82354E+00 -0.0843 67 MgCl+ 0.75142E-12 -12.1241 0.61883E-12 -12.2084 0.82354E+00 -0.0843 68 MgF+ 0.15817E-11 -11.8009 0.13026E-11 -11.8852 0.82354E+00 -0.0843 69 MgOH+ 0.66201E-15 -15.1791 0.54519E-15 -15.2634 0.82354E+00 -0.0843 71 MnF+ 0.11505E-10 -10.9391 0.94747E-11 -11.0234 0.82354E+00 -0.0843 72 MnO,aq 0.11304E-17 -17.9468 0.11304E-17 -17.9468 0.10000E+01 0.0000 73 MnOH+ 0.11856E-12 -12.9261 0.97635E-13 -13.0104 0.82354E+00 -0.0843 78 MnCl+ 0.73681E-10 -10.1326 0.60680E-10 -10.2170 0.82354E+00 -0.0843 79 MnSO4,aq 0.36290E-09 -9.4402 0.36290E-09 -9.4402 0.10000E+01 0.0000 80 NaCl,aq 0.60128E-04 -4.2209 0.60128E-04 -4.2209 0.10000E+01 0.0000 81 NaF,aq 0.24248E-05 -5.6153 0.24248E-05 -5.6153 0.10000E+01 0.0000 82 NaOH,aq 0.25543E-09 -9.5927 0.25543E-09 -9.5927 0.10000E+01 0.0000 84 OH- 0.23749E-07 -7.6244 0.19474E-07 -7.7105 0.81999E+00 -0.0862 91 H2PO3- 0.48554E-19 -19.3138 0.39897E-19 -19.3991 0.82171E+00 -0.0853 92 H3PO4,aq 0.40837E-09 -9.3889 0.40837E-09 -9.3889 0.10000E+01 0.0000 93 H2PO4- 0.44267E-07 -7.3539 0.36415E-07 -7.4387 0.82262E+00 -0.0848 94 PO4-3 0.85107E-17 -17.0700 0.18408E-17 -17.7350 0.21629E+00 -0.6650 96 H3P2O7- 0.11584E-17 -17.9361 0.95189E-18 -18.0214 0.82171E+00 -0.0853 97 H2P2O7-2 0.21276E-15 -15.6721 0.10429E-15 -15.9818 0.49017E+00 -0.3096 98 HP2O7-3 0.34419E-17 -17.4632 0.70402E-18 -18.1524 0.20454E+00 -0.6892 100 H2S,aq 0.18959E-01 -1.7222 0.18415E-01 -1.7348 0.97131E+00 -0.0126 101 S2-2 0.56888E-09 -9.2450 0.27885E-09 -9.5546 0.49017E+00 -0.3096 102 S3-2 0.43772E-08 -8.3588 0.21456E-08 -8.6685 0.49017E+00 -0.3096 103 S3- 0.91173E-06 -6.0401 0.74918E-06 -6.1254 0.82171E+00 -0.0853 104 S4-2 0.22248E-07 -7.6527 0.10905E-07 -7.9624 0.49017E+00 -0.3096 105 S5-2 0.75403E-07 -7.1226 0.36961E-07 -7.4323 0.49017E+00 -0.3096 106 SO2,aq 0.16633E-10 -10.7790 0.16633E-10 -10.7790 0.10000E+01 0.0000 107 SO3-2 0.11065E-11 -11.9560 0.55151E-12 -12.2585 0.49842E+00 -0.3024 108 HSO3- 0.12430E-08 -8.9055 0.10214E-08 -8.9908 0.82171E+00 -0.0853 109 HSO4- 0.45369E-04 -4.3432 0.37406E-04 -4.4271 0.82448E+00 -0.0838 111 S2O3-2 0.58086E-06 -6.2359 0.28472E-06 -6.5456 0.49017E+00 -0.3096 112 HS2O3- 0.18326E-08 -8.7369 0.15058E-08 -8.8222 0.82171E+00 -0.0853 113 H2S2O3,aq 0.71405E-12 -12.1463 0.71405E-12 -12.1463 0.10000E+01 0.0000 121 S4O6-2 0.95231E-14 -14.0212 0.46680E-14 -14.3309 0.49017E+00 -0.3096 Charge balance for all species = -.5920E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3574544E-04 0.1687157E+00 0.1685842E+03 0.0000 2 H2O 0.1000000E+01 0.5535869E+02 0.9886763E+06 0.0000 3 Cl- 0.1251821E-01 0.1257842E-01 0.4420852E+03 2.5413 4 SO4-- 0.2670411E-02 0.2720098E-02 0.2590367E+03 6.1760 5 HCO3- 0.2783785E-02 0.1523368E+00 0.9214757E+04 1.8891 6 HS- 0.2451067E-03 0.1920754E-01 0.6297369E+03 0.8332 7 Al+++ 0.1218588E-11 0.3424415E-09 0.9159658E-05 0.9831 8 H4SiO4 0.1018432E-02 0.1018481E-02 0.9704488E+02 -2.9921 9 Ca++ 0.1785681E-06 0.2236713E-06 0.8886753E-02 1.9975 10 Mg++ 0.8464087E-10 0.8995210E-10 0.2167998E-05 -1.3290 11 Fe++ 0.2433997E-12 0.2501950E-12 0.1385177E-07 -3.8697 12 K+ 0.1487513E-03 0.1518091E-03 0.5884689E+01 0.6171 13 Na+ 0.2147022E-01 0.2153278E-01 0.4907521E+03 2.7755 14 Mn++ 0.1972434E-08 0.2420635E-08 0.1318344E-03 0.0394 15 F- 0.7163154E-03 0.8377009E-03 0.1577697E+02 1.2978 16 HPO4-- 0.1357888E-09 0.4481110E-07 0.4263720E-02 -1.1176 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1910154E+00 0.1569578E+00 0.3405759E-01 0.0000000E+00 2 H2O 0.5145105E+02 0.5150071E+02 -.4966000E-01 0.0000000E+00 3 Cl- 0.1170183E-01 0.1170183E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9343967E-02 0.2530533E-02 0.6813434E-02 0.0000000E+00 5 HCO3- 0.1417203E+00 0.1417203E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3830929E-01 0.1786896E-01 0.2044034E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3185765E-09 0.4775033E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9475023E-03 0.1120552E-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 0.2327588E-12 0.3259204E-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- 0.7840960E-03 0.7793210E-03 0.4775033E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1082E-17 Mass of aqueous solution: 0.938427E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.9599900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2527E-03 0.7802E-06 quartz 0.1120E-01 -1.951 0.6731 -0.172 43.50 0.2542 sulfur 0.2725E-01 -1.565 0.8738 -0.059 56.47 0.4227 topaz 0.2388E-05 -5.622 0.4394E-03 -3.357 0.2840E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.547281 g Volume = 0.677026 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: 1.9599900 moles log = 0.2923 Original solution: 1000.0103000 g Original solution / Rock added: 510.21 (Water/Rock Ratio), log = 2.7078 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 18.0071 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6165E-01 0.9035 0.1003E+01 0.1110E+01 CO2,gas 0.9082E+00 0.9503 0.1554E+02 0.1635E+02 CH4,gas 0.2744E-07 1.0147 0.5014E-06 0.4942E-06 H2,gas 0.2328E-06 1.0096 0.4233E-05 0.4193E-05 H2S,gas 0.3013E-01 0.9332 0.5062E+00 0.5425E+00 S2,gas 0.2981E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.9767E-09 1.0000 0.1759E-07 0.1759E-07 SO3,gas 0.2418E-28 1.0000 0.4354E-27 0.4354E-27 SO2,gas 0.3994E-11 1.0000 0.7193E-10 0.7193E-10 HF,gas 0.1621E-07 1.0000 0.2919E-06 0.2919E-06 HCl,gas 0.5463E-11 1.0000 0.9838E-10 0.9838E-10 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 -0.30331E-11 214 topaz -16.55 -16.55 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 -1.698 0.28988E+04 0.001 2 CO2,gas -6.66 -7.17 -0.51 -0.169 0.86650E+03 1.191 3 CH4,gas 4.54 -3.46 -8.00 -2.000 0.13658E+05 -6.300 4 H2,gas 8.00 0.93 -7.07 -4.041 0.12076E+05 -5.373 5 H2S,gas -6.23 -8.22 -1.99 -0.997 0.34058E+04 -0.296 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.24 -9.45 -2.909 0.16142E+05 -7.755 8 SO3,gas 17.12 -11.94 -29.06 -7.265 0.49619E+05 -27.361 9 SO2,gas 0.83 -11.01 -11.84 -3.158 0.20220E+05 -10.143 10 HF,gas 0.47 -7.76 -8.23 -4.117 0.14059E+05 -6.535 11 HCl,gas 5.19 -6.52 -11.71 -5.853 0.19988E+05 -10.007 17 albite -0.38 -5.21 -4.83 -0.371 0.82445E+04 25 anhydrite -5.32 -9.94 -4.63 -2.313 0.78983E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 0.98 -1.89 -0.316 0.32326E+04 69 diamond -3.10 -5.31 -2.21 -0.631 0.37695E+04 86 gibbsite 4.08 0.98 -3.10 -0.443 0.52934E+04 89 graphite -3.55 -5.31 -1.76 -0.504 0.30117E+04 101 kaolinite -1.33 -4.02 -2.69 -0.244 0.45870E+04 119 microcline -2.49 -7.37 -4.88 -0.376 0.83397E+04 149 pyrophyllite -6.18 -10.00 -3.82 -0.239 0.65241E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 218 gypsum -4.96 -9.95 -4.99 -1.248 0.85203E+04 237 boehmite 4.41 0.98 -3.43 -0.571 0.58495E+04 240 fluorite -9.93 -13.52 -3.59 -1.197 0.61336E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.9599900 MOLES New total amount of reactant added: 1.9999900 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 = 14 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 1.9999900 Water: Moles liquid = 0.5168E+02 kg liquid = 0.9310E+00 Moles total = 0.5148E+02 kg total = 0.9275E+00 Activity = 0.9969 Stoichiometric ionic strength = .1103949E+00 Osmotic coef. = 0.8896 True ionic strength = .2419696E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1194E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.36857E-04 -4.4335 0.30508E-04 -4.5156 0.82774E+00 -0.0821 2 H2O 0.99692E+00 -0.0013 0.99692E+00 -0.0013 3 Cl- 0.12762E-01 -1.8941 0.10490E-01 -1.9792 0.82198E+00 -0.0851 4 SO4-- 0.25564E-02 -2.5924 0.12580E-02 -2.9003 0.49209E+00 -0.3080 5 HCO3- 0.27519E-02 -2.5604 0.22658E-02 -2.6448 0.82337E+00 -0.0844 6 HS- 0.23600E-03 -3.6271 0.19402E-03 -3.7121 0.82212E+00 -0.0851 7 Al+++ 0.12723E-11 -11.8954 0.26077E-12 -12.5837 0.20497E+00 -0.6883 8 H4SiO4 0.10183E-02 -2.9921 0.10183E-02 -2.9921 0.10000E+01 0.0000 9 Ca++ 0.17961E-06 -6.7457 0.87630E-07 -7.0573 0.48789E+00 -0.3117 10 Mg++ 0.84569E-10 -10.0728 0.41041E-10 -10.3868 0.48530E+00 -0.3140 11 Fe++ 0.26026E-12 -12.5846 0.12646E-12 -12.8980 0.48592E+00 -0.3134 12 K+ 0.14877E-03 -3.8275 0.12252E-03 -3.9118 0.82359E+00 -0.0843 13 Na+ 0.21454E-01 -1.6685 0.17631E-01 -1.7537 0.82180E+00 -0.0852 14 Mn++ 0.19815E-08 -8.7030 0.96376E-09 -9.0160 0.48639E+00 -0.3130 15 F- 0.72722E-03 -3.1383 0.59634E-03 -3.2245 0.82002E+00 -0.0862 16 HPO4-- 0.13139E-09 -9.8814 0.64666E-10 -10.1893 0.49217E+00 -0.3079 17 SiF6-2 0.25990E-15 -15.5852 0.12758E-15 -15.8942 0.49088E+00 -0.3090 18 HSiO3- 0.38035E-07 -7.4198 0.31264E-07 -7.5050 0.82198E+00 -0.0851 19 Ca(HSiO3)+ 0.75737E-13 -13.1207 0.62392E-13 -13.2049 0.82380E+00 -0.0842 20 Mg(HSiO3)+ 0.44145E-16 -16.3551 0.36366E-16 -16.4393 0.82380E+00 -0.0842 21 NaHSiO3,aq 0.89149E-08 -8.0499 0.89149E-08 -8.0499 0.10000E+01 0.0000 22 AlO+ 0.46127E-10 -10.3360 0.37999E-10 -10.4202 0.82380E+00 -0.0842 23 AlOH+2 0.11855E-10 -10.9261 0.57725E-11 -11.2386 0.48694E+00 -0.3125 24 HAlO2,aq 0.24729E-09 -9.6068 0.24729E-09 -9.6068 0.10000E+01 0.0000 25 AlO2- 0.21874E-10 -10.6601 0.17943E-10 -10.7461 0.82026E+00 -0.0860 26 CH4,aq 0.34852E-09 -9.4578 0.33842E-09 -9.4705 0.97102E+00 -0.0128 31 CO,aq 0.11959E-10 -10.9223 0.11959E-10 -10.9223 0.10000E+01 0.0000 32 CO2,aq 0.15258E+00 -0.8165 0.14816E+00 -0.8293 0.97102E+00 -0.0128 33 CO3-2 0.13216E-07 -7.8789 0.64872E-08 -8.1879 0.49088E+00 -0.3090 34 CaCO3,aq 0.71280E-11 -11.1470 0.71280E-11 -11.1470 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61523E-08 -8.2110 0.50683E-08 -8.2951 0.82380E+00 -0.0842 36 CaCl+ 0.18058E-08 -8.7433 0.14876E-08 -8.8275 0.82380E+00 -0.0842 37 CaCl2,aq 0.37072E-11 -11.4309 0.37072E-11 -11.4309 0.10000E+01 0.0000 38 CaF+ 0.92615E-09 -9.0333 0.76296E-09 -9.1175 0.82380E+00 -0.0842 39 CaOH+ 0.24773E-12 -12.6060 0.20408E-12 -12.6902 0.82380E+00 -0.0842 40 CaSO4,aq 0.35006E-07 -7.4559 0.35006E-07 -7.4559 0.10000E+01 0.0000 41 HCl,aq 0.58642E-07 -7.2318 0.58642E-07 -7.2318 0.10000E+01 0.0000 45 HF,aq 0.12454E-03 -3.9047 0.12454E-03 -3.9047 0.10000E+01 0.0000 46 HF2- 0.30506E-07 -7.5156 0.25076E-07 -7.6007 0.82198E+00 -0.0851 48 FeCl+ 0.25488E-14 -14.5937 0.20997E-14 -14.6778 0.82380E+00 -0.0842 51 FeF+ 0.46781E-14 -14.3299 0.38538E-14 -14.4141 0.82380E+00 -0.0842 54 FeOH+ 0.16329E-15 -15.7870 0.13452E-15 -15.8712 0.82380E+00 -0.0842 60 H2,aq 0.32988E-08 -8.4816 0.32032E-08 -8.4944 0.97102E+00 -0.0128 61 KCl,aq 0.23294E-07 -7.6328 0.23294E-07 -7.6328 0.10000E+01 0.0000 62 KHSO4,aq 0.13295E-10 -10.8763 0.13295E-10 -10.8763 0.10000E+01 0.0000 63 KOH,aq 0.17098E-11 -11.7670 0.17098E-11 -11.7670 0.10000E+01 0.0000 64 KSO4- 0.29098E-05 -5.5361 0.23918E-05 -5.6213 0.82198E+00 -0.0851 65 MgCO3,aq 0.83679E-15 -15.0774 0.83679E-15 -15.0774 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.29443E-11 -11.5310 0.24255E-11 -11.6152 0.82380E+00 -0.0842 67 MgCl+ 0.76652E-12 -12.1155 0.63146E-12 -12.1997 0.82380E+00 -0.0842 68 MgF+ 0.16068E-11 -11.7940 0.13237E-11 -11.8782 0.82380E+00 -0.0842 69 MgOH+ 0.64203E-15 -15.1924 0.52890E-15 -15.2766 0.82380E+00 -0.0842 71 MnF+ 0.11751E-10 -10.9299 0.96804E-11 -11.0141 0.82380E+00 -0.0842 72 MnO,aq 0.10691E-17 -17.9710 0.10691E-17 -17.9710 0.10000E+01 0.0000 73 MnOH+ 0.11560E-12 -12.9370 0.95232E-13 -13.0212 0.82380E+00 -0.0842 78 MnCl+ 0.75569E-10 -10.1217 0.62254E-10 -10.2058 0.82380E+00 -0.0842 79 MnSO4,aq 0.35001E-09 -9.4559 0.35001E-09 -9.4559 0.10000E+01 0.0000 80 NaCl,aq 0.61289E-04 -4.2126 0.61289E-04 -4.2126 0.10000E+01 0.0000 81 NaF,aq 0.24615E-05 -5.6088 0.24615E-05 -5.6088 0.10000E+01 0.0000 82 NaOH,aq 0.24753E-09 -9.6064 0.24753E-09 -9.6064 0.10000E+01 0.0000 84 OH- 0.23017E-07 -7.6379 0.18880E-07 -7.7240 0.82026E+00 -0.0860 91 H2PO3- 0.48192E-19 -19.3170 0.39613E-19 -19.4022 0.82198E+00 -0.0851 92 H3PO4,aq 0.42094E-09 -9.3758 0.42094E-09 -9.3758 0.10000E+01 0.0000 93 H2PO4- 0.44227E-07 -7.3543 0.36393E-07 -7.4390 0.82288E+00 -0.0847 94 PO4-3 0.79710E-17 -17.0985 0.17294E-17 -17.7621 0.21696E+00 -0.6636 96 H3P2O7- 0.11931E-17 -17.9233 0.98067E-18 -18.0085 0.82198E+00 -0.0851 97 H2P2O7-2 0.21222E-15 -15.6732 0.10417E-15 -15.9822 0.49088E+00 -0.3090 98 HP2O7-3 0.33224E-17 -17.4786 0.68182E-18 -18.1663 0.20522E+00 -0.6878 100 H2S,aq 0.18840E-01 -1.7249 0.18294E-01 -1.7377 0.97102E+00 -0.0128 101 S2-2 0.53049E-09 -9.2753 0.26041E-09 -9.5843 0.49088E+00 -0.3090 102 S3-2 0.40818E-08 -8.3891 0.20037E-08 -8.6982 0.49088E+00 -0.3090 103 S3- 0.88078E-06 -6.0551 0.72398E-06 -6.1403 0.82198E+00 -0.0851 104 S4-2 0.20747E-07 -7.6830 0.10184E-07 -7.9921 0.49088E+00 -0.3090 105 S5-2 0.70315E-07 -7.1530 0.34516E-07 -7.4620 0.49088E+00 -0.3090 106 SO2,aq 0.16853E-10 -10.7733 0.16853E-10 -10.7733 0.10000E+01 0.0000 107 SO3-2 0.10524E-11 -11.9778 0.52526E-12 -12.2796 0.49910E+00 -0.3018 108 HSO3- 0.12206E-08 -8.9134 0.10033E-08 -8.9986 0.82198E+00 -0.0851 109 HSO4- 0.44846E-04 -4.3483 0.36986E-04 -4.4320 0.82473E+00 -0.0837 111 S2O3-2 0.55243E-06 -6.2577 0.27117E-06 -6.5668 0.49088E+00 -0.3090 112 HS2O3- 0.17996E-08 -8.7448 0.14792E-08 -8.8300 0.82198E+00 -0.0851 113 H2S2O3,aq 0.72345E-12 -12.1406 0.72345E-12 -12.1406 0.10000E+01 0.0000 121 S4O6-2 0.92370E-14 -14.0345 0.45342E-14 -14.3435 0.49088E+00 -0.3090 Charge balance for all species = -.5916E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3685681E-04 0.1716323E+00 0.1714773E+03 0.0000 2 H2O 0.1000000E+01 0.5535566E+02 0.9885001E+06 0.0000 3 Cl- 0.1276158E-01 0.1282295E-01 0.4506238E+03 2.5364 4 SO4-- 0.2556444E-02 0.2605428E-02 0.2480859E+03 6.1309 5 HCO3- 0.2751879E-02 0.1553346E+00 0.9394931E+04 1.8708 6 HS- 0.2360036E-03 0.1907908E-01 0.6254477E+03 0.8034 7 Al+++ 0.1272256E-11 0.3284147E-09 0.8783383E-05 0.9630 8 H4SiO4 0.1018326E-02 0.1018373E-02 0.9702261E+02 -2.9921 9 Ca++ 0.1796108E-06 0.2235118E-06 0.8879318E-02 1.9738 10 Mg++ 0.8456882E-10 0.8988795E-10 0.2166184E-05 -1.3556 11 Fe++ 0.2602565E-12 0.2676468E-12 0.1481614E-07 -3.8669 12 K+ 0.1487677E-03 0.1517008E-03 0.5879766E+01 0.6038 13 Na+ 0.2145367E-01 0.2151743E-01 0.4903416E+03 2.7619 14 Mn++ 0.1981464E-08 0.2418908E-08 0.1317242E-03 0.0151 15 F- 0.7272225E-03 0.8542898E-03 0.1608741E+02 1.2911 16 HPO4-- 0.1313912E-09 0.4477915E-07 0.4260153E-02 -1.1581 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1953224E+00 0.1597850E+00 0.3553733E-01 0.0000000E+00 2 H2O 0.5148380E+02 0.5153464E+02 -.5084264E-01 0.0000000E+00 3 Cl- 0.1193783E-01 0.1193783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.9534967E-02 0.2425584E-02 0.7109383E-02 0.0000000E+00 5 HCO3- 0.1446123E+00 0.1446123E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.3909029E-01 0.1776211E-01 0.2132818E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3057453E-09 0.4775046E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9480779E-03 0.1120494E-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 0.2491720E-12 0.3259202E-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- 0.8000960E-03 0.7953210E-03 0.4775046E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.3449E-17 Mass of aqueous solution: 0.939213E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 1.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3259E-07 -7.487 0.3910E-05 -5.408 0.2467E-03 0.7802E-06 quartz 0.1120E-01 -1.951 0.6730 -0.172 42.46 0.2542 sulfur 0.2844E-01 -1.546 0.9117 -0.040 57.51 0.4411 topaz 0.2388E-05 -5.622 0.4394E-03 -3.357 0.2772E-01 0.1230E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity pyrite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 1.585199 g Volume = 0.695374 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: 1.9999900 moles log = 0.3010 Original solution: 1000.0103000 g Original solution / Rock added: 500.01 (Water/Rock Ratio), log = 2.6990 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 18.3486 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6060E-01 0.9019 0.1003E+01 0.1112E+01 CO2,gas 0.9100E+00 0.9494 0.1585E+02 0.1670E+02 CH4,gas 0.2675E-07 1.0149 0.4981E-06 0.4908E-06 H2,gas 0.2270E-06 1.0098 0.4205E-05 0.4165E-05 H2S,gas 0.2941E-01 0.9320 0.5029E+00 0.5396E+00 S2,gas 0.2925E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.9712E-09 1.0000 0.1782E-07 0.1782E-07 SO3,gas 0.2420E-28 1.0000 0.4441E-27 0.4441E-27 SO2,gas 0.3972E-11 1.0000 0.7288E-10 0.7288E-10 HF,gas 0.1667E-07 1.0000 0.3058E-06 0.3058E-06 HCl,gas 0.5639E-11 1.0000 0.1035E-09 0.1035E-09 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 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+00 172 sulfur -9.15 -9.15 0.00 0.000 0.00000E+00 214 topaz -16.55 -16.55 0.00 0.000 0.60662E-11 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 -1.698 0.28988E+04 0.001 2 CO2,gas -6.66 -7.16 -0.50 -0.166 0.85186E+03 1.200 3 CH4,gas 4.54 -3.46 -8.00 -2.000 0.13663E+05 -6.303 4 H2,gas 8.00 0.92 -7.08 -4.043 0.12081E+05 -5.376 5 H2S,gas -6.23 -8.23 -2.00 -0.999 0.34107E+04 -0.299 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -6.23 -9.45 -2.907 0.16132E+05 -7.749 8 SO3,gas 17.12 -11.93 -29.05 -7.263 0.49605E+05 -27.353 9 SO2,gas 0.83 -11.00 -11.84 -3.156 0.20210E+05 -10.137 10 HF,gas 0.47 -7.74 -8.21 -4.107 0.14024E+05 -6.515 11 HCl,gas 5.19 -6.49 -11.68 -5.842 0.19950E+05 -9.985 17 albite -0.38 -5.25 -4.86 -0.374 0.83021E+04 25 anhydrite -5.32 -9.96 -4.64 -2.320 0.79242E+04 57 coesite -2.38 -2.99 -0.61 -0.204 0.10473E+04 64 cristobalite -2.56 -2.99 -0.43 -0.143 0.73267E+03 68 diaspore 2.87 0.96 -1.91 -0.319 0.32670E+04 69 diamond -3.10 -5.31 -2.20 -0.630 0.37646E+04 86 gibbsite 4.08 0.96 -3.12 -0.446 0.53278E+04 89 graphite -3.55 -5.31 -1.76 -0.503 0.30068E+04 101 kaolinite -1.33 -4.06 -2.73 -0.248 0.46558E+04 119 microcline -2.49 -7.40 -4.92 -0.378 0.83968E+04 149 pyrophyllite -6.18 -10.04 -3.86 -0.241 0.65930E+04 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 237 boehmite 4.41 0.96 -3.45 -0.574 0.58839E+04 240 fluorite -9.93 -13.51 -3.58 -1.192 0.61053E+04 245 silica-amorphous -2.09 -2.99 -0.90 -0.299 0.15335E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0400000 MOLES Current total amount of reactant added: 1.9999900 MOLES New total amount of reactant added: 2.0399900 MOLES Mixing fraction reached given limit of 0.2000E+01 TOTMIX = 0.2040E+01 Execution stopped.