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. 0.41067E+00 0.38291E-02 0.8244 0.00000000E+00 H2O 2 0. 0.53121E+02 0.10000E+01 0.9942 0.00000000E+00 Cl- 3 -1. 0.23738E-01 0.24501E-01 0.8186 0.00000000E+00 SO4-- 4 -2. 0.19085E-01 0.16394E-06 0.4882 0.00000000E+00 HCO3- 5 -1. 0.28921E+00 0.51561E-04 0.8200 0.00000000E+00 HS- 6 -1. 0.78140E-01 0.25935E-05 0.8187 0.00000000E+00 Al+++ 7 3. 0.47754E-05 0.11405E-06 0.2020 0.00000000E+00 H4SiO4 8 0. 0.12153E-01 0.10129E-02 1.0000 0.00000000E+00 Ca++ 9 2. 0.20808E-06 0.21152E-06 0.4840 0.00000000E+00 Mg++ 10 2. 0.83683E-10 0.85090E-10 0.4814 0.00000000E+00 Fe++ 11 2. 0.32592E-07 0.24806E-08 0.4820 0.00000000E+00 K+ 12 1. 0.14123E-03 0.14646E-03 0.8202 0.00000000E+00 Na+ 13 1. 0.20032E-01 0.20668E-01 0.8184 0.00000000E+00 Mn++ 14 2. 0.22519E-08 0.21764E-08 0.4825 0.00000000E+00 F- 15 -1. 0.16001E-02 0.88733E-04 0.8166 0.00000000E+00 HPO4-- 16 -2. 0.41688E-07 0.62920E-12 0.4883 0.00000000E+00 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2374E-05 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 50.0000 SLIM = 0.800000E+01 TEMP = 100.0000 SINC = 0.2000E+00 TEMPC = 0.0000 TOTMIX = 0.399999E+01 ENTH = 0.0000 SENTH = 0.0000 DENTH = 0.0000 TOTWAT = 90.0000 SOLMIN = 0.0000E+00 RM = 0.0000 AQGRM = 1000.0103 SUPRNT = 0.1000E-19 VBOX-1 = 400.9996 RHOFRS = 0.0000 RHOROC = 2.5000 The following options were selected: CONFLG = 1 C = 3 IFRAC = 0 IPUNCH = 2 NLOOP = 400 ISTEP = 2 LIMSOL = 1 LOOC = 0 IENTH = 0 ITREF = 0 IDEAL = 0 IPSAT = 1 INCREM = 0 INCP = 0 MINSOL = 3 NEUT = 0 AWAT = 0 CHGF = 0 Of the derived species, only those with molality > 0.10E-19 will appear in the output Species No. Charge Log K(diss) Species No. Charge Log K(diss) SiF6-2 17 -2. -24.5019 Mn+3 70 3. 19.1453 HSiO3- 18 -1. 9.0298 MnF+ 71 1. -1.2264 Ca(HSiO3)+ 19 1. 7.6723 MnO,aq 72 0. 17.9848 Mg(HSiO3)+ 20 1. 7.5773 MnOH+ 73 1. 8.5194 NaHSiO3,aq 21 0. 7.8210 MnO2-2 74 -2. 40.4638 AlO+ 22 1. 6.8663 HMnO2- 75 -1. 29.1232 AlOH+2 23 2. 3.1691 MnO4- 76 -1. 83.3111 HAlO2,aq 24 0. 10.5671 MnO4-2 77 -2. 81.3005 AlO2- 25 -1. 16.2221 MnCl+ 78 1. -0.7894 CH4,aq 26 0. 6.0126 MnSO4,aq 79 0. -2.4604 C2H6,aq 27 0. 12.3733 NaCl,aq 80 0. 0.4796 C3H8,aq 28 0. 17.3707 NaF,aq 81 0. 0.6306 C4H10,aq 29 0. 22.3757 NaOH,aq 82 0. 12.3669 ethanol,aq 30 0. 15.3258 O2,aq 83 0. 53.5502 CO,aq 31 0. 4.6892 OH- 84 -1. 12.2382 CO2,aq 32 0. -6.3298 HO2- 85 -1. 50.8010 CO3-2 33 -2. 10.0588 H2O2,aq 86 0. 40.0166 CaCO3,aq 34 0. 5.9605 H3PO2,aq 87 0. 24.3066 Ca(HCO3)+ 35 1. -1.4070 H2PO2- 88 -1. 26.5366 CaCl+ 36 1. -0.2091 HPO3-2 89 -2. 11.9254 CaCl2,aq 37 0. 0.4151 H3PO3,aq 90 0. 3.5792 CaF+ 38 1. -1.1644 H2PO3- 91 -1. 5.6232 CaOH+ 39 1. 10.1471 H3PO4,aq 92 0. -9.8447 CaSO4,aq 40 0. -2.5018 H2PO4- 93 -1. -7.2659 HCl,aq 41 0. 0.7370 PO4-3 94 -3. 12.0884 HClO,aq 42 0. 32.4260 H4P2O7,aq 95 0. -17.8095 ClO- 43 -1. 39.6530 H3P2O7- 96 -1. -15.9156 HClO2,aq 44 0. 70.1812 H2P2O7-2 97 -2. -13.4262 HF,aq 45 0. -3.8354 HP2O7-3 98 -3. -6.7266 HF2- 46 -1. -3.3639 P2O7-4 99 -4. 2.8952 Fe+3 47 3. 8.3809 H2S,aq 100 0. -6.4900 FeCl+ 48 1. -0.1994 S2-2 101 -2. 1.2355 FeCl2,aq 49 0. 4.3001 S3-2 102 -2. -8.8031 FeCl+2 50 2. 6.5269 S3- 103 -1. -16.3389 FeF+ 51 1. -1.7084 S4-2 104 -2. -18.6615 FeF+2 52 2. 1.4309 S5-2 105 -2. -28.3439 FeO,aq 53 0. 16.4104 SO2,aq 106 0. -0.2309 FeOH+ 54 1. 7.4874 SO3-2 107 -2. 10.3052 HFeO2- 55 -1. 24.3908 HSO3- 108 -1. 2.5086 FeO+ 56 1. 11.4004 HSO4- 109 -1. -2.9839 FeOH+2 57 2. 9.1194 HSO5- 110 -1. 38.8366 FeO2- 58 -1. 24.0895 S2O3-2 111 -2. -4.5600 HFeO2,aq 59 0. 15.9850 HS2O3- 112 -1. -6.8123 H2,aq 60 0. 9.4190 H2S2O3,aq 113 0. -8.0173 KCl,aq 61 0. 1.7417 S2O4-2 114 -2. 10.5541 KHSO4,aq 62 0. -0.4514 HS2O4- 115 -1. 7.6551 KOH,aq 63 0. 12.3695 H2S2O4,aq 116 0. 6.6259 KSO4- 64 -1. -1.1908 S2O5-2 117 -2. 10.0741 MgCO3,aq 65 0. 6.5614 S2O6-2 118 -2. 11.5521 Mg(HCO3)+ 66 1. -1.4164 S2O8-2 119 -2. 42.0620 MgCl+ 67 1. -0.1664 S3O6-2 120 -2. 3.7866 MgF+ 68 1. -1.7331 S4O6-2 121 -2. -17.8657 MgOH+ 69 1. 9.4041 S5O6-2 122 -2. -14.1333 For mixed gases (JSOLS=6), log K(hydrol) = log (K*P) Log K Trial Log K Trial Mineral No. hydrol Moles Mineral No. hydrol Moles H2O,gas 1 1.696 0.0000E+00 osumilite(1) 126 21.717 0.0000E+00 CO2,gas 2 -6.660 0.0000E+00 osumilite(2) 127 20.667 0.0000E+00 CH4,gas 3 4.544 0.0000E+00 osumilite-Fe 128 14.390 0.0000E+00 H2,gas 4 8.000 0.0000E+00 pargasite 129 65.092 0.0000E+00 H2S,gas 5 -6.230 0.0000E+00 periclase 130 16.138 0.0000E+00 S2,gas 6 -7.335 0.0000E+00 periclase-Fe 131 11.627 0.0000E+00 CO,gas 7 3.215 0.0000E+00 perovskite-Al 132 12.344 0.0000E+00 SO3,gas 8 17.121 0.0000E+00 perovskite-Ca 133 23.807 0.0000E+00 SO2,gas 9 0.832 0.0000E+00 perovskite-Fe 134 21.143 0.0000E+00 HF,gas 10 0.473 0.0000E+00 perovskite-Mg 135 23.119 0.0000E+00 HCl,gas 11 5.189 0.0000E+00 phase_A 136 80.189 0.0000E+00 acmite 12 7.710 0.0000E+00 phlogopite-Na 137 29.647 0.0000E+00 akermanite 13 36.442 0.0000E+00 piemontite(ordered) 138 33.776 0.0000E+00 akimotoite 14 16.591 0.0000E+00 prehnite 139 19.372 0.0000E+00 akimotoite-Fe 15 13.067 0.0000E+00 prehnite-Fe 140 22.498 0.0000E+00 albite-high 16 0.693 0.0000E+00 pumpellyite-Fe 141 46.269 0.0000E+00 albite 17 -0.384 0.0000E+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 0.3015E-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 0.1117E-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 0.7634E-01 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 0.2328E-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: 3.9999900 moles log = 0.6021 Original solution: 1000.0103000 g Original solution / Rock added: 250.00 (Water/Rock Ratio), log = 2.3979 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 = 9 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 3.9999900 Water: Moles liquid = 0.5351E+02 kg liquid = 0.9640E+00 Moles total = 0.5312E+02 kg total = 0.9570E+00 Activity = 0.9942 Stoichiometric ionic strength = .1854501E+00 Osmotic coef. = 0.9169 True ionic strength = .2464496E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2374E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.38291E-02 -2.4169 0.31568E-02 -2.5008 0.82442E+00 -0.0839 2 H2O 0.99424E+00 -0.0025 0.99424E+00 -0.0025 3 Cl- 0.24501E-01 -1.6108 0.20056E-01 -1.6977 0.81860E+00 -0.0869 4 SO4-- 0.16394E-06 -6.7853 0.80036E-07 -7.0967 0.48821E+00 -0.3114 5 HCO3- 0.51561E-04 -4.2877 0.42280E-04 -4.3739 0.82001E+00 -0.0862 6 HS- 0.25935E-05 -5.5861 0.21234E-05 -5.6730 0.81874E+00 -0.0869 7 Al+++ 0.11405E-06 -6.9429 0.23040E-07 -7.6375 0.20202E+00 -0.6946 8 H4SiO4 0.10129E-02 -2.9945 0.10129E-02 -2.9945 0.10000E+01 0.0000 9 Ca++ 0.21152E-06 -6.6746 0.10237E-06 -6.9898 0.48399E+00 -0.3152 10 Mg++ 0.85090E-10 -10.0701 0.40961E-10 -10.3876 0.48139E+00 -0.3175 11 Fe++ 0.24806E-08 -8.6054 0.11957E-08 -8.9224 0.48201E+00 -0.3169 12 K+ 0.14646E-03 -3.8343 0.12013E-03 -3.9203 0.82023E+00 -0.0861 13 Na+ 0.20668E-01 -1.6847 0.16915E-01 -1.7717 0.81842E+00 -0.0870 14 Mn++ 0.21764E-08 -8.6623 0.10501E-08 -8.9788 0.48248E+00 -0.3165 15 F- 0.88733E-04 -4.0519 0.72462E-04 -4.1399 0.81663E+00 -0.0880 16 HPO4-- 0.62920E-12 -12.2012 0.30723E-12 -12.5125 0.48829E+00 -0.3113 17 SiF6-2 0.97193E-13 -13.0124 0.47333E-13 -13.3248 0.48700E+00 -0.3125 18 HSiO3- 0.36810E-09 -9.4340 0.30133E-09 -9.5210 0.81860E+00 -0.0869 19 Ca(HSiO3)+ 0.85628E-15 -15.0674 0.70253E-15 -15.1533 0.82044E+00 -0.0860 20 Mg(HSiO3)+ 0.42638E-18 -18.3702 0.34982E-18 -18.4562 0.82044E+00 -0.0860 21 NaHSiO3,aq 0.82436E-10 -10.0839 0.82436E-10 -10.0839 0.10000E+01 0.0000 22 AlO+ 0.38116E-09 -9.4189 0.31272E-09 -9.5048 0.82044E+00 -0.0860 23 AlOH+2 0.10177E-07 -7.9924 0.49156E-08 -8.3084 0.48303E+00 -0.3160 24 HAlO2,aq 0.19615E-10 -10.7074 0.19615E-10 -10.7074 0.10000E+01 0.0000 25 AlO2- 0.16837E-13 -13.7737 0.13754E-13 -13.8616 0.81687E+00 -0.0878 26 CH4,aq 0.11329E-08 -8.9458 0.10833E-08 -8.9652 0.95626E+00 -0.0194 27 C2H6,aq 0.57842E-19 -19.2378 0.55312E-19 -19.2572 0.95626E+00 -0.0194 31 CO,aq 0.26290E-10 -10.5802 0.26290E-10 -10.5802 0.10000E+01 0.0000 32 CO2,aq 0.29997E+00 -0.5229 0.28685E+00 -0.5424 0.95626E+00 -0.0194 33 CO3-2 0.24022E-11 -11.6194 0.11699E-11 -11.9319 0.48700E+00 -0.3125 34 CaCO3,aq 0.15017E-14 -14.8234 0.15017E-14 -14.8234 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.13467E-09 -9.8707 0.11049E-09 -9.9567 0.82044E+00 -0.0860 36 CaCl+ 0.40500E-08 -8.3925 0.33228E-08 -8.4785 0.82044E+00 -0.0860 37 CaCl2,aq 0.15833E-10 -10.8004 0.15833E-10 -10.8004 0.10000E+01 0.0000 38 CaF+ 0.13201E-09 -9.8794 0.10831E-09 -9.9653 0.82044E+00 -0.0860 39 CaOH+ 0.28009E-14 -14.5527 0.22980E-14 -14.6387 0.82044E+00 -0.0860 40 CaSO4,aq 0.26019E-11 -11.5847 0.26019E-11 -11.5847 0.10000E+01 0.0000 41 HCl,aq 0.11602E-04 -4.9355 0.11602E-04 -4.9355 0.10000E+01 0.0000 45 HF,aq 0.15659E-02 -2.8052 0.15659E-02 -2.8052 0.10000E+01 0.0000 46 HF2- 0.46800E-07 -7.3298 0.38311E-07 -7.4167 0.81860E+00 -0.0869 47 Fe+3 0.25100E-19 -19.6003 0.50892E-20 -20.2934 0.20276E+00 -0.6930 48 FeCl+ 0.46265E-10 -10.3347 0.37958E-10 -10.4207 0.82044E+00 -0.0860 49 FeCl2,aq 0.24103E-16 -16.6179 0.24103E-16 -16.6179 0.10000E+01 0.0000 50 FeCl+2 0.15098E-19 -19.8211 0.72929E-20 -20.1371 0.48303E+00 -0.3160 51 FeF+ 0.53965E-11 -11.2679 0.44275E-11 -11.3538 0.82044E+00 -0.0860 52 FeF+2 0.68043E-17 -17.1672 0.32867E-17 -17.4832 0.48303E+00 -0.3160 54 FeOH+ 0.14941E-13 -13.8256 0.12258E-13 -13.9116 0.82044E+00 -0.0860 56 FeO+ 0.59171E-18 -18.2279 0.48546E-18 -18.3138 0.82044E+00 -0.0860 57 FeOH+2 0.60589E-18 -18.2176 0.29266E-18 -18.5336 0.48303E+00 -0.3160 60 H2,aq 0.37934E-08 -8.4210 0.36274E-08 -8.4404 0.95626E+00 -0.0194 61 KCl,aq 0.43669E-07 -7.3598 0.43669E-07 -7.3598 0.10000E+01 0.0000 62 KHSO4,aq 0.85818E-13 -13.0664 0.85818E-13 -13.0664 0.10000E+01 0.0000 63 KOH,aq 0.16158E-13 -13.7916 0.16158E-13 -13.7916 0.10000E+01 0.0000 64 KSO4- 0.18226E-09 -9.7393 0.14920E-09 -9.8262 0.81860E+00 -0.0869 65 MgCO3,aq 0.15061E-18 -18.8221 0.15061E-18 -18.8221 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.55058E-13 -13.2592 0.45172E-13 -13.3451 0.82044E+00 -0.0860 67 MgCl+ 0.14687E-11 -11.8331 0.12050E-11 -11.9190 0.82044E+00 -0.0860 68 MgF+ 0.19566E-12 -12.7085 0.16053E-12 -12.7945 0.82044E+00 -0.0860 69 MgOH+ 0.62012E-17 -17.2075 0.50877E-17 -17.2935 0.82044E+00 -0.0860 71 MnF+ 0.15621E-11 -11.8063 0.12816E-11 -11.8922 0.82044E+00 -0.0860 73 MnOH+ 0.12189E-14 -14.9140 0.10001E-14 -15.0000 0.82044E+00 -0.0860 78 MnCl+ 0.15807E-09 -9.8011 0.12969E-09 -9.8871 0.82044E+00 -0.0860 79 MnSO4,aq 0.24263E-13 -13.6151 0.24263E-13 -13.6151 0.10000E+01 0.0000 80 NaCl,aq 0.11243E-03 -3.9491 0.11243E-03 -3.9491 0.10000E+01 0.0000 81 NaF,aq 0.28696E-06 -6.5422 0.28696E-06 -6.5422 0.10000E+01 0.0000 82 NaOH,aq 0.22889E-11 -11.6404 0.22889E-11 -11.6404 0.10000E+01 0.0000 84 OH- 0.22277E-09 -9.6521 0.18197E-09 -9.7400 0.81687E+00 -0.0878 91 H2PO3- 0.27013E-19 -19.5684 0.22113E-19 -19.6554 0.81860E+00 -0.0869 92 H3PO4,aq 0.21413E-07 -7.6693 0.21413E-07 -7.6693 0.10000E+01 0.0000 93 H2PO4- 0.21832E-07 -7.6609 0.17892E-07 -7.7474 0.81951E+00 -0.0864 95 H4P2O7,aq 0.60803E-17 -17.2161 0.60803E-17 -17.2161 0.10000E+01 0.0000 96 H3P2O7- 0.30040E-16 -16.5223 0.24591E-16 -16.6092 0.81860E+00 -0.0869 97 H2P2O7-2 0.51838E-16 -16.2853 0.25245E-16 -16.5978 0.48700E+00 -0.3125 100 H2S,aq 0.21664E-01 -1.6643 0.20717E-01 -1.6837 0.95626E+00 -0.0194 101 S2-2 0.56555E-13 -13.2475 0.27542E-13 -13.5600 0.48700E+00 -0.3125 102 S3-2 0.43516E-12 -12.3614 0.21192E-12 -12.6738 0.48700E+00 -0.3125 103 S3- 0.90955E-08 -8.0412 0.74456E-08 -8.1281 0.81860E+00 -0.0869 104 S4-2 0.22118E-11 -11.6553 0.10771E-11 -11.9677 0.48700E+00 -0.3125 105 S5-2 0.74962E-11 -11.1252 0.36506E-11 -11.4376 0.48700E+00 -0.3125 106 SO2,aq 0.13071E-10 -10.8837 0.13071E-10 -10.8837 0.10000E+01 0.0000 107 SO3-2 0.76617E-16 -16.1157 0.37946E-16 -16.4208 0.49527E+00 -0.3052 108 HSO3- 0.91622E-11 -11.0380 0.75002E-11 -11.1249 0.81860E+00 -0.0869 109 HSO4- 0.29644E-06 -6.5281 0.24349E-06 -6.6135 0.82139E+00 -0.0855 111 S2O3-2 0.40227E-10 -10.3955 0.19590E-10 -10.7080 0.48700E+00 -0.3125 112 HS2O3- 0.13508E-10 -10.8694 0.11057E-10 -10.9563 0.81860E+00 -0.0869 113 H2S2O3,aq 0.55959E-12 -12.2521 0.55959E-12 -12.2521 0.10000E+01 0.0000 121 S4O6-2 0.45943E-18 -18.3378 0.22374E-18 -18.6503 0.48700E+00 -0.3125 Charge balance for all species = -.5713E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3829086E-02 0.3270378E+00 0.3246250E+03 0.0000 2 H2O 0.1000000E+01 0.5520828E+02 0.9794789E+06 0.0000 3 Cl- 0.2450064E-01 0.2462472E-01 0.8597527E+03 0.8030 4 SO4-- 0.1639367E-06 0.4642355E-06 0.4391749E-01 -2.0952 5 HCO3- 0.5156076E-04 0.3000179E+00 0.1802805E+05 -1.8731 6 HS- 0.2593500E-05 0.2166707E-01 0.7056836E+03 -3.1722 7 Al+++ 0.1140475E-06 0.1246249E-06 0.3311465E-02 -0.1353 8 H4SiO4 0.1012854E-02 0.1012854E-02 0.9587144E+02 -2.9945 9 Ca++ 0.2115227E-06 0.2158579E-06 0.8519681E-02 -1.9883 10 Mg++ 0.8509042E-10 0.8680985E-10 0.2078447E-05 -5.3861 11 Fe++ 0.2480638E-08 0.2532315E-08 0.1392730E-03 -3.9209 12 K+ 0.1464621E-03 0.1465060E-03 0.5641618E+01 -1.4196 13 Na+ 0.2066787E-01 0.2078059E-01 0.4704813E+03 0.7290 14 Mn++ 0.2176416E-08 0.2336076E-08 0.1263889E-03 -3.9773 15 F- 0.8873332E-04 0.1655050E-02 0.3096479E+02 -1.6391 16 HPO4-- 0.6291999E-12 0.4324574E-07 0.4087605E-02 -7.5110 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.4106724E+00 0.3152591E+00 0.9541326E-01 0.0000000E+00 2 H2O 0.5312120E+02 0.5321989E+02 -.9868671E-01 0.0000000E+00 3 Cl- 0.2373783E-01 0.2373783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1908497E-01 0.4475155E-06 0.1908452E-01 0.0000000E+00 5 HCO3- 0.2892123E+00 0.2892123E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.7814029E-01 0.2088671E-01 0.5725359E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1201364E-06 0.4655216E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9763750E-03 0.1117665E-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 0.2441110E-08 0.3015116E-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- 0.1600096E-02 0.1595441E-02 0.4655216E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4544E-17 Mass of aqueous solution: 0.978860E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 3.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.3015E-07 -7.521 0.3618E-05 -5.442 0.1160E-03 0.7218E-06 quartz 0.1117E-01 -1.952 0.6714 -0.173 21.52 0.2535 sulfur 0.7634E-01 -1.117 2.447 0.389 78.46 1.184 topaz 0.2328E-05 -5.633 0.4284E-03 -3.368 0.1373E-01 0.1199E-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 = 3.119183 g Volume = 1.437687 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: 3.9999900 moles log = 0.6021 Original solution: 1000.0103000 g Original solution / Rock added: 250.00 (Water/Rock Ratio), log = 2.3979 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 35.8105 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3422E-01 0.8163 0.1000E+01 0.1225E+01 CO2,gas 0.9476E+00 0.9044 0.3069E+02 0.3393E+02 CH4,gas 0.4336E-07 1.0270 0.1595E-05 0.1553E-05 H2,gas 0.1305E-06 1.0193 0.4762E-05 0.4672E-05 H2S,gas 0.1821E-01 0.8732 0.5695E+00 0.6522E+00 S2,gas 0.1499E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1094E-08 1.0000 0.3918E-07 0.3918E-07 SO3,gas 0.8470E-29 1.0000 0.3033E-27 0.3033E-27 SO2,gas 0.1578E-11 1.0000 0.5652E-10 0.5652E-10 HF,gas 0.1074E-06 1.0000 0.3845E-05 0.3845E-05 HCl,gas 0.5717E-09 1.0000 0.2047E-07 0.2047E-07 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 -1.699 0.29008E+04 0.000 2 CO2,gas -6.66 -6.87 -0.21 -0.071 0.36195E+03 1.487 3 CH4,gas 4.54 -2.95 -7.50 -1.874 0.12800E+05 -5.797 4 H2,gas 8.00 0.98 -7.02 -4.012 0.11988E+05 -5.322 5 H2S,gas -6.23 -8.17 -1.94 -0.972 0.33184E+04 -0.245 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.89 -9.11 -2.802 0.15548E+05 -7.407 8 SO3,gas 17.12 -12.10 -29.22 -7.304 0.49887E+05 -27.518 9 SO2,gas 0.83 -11.11 -11.95 -3.186 0.20399E+05 -10.248 10 HF,gas 0.47 -6.64 -7.11 -3.557 0.12147E+05 -5.415 11 HCl,gas 5.19 -4.20 -9.39 -4.694 0.16029E+05 -7.689 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 -0.14 -3.01 -0.502 0.51463E+04 69 diamond -3.10 -4.91 -1.81 -0.516 0.30862E+04 86 gibbsite 4.08 -0.14 -4.22 -0.603 0.72091E+04 89 graphite -3.55 -4.91 -1.36 -0.390 0.23284E+04 101 kaolinite -1.33 -6.26 -4.93 -0.448 0.84164E+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 -0.14 -4.55 -0.758 0.77632E+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: 0.2000000 MOLES Current total amount of reactant added: 3.9999900 MOLES New total amount of reactant added: 4.1999900 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 = 9 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 4.1999900 Water: Moles liquid = 0.5369E+02 kg liquid = 0.9673E+00 Moles total = 0.5328E+02 kg total = 0.9599E+00 Activity = 0.9940 Stoichiometric ionic strength = .1935810E+00 Osmotic coef. = 0.9166 True ionic strength = .2574646E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2492E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.50047E-02 -2.3006 0.41129E-02 -2.3858 0.82181E+00 -0.0852 2 H2O 0.99397E+00 -0.0026 0.99397E+00 -0.0026 3 Cl- 0.25629E-01 -1.5913 0.20908E-01 -1.6797 0.81581E+00 -0.0884 4 SO4-- 0.85676E-07 -7.0671 0.41308E-07 -7.3840 0.48214E+00 -0.3168 5 HCO3- 0.41481E-04 -4.3822 0.33901E-04 -4.4698 0.81726E+00 -0.0876 6 HS- 0.20867E-05 -5.6805 0.17026E-05 -5.7689 0.81596E+00 -0.0883 7 Al+++ 0.24492E-06 -6.6110 0.48095E-07 -7.3179 0.19637E+00 -0.7069 8 H4SiO4 0.10123E-02 -2.9947 0.10123E-02 -2.9947 0.10000E+01 0.0000 9 Ca++ 0.21073E-06 -6.6763 0.10069E-06 -6.9970 0.47782E+00 -0.3207 10 Mg++ 0.84804E-10 -10.0716 0.40296E-10 -10.3947 0.47517E+00 -0.3232 11 Fe++ 0.40833E-08 -8.3890 0.19428E-08 -8.7116 0.47580E+00 -0.3226 12 K+ 0.14596E-03 -3.8358 0.11932E-03 -3.9233 0.81749E+00 -0.0875 13 Na+ 0.20594E-01 -1.6863 0.16797E-01 -1.7748 0.81562E+00 -0.0885 14 Mn++ 0.21646E-08 -8.6646 0.10309E-08 -8.9868 0.47628E+00 -0.3221 15 F- 0.72429E-04 -4.1401 0.58941E-04 -4.2296 0.81378E+00 -0.0895 16 HPO4-- 0.42317E-12 -12.3735 0.20406E-12 -12.6902 0.48222E+00 -0.3168 17 SiF6-2 0.82190E-13 -13.0852 0.39525E-13 -13.4031 0.48089E+00 -0.3179 18 HSiO3- 0.28342E-09 -9.5476 0.23121E-09 -9.6360 0.81581E+00 -0.0884 19 Ca(HSiO3)+ 0.64840E-15 -15.1882 0.53020E-15 -15.2756 0.81771E+00 -0.0874 20 Mg(HSiO3)+ 0.32293E-18 -18.4909 0.26406E-18 -18.5783 0.81771E+00 -0.0874 21 NaHSiO3,aq 0.62812E-10 -10.2020 0.62812E-10 -10.2020 0.10000E+01 0.0000 22 AlO+ 0.47017E-09 -9.3277 0.38446E-09 -9.4152 0.81771E+00 -0.0874 23 AlOH+2 0.16512E-07 -7.7822 0.78736E-08 -8.1038 0.47684E+00 -0.3216 24 HAlO2,aq 0.18503E-10 -10.7328 0.18503E-10 -10.7328 0.10000E+01 0.0000 25 AlO2- 0.12234E-13 -13.9124 0.99585E-14 -14.0018 0.81403E+00 -0.0894 26 CH4,aq 0.14129E-08 -8.8499 0.13492E-08 -8.8699 0.95486E+00 -0.0201 27 C2H6,aq 0.85996E-19 -19.0655 0.82114E-19 -19.0856 0.95486E+00 -0.0201 31 CO,aq 0.28707E-10 -10.5420 0.28707E-10 -10.5420 0.10000E+01 0.0000 32 CO2,aq 0.31391E+00 -0.5032 0.29974E+00 -0.5233 0.95486E+00 -0.0201 33 CO3-2 0.14971E-11 -11.8247 0.71995E-12 -12.1427 0.48089E+00 -0.3179 34 CaCO3,aq 0.90897E-15 -15.0414 0.90897E-15 -15.0414 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.10656E-09 -9.9724 0.87133E-10 -10.0598 0.81771E+00 -0.0874 36 CaCl+ 0.41665E-08 -8.3802 0.34070E-08 -8.4676 0.81771E+00 -0.0874 37 CaCl2,aq 0.16924E-10 -10.7715 0.16924E-10 -10.7715 0.10000E+01 0.0000 38 CaF+ 0.10597E-09 -9.9748 0.86649E-10 -10.0622 0.81771E+00 -0.0874 39 CaOH+ 0.21209E-14 -14.6735 0.17343E-14 -14.7609 0.81771E+00 -0.0874 40 CaSO4,aq 0.13208E-11 -11.8792 0.13208E-11 -11.8792 0.10000E+01 0.0000 41 HCl,aq 0.15758E-04 -4.8025 0.15758E-04 -4.8025 0.10000E+01 0.0000 45 HF,aq 0.16595E-02 -2.7800 0.16595E-02 -2.7800 0.10000E+01 0.0000 46 HF2- 0.40481E-07 -7.3927 0.33025E-07 -7.4812 0.81581E+00 -0.0884 47 Fe+3 0.53478E-19 -19.2718 0.10541E-19 -19.9771 0.19711E+00 -0.7053 48 FeCl+ 0.78631E-10 -10.1044 0.64297E-10 -10.1918 0.81771E+00 -0.0874 49 FeCl2,aq 0.42563E-16 -16.3710 0.42563E-16 -16.3710 0.10000E+01 0.0000 50 FeCl+2 0.33024E-19 -19.4812 0.15747E-19 -19.8028 0.47684E+00 -0.3216 51 FeF+ 0.71564E-11 -11.1453 0.58518E-11 -11.2327 0.81771E+00 -0.0874 52 FeF+2 0.11612E-16 -16.9351 0.55373E-17 -17.2567 0.47684E+00 -0.3216 54 FeOH+ 0.18691E-13 -13.7284 0.15284E-13 -13.8158 0.81771E+00 -0.0874 56 FeO+ 0.72420E-18 -18.1401 0.59218E-18 -18.2275 0.81771E+00 -0.0874 57 FeOH+2 0.97543E-18 -18.0108 0.46513E-18 -18.3324 0.47684E+00 -0.3216 60 H2,aq 0.39688E-08 -8.4013 0.37896E-08 -8.4214 0.95486E+00 -0.0201 61 KCl,aq 0.45218E-07 -7.3447 0.45218E-07 -7.3447 0.10000E+01 0.0000 62 KHSO4,aq 0.57318E-13 -13.2417 0.57318E-13 -13.2417 0.10000E+01 0.0000 63 KOH,aq 0.12315E-13 -13.9096 0.12315E-13 -13.9096 0.10000E+01 0.0000 64 KSO4- 0.93755E-10 -10.0280 0.76486E-10 -10.1164 0.81581E+00 -0.0884 65 MgCO3,aq 0.91180E-19 -19.0401 0.91180E-19 -19.0401 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.43574E-13 -13.3608 0.35631E-13 -13.4482 0.81771E+00 -0.0874 67 MgCl+ 0.15113E-11 -11.8207 0.12358E-11 -11.9081 0.81771E+00 -0.0874 68 MgF+ 0.15709E-12 -12.8039 0.12845E-12 -12.8913 0.81771E+00 -0.0874 69 MgOH+ 0.46967E-17 -17.3282 0.38405E-17 -17.4156 0.81771E+00 -0.0874 71 MnF+ 0.12517E-11 -11.9025 0.10235E-11 -11.9899 0.81771E+00 -0.0874 73 MnOH+ 0.92134E-15 -15.0356 0.75339E-15 -15.1230 0.81771E+00 -0.0874 78 MnCl+ 0.16233E-09 -9.7896 0.13274E-09 -9.8770 0.81771E+00 -0.0874 79 MnSO4,aq 0.12294E-13 -13.9103 0.12294E-13 -13.9103 0.10000E+01 0.0000 80 NaCl,aq 0.11639E-03 -3.9341 0.11639E-03 -3.9341 0.10000E+01 0.0000 81 NaF,aq 0.23178E-06 -6.6349 0.23178E-06 -6.6349 0.10000E+01 0.0000 82 NaOH,aq 0.17440E-11 -11.7584 0.17440E-11 -11.7584 0.10000E+01 0.0000 84 OH- 0.17153E-09 -9.7657 0.13963E-09 -9.8550 0.81403E+00 -0.0894 91 H2PO3- 0.24511E-19 -19.6106 0.19996E-19 -19.6990 0.81581E+00 -0.0884 92 H3PO4,aq 0.24143E-07 -7.6172 0.24143E-07 -7.6172 0.10000E+01 0.0000 93 H2PO4- 0.18956E-07 -7.7222 0.15483E-07 -7.8102 0.81675E+00 -0.0879 95 H4P2O7,aq 0.77311E-17 -17.1118 0.77311E-17 -17.1118 0.10000E+01 0.0000 96 H3P2O7- 0.29417E-16 -16.5314 0.23999E-16 -16.6198 0.81581E+00 -0.0884 97 H2P2O7-2 0.39322E-16 -16.4054 0.18910E-16 -16.7233 0.48089E+00 -0.3179 100 H2S,aq 0.22666E-01 -1.6446 0.21643E-01 -1.6647 0.95486E+00 -0.0201 101 S2-2 0.35248E-13 -13.4529 0.16950E-13 -13.7708 0.48089E+00 -0.3179 102 S3-2 0.27121E-12 -12.5667 0.13042E-12 -12.8846 0.48089E+00 -0.3179 103 S3- 0.71598E-08 -8.1451 0.58411E-08 -8.2335 0.81581E+00 -0.0884 104 S4-2 0.13785E-11 -11.8606 0.66291E-12 -12.1785 0.48089E+00 -0.3179 105 S5-2 0.46720E-11 -11.3305 0.22467E-11 -11.6485 0.48089E+00 -0.3179 106 SO2,aq 0.11970E-10 -10.9219 0.11970E-10 -10.9219 0.10000E+01 0.0000 107 SO3-2 0.41822E-16 -16.3786 0.20466E-16 -16.6890 0.48935E+00 -0.3104 108 HSO3- 0.64601E-11 -11.1898 0.52703E-11 -11.2782 0.81581E+00 -0.0884 109 HSO4- 0.19999E-06 -6.6990 0.16373E-06 -6.7859 0.81868E+00 -0.0869 111 S2O3-2 0.21971E-10 -10.6582 0.10566E-10 -10.9761 0.48089E+00 -0.3179 112 HS2O3- 0.95241E-11 -11.0212 0.77699E-11 -11.1096 0.81581E+00 -0.0884 113 H2S2O3,aq 0.51231E-12 -12.2905 0.51231E-12 -12.2905 0.10000E+01 0.0000 121 S4O6-2 0.21990E-18 -18.6578 0.10575E-18 -18.9757 0.48089E+00 -0.3179 Charge balance for all species = -.5694E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5004713E-02 0.3432552E+00 0.3404919E+03 0.0000 2 H2O 0.1000000E+01 0.5519434E+02 0.9785681E+06 0.0000 3 Cl- 0.2562898E-01 0.2576117E-01 0.8988217E+03 0.7062 4 SO4-- 0.8567596E-07 0.2878778E-06 0.2721529E-01 -2.6123 5 HCO3- 0.4148079E-04 0.3139501E+00 0.1885246E+05 -2.0839 6 HS- 0.2086666E-05 0.2266829E-01 0.7377925E+03 -3.3830 7 Al+++ 0.2449241E-06 0.2619248E-06 0.6955009E-02 -0.1604 8 H4SiO4 0.1012312E-02 0.1012312E-02 0.9575520E+02 -2.9947 9 Ca++ 0.2107288E-06 0.2151261E-06 0.8485044E-02 -2.2253 10 Mg++ 0.8480362E-10 0.8651554E-10 0.2069997E-05 -5.6230 11 Fe++ 0.4083315E-08 0.4169121E-08 0.2291392E-03 -3.9399 12 K+ 0.1459640E-03 0.1460093E-03 0.5618683E+01 -1.5374 13 Na+ 0.2059352E-01 0.2071014E-01 0.4685686E+03 0.6111 14 Mn++ 0.2164564E-08 0.2328156E-08 0.1258751E-03 -4.2151 15 F- 0.7242888E-04 0.1732284E-02 0.3238783E+02 -1.8437 16 HPO4-- 0.4231684E-12 0.4309913E-07 0.4070987E-02 -7.9185 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.4322074E+00 0.3320180E+00 0.1001894E+00 0.0000000E+00 2 H2O 0.5328494E+02 0.5338744E+02 -.1025019E+00 0.0000000E+00 3 Cl- 0.2491783E-01 0.2491783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2003997E-01 0.2784535E-06 0.2003969E-01 0.0000000E+00 5 HCO3- 0.3036723E+00 0.3036723E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.8204529E-01 0.2192620E-01 0.6011909E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2533501E-06 0.4522002E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9791720E-03 0.1117385E-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 0.4032637E-08 0.2855963E-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- 0.1680096E-02 0.1675574E-02 0.4522002E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.6101E-17 Mass of aqueous solution: 0.982855E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 4.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.2856E-07 -7.544 0.3427E-05 -5.465 0.1057E-03 0.6837E-06 quartz 0.1117E-01 -1.952 0.6712 -0.173 20.71 0.2535 sulfur 0.8016E-01 -1.096 2.570 0.410 79.28 1.243 topaz 0.2261E-05 -5.646 0.4161E-03 -3.381 0.1284E-01 0.1165E-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 = 3.241497 g Volume = 1.496881 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: 4.1999900 moles log = 0.6232 Original solution: 1000.0103000 g Original solution / Rock added: 238.10 (Water/Rock Ratio), log = 2.3768 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 37.5503 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3298E-01 0.8073 0.9999E+00 0.1239E+01 CO2,gas 0.9488E+00 0.9001 0.3207E+02 0.3563E+02 CH4,gas 0.5143E-07 1.0282 0.1986E-05 0.1931E-05 H2,gas 0.1299E-06 1.0202 0.4975E-05 0.4877E-05 H2S,gas 0.1826E-01 0.8676 0.5950E+00 0.6857E+00 S2,gas 0.1429E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1139E-08 1.0000 0.4278E-07 0.4278E-07 SO3,gas 0.7079E-29 1.0000 0.2658E-27 0.2658E-27 SO2,gas 0.1378E-11 1.0000 0.5176E-10 0.5176E-10 HF,gas 0.1085E-06 1.0000 0.4075E-05 0.4075E-05 HCl,gas 0.7405E-09 1.0000 0.2781E-07 0.2781E-07 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 -1.699 0.29010E+04 0.000 2 CO2,gas -6.66 -6.85 -0.19 -0.064 0.32935E+03 1.506 3 CH4,gas 4.54 -2.86 -7.40 -1.850 0.12637E+05 -5.702 4 H2,gas 8.00 1.00 -7.00 -4.001 0.11956E+05 -5.303 5 H2S,gas -6.23 -8.15 -1.92 -0.962 0.32860E+04 -0.226 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.85 -9.07 -2.790 0.15483E+05 -7.369 8 SO3,gas 17.12 -12.15 -29.27 -7.319 0.49985E+05 -27.575 9 SO2,gas 0.83 -11.15 -11.98 -3.196 0.20464E+05 -10.286 10 HF,gas 0.47 -6.62 -7.09 -3.544 0.12104E+05 -5.390 11 HCl,gas 5.19 -4.07 -9.25 -4.627 0.15802E+05 -7.556 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 -0.17 -3.04 -0.507 0.51895E+04 69 diamond -3.10 -4.85 -1.75 -0.500 0.29883E+04 86 gibbsite 4.08 -0.17 -4.25 -0.607 0.72526E+04 89 graphite -3.55 -4.85 -1.31 -0.373 0.22306E+04 101 kaolinite -1.33 -6.31 -4.98 -0.453 0.85031E+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 -0.17 -4.57 -0.762 0.78064E+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: 0.2000000 MOLES Current total amount of reactant added: 4.1999900 MOLES New total amount of reactant added: 4.3999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 4.3999900 Water: Moles liquid = 0.5387E+02 kg liquid = 0.9705E+00 Moles total = 0.5345E+02 kg total = 0.9629E+00 Activity = 0.9937 Stoichiometric ionic strength = .2016618E+00 Osmotic coef. = 0.9163 True ionic strength = .2685053E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2610E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.61819E-02 -2.2089 0.50646E-02 -2.2955 0.81928E+00 -0.0866 2 H2O 0.99371E+00 -0.0027 0.99371E+00 -0.0027 3 Cl- 0.26749E-01 -1.5727 0.21750E-01 -1.6625 0.81311E+00 -0.0899 4 SO4-- 0.50440E-07 -7.2972 0.24024E-07 -7.6193 0.47630E+00 -0.3221 5 HCO3- 0.35227E-04 -4.4531 0.28696E-04 -4.5422 0.81460E+00 -0.0891 6 HS- 0.17723E-05 -5.7515 0.14413E-05 -5.8412 0.81325E+00 -0.0898 7 Al+++ 0.44680E-06 -6.3499 0.85346E-07 -7.0688 0.19102E+00 -0.7189 8 H4SiO4 0.10118E-02 -2.9949 0.10118E-02 -2.9949 0.10000E+01 0.0000 9 Ca++ 0.20992E-06 -6.6779 0.99062E-07 -7.0041 0.47189E+00 -0.3262 10 Mg++ 0.84502E-10 -10.0731 0.39647E-10 -10.4018 0.46919E+00 -0.3287 11 Fe++ 0.60152E-08 -8.2207 0.28261E-08 -8.5488 0.46983E+00 -0.3281 12 K+ 0.14547E-03 -3.8372 0.11853E-03 -3.9262 0.81483E+00 -0.0889 13 Na+ 0.20520E-01 -1.6878 0.16681E-01 -1.7778 0.81291E+00 -0.0900 14 Mn++ 0.21528E-08 -8.6670 0.10125E-08 -8.9946 0.47032E+00 -0.3276 15 F- 0.62118E-04 -4.2068 0.50379E-04 -4.2978 0.81102E+00 -0.0910 16 HPO4-- 0.30651E-12 -12.5136 0.14602E-12 -12.8356 0.47638E+00 -0.3220 17 SiF6-2 0.74633E-13 -13.1271 0.35453E-13 -13.4503 0.47503E+00 -0.3233 18 HSiO3- 0.23086E-09 -9.6366 0.18772E-09 -9.7265 0.81311E+00 -0.0899 19 Ca(HSiO3)+ 0.51958E-15 -15.2843 0.42349E-15 -15.3732 0.81505E+00 -0.0888 20 Mg(HSiO3)+ 0.25880E-18 -18.5870 0.21094E-18 -18.6758 0.81505E+00 -0.0888 21 NaHSiO3,aq 0.50643E-10 -10.2955 0.50643E-10 -10.2955 0.10000E+01 0.0000 22 AlO+ 0.55187E-09 -9.2582 0.44980E-09 -9.3470 0.81505E+00 -0.0888 23 AlOH+2 0.24089E-07 -7.6182 0.11343E-07 -7.9453 0.47089E+00 -0.3271 24 HAlO2,aq 0.17575E-10 -10.7551 0.17575E-10 -10.7551 0.10000E+01 0.0000 25 AlO2- 0.94686E-14 -14.0237 0.76817E-14 -14.1145 0.81127E+00 -0.0908 26 CH4,aq 0.17428E-08 -8.7587 0.16618E-08 -8.7794 0.95350E+00 -0.0207 27 C2H6,aq 0.12534E-18 -18.9019 0.11951E-18 -18.9226 0.95350E+00 -0.0207 31 CO,aq 0.31209E-10 -10.5057 0.31209E-10 -10.5057 0.10000E+01 0.0000 32 CO2,aq 0.32775E+00 -0.4845 0.31251E+00 -0.5051 0.95350E+00 -0.0207 33 CO3-2 0.10418E-11 -11.9822 0.49490E-12 -12.3055 0.47503E+00 -0.3233 34 CaCO3,aq 0.61472E-15 -15.2113 0.61472E-15 -15.2113 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.89027E-10 -10.0505 0.72562E-10 -10.1393 0.81505E+00 -0.0888 36 CaCl+ 0.42780E-08 -8.3688 0.34868E-08 -8.4576 0.81505E+00 -0.0888 37 CaCl2,aq 0.18018E-10 -10.7443 0.18018E-10 -10.7443 0.10000E+01 0.0000 38 CaF+ 0.89397E-10 -10.0487 0.72863E-10 -10.1375 0.81505E+00 -0.0888 39 CaOH+ 0.16995E-14 -14.7697 0.13852E-14 -14.8585 0.81505E+00 -0.0888 40 CaSO4,aq 0.75573E-12 -12.1216 0.75573E-12 -12.1216 0.10000E+01 0.0000 41 HCl,aq 0.20186E-04 -4.6950 0.20186E-04 -4.6950 0.10000E+01 0.0000 45 HF,aq 0.17467E-02 -2.7578 0.17467E-02 -2.7578 0.10000E+01 0.0000 46 HF2- 0.36538E-07 -7.4373 0.29710E-07 -7.5271 0.81311E+00 -0.0899 47 Fe+3 0.96439E-19 -19.0157 0.18493E-19 -19.7330 0.19176E+00 -0.7172 48 FeCl+ 0.11937E-09 -9.9231 0.97295E-10 -10.0119 0.81505E+00 -0.0888 49 FeCl2,aq 0.66999E-16 -16.1739 0.66999E-16 -16.1739 0.10000E+01 0.0000 50 FeCl+2 0.61031E-19 -19.2144 0.28739E-19 -19.5415 0.47089E+00 -0.3271 51 FeF+ 0.89267E-11 -11.0493 0.72757E-11 -11.1381 0.81505E+00 -0.0888 52 FeF+2 0.17633E-16 -16.7537 0.83035E-17 -17.0807 0.47089E+00 -0.3271 54 FeOH+ 0.22145E-13 -13.6547 0.18050E-13 -13.7435 0.81505E+00 -0.0888 56 FeO+ 0.84041E-18 -18.0755 0.68498E-18 -18.1643 0.81505E+00 -0.0888 57 FeOH+2 0.14069E-17 -17.8517 0.66251E-18 -18.1788 0.47089E+00 -0.3271 60 H2,aq 0.41430E-08 -8.3827 0.39503E-08 -8.4034 0.95350E+00 -0.0207 61 KCl,aq 0.46726E-07 -7.3304 0.46726E-07 -7.3304 0.10000E+01 0.0000 62 KHSO4,aq 0.40778E-13 -13.3896 0.40778E-13 -13.3896 0.10000E+01 0.0000 63 KOH,aq 0.99320E-14 -14.0030 0.99320E-14 -14.0030 0.10000E+01 0.0000 64 KSO4- 0.54346E-10 -10.2648 0.44189E-10 -10.3547 0.81311E+00 -0.0899 65 MgCO3,aq 0.61669E-19 -19.2099 0.61669E-19 -19.2099 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.36409E-13 -13.4388 0.29675E-13 -13.5276 0.81505E+00 -0.0888 67 MgCl+ 0.15518E-11 -11.8092 0.12648E-11 -11.8980 0.81505E+00 -0.0888 68 MgF+ 0.13254E-12 -12.8777 0.10802E-12 -12.9665 0.81505E+00 -0.0888 69 MgOH+ 0.37639E-17 -17.4244 0.30678E-17 -17.5132 0.81505E+00 -0.0888 71 MnF+ 0.10541E-11 -11.9771 0.85918E-12 -12.0659 0.81505E+00 -0.0888 73 MnOH+ 0.73704E-15 -15.1325 0.60073E-15 -15.2213 0.81505E+00 -0.0888 78 MnCl+ 0.16639E-09 -9.7789 0.13561E-09 -9.8677 0.81505E+00 -0.0888 79 MnSO4,aq 0.70225E-14 -14.1535 0.70225E-14 -14.1535 0.10000E+01 0.0000 80 NaCl,aq 0.12023E-03 -3.9200 0.12023E-03 -3.9200 0.10000E+01 0.0000 81 NaF,aq 0.19674E-06 -6.7061 0.19674E-06 -6.7061 0.10000E+01 0.0000 82 NaOH,aq 0.14062E-11 -11.8520 0.14062E-11 -11.8520 0.10000E+01 0.0000 84 OH- 0.13973E-09 -9.8547 0.11336E-09 -9.9455 0.81127E+00 -0.0908 90 H3PO3,aq 0.10296E-19 -19.9873 0.10296E-19 -19.9873 0.10000E+01 0.0000 91 H2PO3- 0.22594E-19 -19.6460 0.18372E-19 -19.7359 0.81311E+00 -0.0899 92 H3PO4,aq 0.26195E-07 -7.5818 0.26195E-07 -7.5818 0.10000E+01 0.0000 93 H2PO4- 0.16758E-07 -7.7758 0.13642E-07 -7.8651 0.81407E+00 -0.0893 95 H4P2O7,aq 0.91041E-17 -17.0408 0.91041E-17 -17.0408 0.10000E+01 0.0000 96 H3P2O7- 0.28225E-16 -16.5494 0.22950E-16 -16.6392 0.81311E+00 -0.0899 97 H2P2O7-2 0.30914E-16 -16.5098 0.14685E-16 -16.8331 0.47503E+00 -0.3233 100 H2S,aq 0.23661E-01 -1.6260 0.22561E-01 -1.6466 0.95350E+00 -0.0207 101 S2-2 0.24530E-13 -13.6103 0.11653E-13 -13.9336 0.47503E+00 -0.3233 102 S3-2 0.18875E-12 -12.7241 0.89660E-13 -13.0474 0.47503E+00 -0.3233 103 S3- 0.59562E-08 -8.2250 0.48430E-08 -8.3149 0.81311E+00 -0.0899 104 S4-2 0.95934E-12 -12.0180 0.45572E-12 -12.3413 0.47503E+00 -0.3233 105 S5-2 0.32514E-11 -11.4879 0.15445E-11 -11.8112 0.47503E+00 -0.3233 106 SO2,aq 0.11010E-10 -10.9582 0.11010E-10 -10.9582 0.10000E+01 0.0000 107 SO3-2 0.25661E-16 -16.5907 0.12411E-16 -16.9062 0.48365E+00 -0.3155 108 HSO3- 0.48402E-11 -11.3151 0.39356E-11 -11.4050 0.81311E+00 -0.0899 109 HSO4- 0.14369E-06 -6.8426 0.11726E-06 -6.9308 0.81606E+00 -0.0883 111 S2O3-2 0.13488E-10 -10.8701 0.64072E-11 -11.1933 0.47503E+00 -0.3233 112 HS2O3- 0.71358E-11 -11.1466 0.58022E-11 -11.2364 0.81311E+00 -0.0899 113 H2S2O3,aq 0.47109E-12 -12.3269 0.47109E-12 -12.3269 0.10000E+01 0.0000 121 S4O6-2 0.11909E-18 -18.9241 0.56569E-19 -19.2474 0.47503E+00 -0.3233 Charge balance for all species = -.5675E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6181856E-02 0.3593632E+00 0.3562305E+03 0.0000 2 H2O 0.1000000E+01 0.5518050E+02 0.9776646E+06 0.0000 3 Cl- 0.2674947E-01 0.2688995E-01 0.9375743E+03 0.6329 4 SO4-- 0.5043992E-07 0.1951591E-06 0.1843748E-01 -3.0284 5 HCO3- 0.3522705E-04 0.3277883E+00 0.1967019E+05 -2.2467 6 HS- 0.1772291E-05 0.2366300E-01 0.7696495E+03 -3.5458 7 Al+++ 0.4467999E-06 0.4714585E-06 0.1251043E-01 -0.1825 8 H4SiO4 0.1011774E-02 0.1011774E-02 0.9563996E+02 -2.9949 9 Ca++ 0.2099240E-06 0.2143992E-06 0.8450688E-02 -2.4132 10 Mg++ 0.8450245E-10 0.8622323E-10 0.2061616E-05 -5.8109 11 Fe++ 0.6015237E-08 0.6143559E-08 0.3374292E-03 -3.9579 12 K+ 0.1454692E-03 0.1455160E-03 0.5595933E+01 -1.6307 13 Na+ 0.2051973E-01 0.2064017E-01 0.4666714E+03 0.5177 14 Mn++ 0.2152842E-08 0.2320290E-08 0.1253654E-03 -4.4037 15 F- 0.6211784E-04 0.1809070E-02 0.3380072E+02 -2.0023 16 HPO4-- 0.3065115E-12 0.4295351E-07 0.4054503E-02 -8.2447 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.4537424E+00 0.3487772E+00 0.1049652E+00 0.0000000E+00 2 H2O 0.5344868E+02 0.5355500E+02 -.1063169E+00 0.0000000E+00 3 Cl- 0.2609783E-01 0.2609783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2099497E-01 0.1894101E-06 0.2099478E-01 0.0000000E+00 5 HCO3- 0.3181323E+00 0.3181323E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.8595029E-01 0.2296593E-01 0.6298436E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4575704E-06 0.4317782E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9819695E-03 0.1117105E-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 0.5962582E-08 0.2662969E-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- 0.1760096E-02 0.1755778E-02 0.4317782E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1208E-16 Mass of aqueous solution: 0.986851E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 4.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.2663E-07 -7.575 0.3195E-05 -5.496 0.9498E-04 0.6375E-06 quartz 0.1117E-01 -1.952 0.6710 -0.173 19.95 0.2534 sulfur 0.8398E-01 -1.076 2.692 0.430 80.04 1.303 topaz 0.2159E-05 -5.666 0.3973E-03 -3.401 0.1181E-01 0.1112E-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 = 3.363797 g Volume = 1.556070 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: 4.3999900 moles log = 0.6435 Original solution: 1000.0103000 g Original solution / Rock added: 227.28 (Water/Rock Ratio), log = 2.3566 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 39.2913 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3187E-01 0.7983 0.9996E+00 0.1252E+01 CO2,gas 0.9498E+00 0.8959 0.3344E+02 0.3732E+02 CH4,gas 0.6047E-07 1.0295 0.2446E-05 0.2376E-05 H2,gas 0.1293E-06 1.0212 0.5186E-05 0.5079E-05 H2S,gas 0.1831E-01 0.8621 0.6202E+00 0.7194E+00 S2,gas 0.1366E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1184E-08 1.0000 0.4651E-07 0.4651E-07 SO3,gas 0.5968E-29 1.0000 0.2345E-27 0.2345E-27 SO2,gas 0.1212E-11 1.0000 0.4761E-10 0.4761E-10 HF,gas 0.1092E-06 1.0000 0.4289E-05 0.4289E-05 HCl,gas 0.9065E-09 1.0000 0.3562E-07 0.3562E-07 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 -1.699 0.29012E+04 0.000 2 CO2,gas -6.66 -6.83 -0.17 -0.058 0.29840E+03 1.524 3 CH4,gas 4.54 -2.77 -7.31 -1.828 0.12482E+05 -5.612 4 H2,gas 8.00 1.02 -6.98 -3.991 0.11925E+05 -5.285 5 H2S,gas -6.23 -8.14 -1.91 -0.953 0.32552E+04 -0.207 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.82 -9.03 -2.779 0.15421E+05 -7.332 8 SO3,gas 17.12 -12.21 -29.33 -7.332 0.50078E+05 -27.630 9 SO2,gas 0.83 -11.19 -12.02 -3.206 0.20526E+05 -10.322 10 HF,gas 0.47 -6.59 -7.07 -3.533 0.12066E+05 -5.368 11 HCl,gas 5.19 -3.96 -9.15 -4.574 0.15619E+05 -7.448 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 -0.19 -3.06 -0.510 0.52277E+04 69 diamond -3.10 -4.80 -1.70 -0.484 0.28954E+04 86 gibbsite 4.08 -0.19 -4.27 -0.610 0.72909E+04 89 graphite -3.55 -4.80 -1.25 -0.358 0.21376E+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 -0.19 -4.59 -0.766 0.78446E+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: 0.2000000 MOLES Current total amount of reactant added: 4.3999900 MOLES New total amount of reactant added: 4.5999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 4.5999900 Water: Moles liquid = 0.5406E+02 kg liquid = 0.9738E+00 Moles total = 0.5361E+02 kg total = 0.9658E+00 Activity = 0.9934 Stoichiometric ionic strength = .2096926E+00 Osmotic coef. = 0.9160 True ionic strength = .2795251E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2728E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.73558E-02 -2.1334 0.60084E-02 -2.2212 0.81682E+00 -0.0879 2 H2O 0.99345E+00 -0.0029 0.99345E+00 -0.0029 3 Cl- 0.27862E-01 -1.5550 0.22582E-01 -1.6462 0.81048E+00 -0.0913 4 SO4-- 0.32175E-07 -7.4925 0.15145E-07 -7.8197 0.47070E+00 -0.3273 5 HCO3- 0.30987E-04 -4.5088 0.25162E-04 -4.5993 0.81202E+00 -0.0904 6 HS- 0.15592E-05 -5.8071 0.12639E-05 -5.8983 0.81064E+00 -0.0912 7 Al+++ 0.73153E-06 -6.1358 0.13604E-06 -6.8663 0.18597E+00 -0.7306 8 H4SiO4 0.10112E-02 -2.9951 0.10112E-02 -2.9951 0.10000E+01 0.0000 9 Ca++ 0.20912E-06 -6.6796 0.97492E-07 -7.0110 0.46621E+00 -0.3314 10 Mg++ 0.84195E-10 -10.0747 0.39020E-10 -10.4087 0.46345E+00 -0.3340 11 Fe++ 0.82381E-08 -8.0842 0.38234E-08 -8.4176 0.46411E+00 -0.3334 12 K+ 0.14498E-03 -3.8387 0.11776E-03 -3.9290 0.81226E+00 -0.0903 13 Na+ 0.20447E-01 -1.6894 0.16567E-01 -1.7807 0.81028E+00 -0.0914 14 Mn++ 0.21413E-08 -8.6693 0.99485E-09 -9.0022 0.46461E+00 -0.3329 15 F- 0.55044E-04 -4.2593 0.44494E-04 -4.3517 0.80834E+00 -0.0924 16 HPO4-- 0.23371E-12 -12.6313 0.11003E-12 -12.9585 0.47078E+00 -0.3272 17 SiF6-2 0.71045E-13 -13.1485 0.33349E-13 -13.4769 0.46941E+00 -0.3284 18 HSiO3- 0.19518E-09 -9.7096 0.15819E-09 -9.8008 0.81048E+00 -0.0913 19 Ca(HSiO3)+ 0.43228E-15 -15.3642 0.35122E-15 -15.4544 0.81248E+00 -0.0902 20 Mg(HSiO3)+ 0.21532E-18 -18.6669 0.17494E-18 -18.7571 0.81248E+00 -0.0902 21 NaHSiO3,aq 0.42387E-10 -10.3728 0.42387E-10 -10.3728 0.10000E+01 0.0000 22 AlO+ 0.62683E-09 -9.2029 0.50929E-09 -9.2930 0.81248E+00 -0.0902 23 AlOH+2 0.32754E-07 -7.4847 0.15237E-07 -7.8171 0.46519E+00 -0.3324 24 HAlO2,aq 0.16770E-10 -10.7755 0.16770E-10 -10.7755 0.10000E+01 0.0000 25 AlO2- 0.76405E-14 -14.1169 0.61781E-14 -14.2091 0.80860E+00 -0.0923 26 CH4,aq 0.21282E-08 -8.6720 0.20265E-08 -8.6933 0.95218E+00 -0.0213 27 C2H6,aq 0.17941E-18 -18.7462 0.17083E-18 -18.7674 0.95218E+00 -0.0213 31 CO,aq 0.33791E-10 -10.4712 0.33791E-10 -10.4712 0.10000E+01 0.0000 32 CO2,aq 0.34150E+00 -0.4666 0.32517E+00 -0.4879 0.95218E+00 -0.0213 33 CO3-2 0.77924E-12 -12.1083 0.36578E-12 -12.4368 0.46941E+00 -0.3284 34 CaCO3,aq 0.44715E-15 -15.3495 0.44715E-15 -15.3495 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.77069E-10 -10.1131 0.62617E-10 -10.2033 0.81248E+00 -0.0902 36 CaCl+ 0.43851E-08 -8.3580 0.35628E-08 -8.4482 0.81248E+00 -0.0902 37 CaCl2,aq 0.19114E-10 -10.7186 0.19114E-10 -10.7186 0.10000E+01 0.0000 38 CaF+ 0.77950E-10 -10.1082 0.63333E-10 -10.1984 0.81248E+00 -0.0902 39 CaOH+ 0.14140E-14 -14.8496 0.11488E-14 -14.9397 0.81248E+00 -0.0902 40 CaSO4,aq 0.46885E-12 -12.3290 0.46885E-12 -12.3290 0.10000E+01 0.0000 41 HCl,aq 0.24863E-04 -4.6044 0.24863E-04 -4.6044 0.10000E+01 0.0000 45 HF,aq 0.18301E-02 -2.7375 0.18301E-02 -2.7375 0.10000E+01 0.0000 46 HF2- 0.33922E-07 -7.4695 0.27493E-07 -7.5608 0.81048E+00 -0.0913 47 Fe+3 0.15585E-18 -18.8073 0.29100E-19 -19.5361 0.18671E+00 -0.7288 48 FeCl+ 0.16820E-09 -9.7742 0.13666E-09 -9.8644 0.81248E+00 -0.0902 49 FeCl2,aq 0.97705E-16 -16.0101 0.97705E-16 -16.0101 0.10000E+01 0.0000 50 FeCl+2 0.10093E-18 -18.9960 0.46952E-19 -19.3283 0.46519E+00 -0.3324 51 FeF+ 0.10700E-10 -10.9706 0.86933E-11 -11.0608 0.81248E+00 -0.0902 52 FeF+2 0.24807E-16 -16.6054 0.11540E-16 -16.9378 0.46519E+00 -0.3324 54 FeOH+ 0.25327E-13 -13.5964 0.20578E-13 -13.6866 0.81248E+00 -0.0902 56 FeO+ 0.94233E-18 -18.0258 0.76563E-18 -18.1160 0.81248E+00 -0.0902 57 FeOH+2 0.18885E-17 -17.7239 0.87851E-18 -18.0563 0.46519E+00 -0.3324 60 H2,aq 0.43160E-08 -8.3649 0.41096E-08 -8.3862 0.95218E+00 -0.0213 61 KCl,aq 0.48196E-07 -7.3170 0.48196E-07 -7.3170 0.10000E+01 0.0000 62 KHSO4,aq 0.30297E-13 -13.5186 0.30297E-13 -13.5186 0.10000E+01 0.0000 63 KOH,aq 0.83151E-14 -14.0801 0.83151E-14 -14.0801 0.10000E+01 0.0000 64 KSO4- 0.34145E-10 -10.4667 0.27674E-10 -10.5579 0.81048E+00 -0.0913 65 MgCO3,aq 0.44859E-19 -19.3481 0.44859E-19 -19.3481 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.31519E-13 -13.5014 0.25609E-13 -13.5916 0.81248E+00 -0.0902 67 MgCl+ 0.15907E-11 -11.7984 0.12924E-11 -11.8886 0.81248E+00 -0.0902 68 MgF+ 0.11557E-12 -12.9372 0.93899E-13 -13.0273 0.81248E+00 -0.0902 69 MgOH+ 0.31316E-17 -17.5042 0.25444E-17 -17.5944 0.81248E+00 -0.0902 71 MnF+ 0.91766E-12 -12.0373 0.74559E-12 -12.1275 0.81248E+00 -0.0902 73 MnOH+ 0.61220E-15 -15.2131 0.49740E-15 -15.3033 0.81248E+00 -0.0902 78 MnCl+ 0.17027E-09 -9.7689 0.13834E-09 -9.8590 0.81248E+00 -0.0902 79 MnSO4,aq 0.43496E-14 -14.3615 0.43496E-14 -14.3615 0.10000E+01 0.0000 80 NaCl,aq 0.12399E-03 -3.9066 0.12399E-03 -3.9066 0.10000E+01 0.0000 81 NaF,aq 0.17258E-06 -6.7630 0.17258E-06 -6.7630 0.10000E+01 0.0000 82 NaOH,aq 0.11769E-11 -11.9292 0.11769E-11 -11.9292 0.10000E+01 0.0000 84 OH- 0.11814E-09 -9.9276 0.95530E-10 -10.0199 0.80860E+00 -0.0923 90 H3PO3,aq 0.11363E-19 -19.9445 0.11363E-19 -19.9445 0.10000E+01 0.0000 91 H2PO3- 0.21086E-19 -19.6760 0.17090E-19 -19.7673 0.81048E+00 -0.0913 92 H3PO4,aq 0.27780E-07 -7.5563 0.27780E-07 -7.5563 0.10000E+01 0.0000 93 H2PO4- 0.15028E-07 -7.8231 0.12195E-07 -7.9138 0.81148E+00 -0.0907 95 H4P2O7,aq 0.10242E-16 -16.9896 0.10242E-16 -16.9896 0.10000E+01 0.0000 96 H3P2O7- 0.26852E-16 -16.5710 0.21763E-16 -16.6623 0.81048E+00 -0.0913 97 H2P2O7-2 0.25006E-16 -16.6020 0.11738E-16 -16.9304 0.46941E+00 -0.3284 100 H2S,aq 0.24650E-01 -1.6082 0.23471E-01 -1.6295 0.95218E+00 -0.0213 101 S2-2 0.18349E-13 -13.7364 0.86133E-14 -14.0648 0.46941E+00 -0.3284 102 S3-2 0.14119E-12 -12.8502 0.66274E-13 -13.1787 0.46941E+00 -0.3284 103 S3- 0.51374E-08 -8.2893 0.41638E-08 -8.3805 0.81048E+00 -0.0913 104 S4-2 0.71761E-12 -12.1441 0.33685E-12 -12.4726 0.46941E+00 -0.3284 105 S5-2 0.24321E-11 -11.6140 0.11417E-11 -11.9425 0.46941E+00 -0.3284 106 SO2,aq 0.10167E-10 -10.9928 0.10167E-10 -10.9928 0.10000E+01 0.0000 107 SO3-2 0.17025E-16 -16.7689 0.81412E-17 -17.0893 0.47819E+00 -0.3204 108 HSO3- 0.37789E-11 -11.4226 0.30628E-11 -11.5139 0.81048E+00 -0.0913 109 HSO4- 0.10780E-06 -6.9674 0.87693E-07 -7.0570 0.81352E+00 -0.0896 111 S2O3-2 0.89538E-11 -11.0480 0.42030E-11 -11.3764 0.46941E+00 -0.3284 112 HS2O3- 0.55712E-11 -11.2541 0.45154E-11 -11.3453 0.81048E+00 -0.0913 113 H2S2O3,aq 0.43493E-12 -12.3616 0.43493E-12 -12.3616 0.10000E+01 0.0000 121 S4O6-2 0.70155E-19 -19.1539 0.32932E-19 -19.4824 0.46941E+00 -0.3284 Charge balance for all species = -.5656E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7355842E-02 0.3753628E+00 0.3718422E+03 0.0000 2 H2O 0.1000000E+01 0.5516675E+02 0.9767684E+06 0.0000 3 Cl- 0.2786222E-01 0.2801112E-01 0.9760144E+03 0.5750 4 SO4-- 0.3217467E-07 0.1400280E-06 0.1322018E-01 -3.3773 5 HCO3- 0.3098658E-04 0.3415333E+00 0.2048132E+05 -2.3780 6 HS- 0.1559173E-05 0.2465111E-01 0.8012531E+03 -3.6770 7 Al+++ 0.7315289E-06 0.7649267E-06 0.2028424E-01 -0.2026 8 H4SiO4 0.1011240E-02 0.1011241E-02 0.9552569E+02 -2.9951 9 Ca++ 0.2091176E-06 0.2136773E-06 0.8416609E-02 -2.5686 10 Mg++ 0.8419509E-10 0.8593289E-10 0.2053302E-05 -5.9662 11 Fe++ 0.8238097E-08 0.8417022E-08 0.4619884E-03 -3.9751 12 K+ 0.1449778E-03 0.1450260E-03 0.5573366E+01 -1.7078 13 Na+ 0.2044651E-01 0.2057066E-01 0.4647894E+03 0.4405 14 Mn++ 0.2141284E-08 0.2312477E-08 0.1248599E-03 -4.5598 15 F- 0.5504404E-04 0.1885424E-02 0.3520380E+02 -2.1305 16 HPO4-- 0.2337064E-12 0.4280887E-07 0.4038153E-02 -8.5160 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.4752774E+00 0.3655363E+00 0.1097411E+00 0.0000000E+00 2 H2O 0.5361242E+02 0.5372255E+02 -.1101318E+00 0.0000000E+00 3 Cl- 0.2727783E-01 0.2727783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2194997E-01 0.1363623E-06 0.2194983E-01 0.0000000E+00 5 HCO3- 0.3325923E+00 0.3325923E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.8985529E-01 0.2400578E-01 0.6584952E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.7449019E-06 0.4030450E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9847675E-03 0.1116825E-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 0.8196675E-08 0.2439560E-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- 0.1840096E-02 0.1836066E-02 0.4030450E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.9735E-17 Mass of aqueous solution: 0.990847E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 4.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.2440E-07 -7.613 0.2927E-05 -5.534 0.8396E-04 0.5840E-06 quartz 0.1117E-01 -1.952 0.6709 -0.173 19.24 0.2533 sulfur 0.8780E-01 -1.057 2.815 0.449 80.75 1.362 topaz 0.2015E-05 -5.696 0.3709E-03 -3.431 0.1064E-01 0.1038E-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 = 3.486087 g Volume = 1.615256 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: 4.5999900 moles log = 0.6628 Original solution: 1000.0103000 g Original solution / Rock added: 217.39 (Water/Rock Ratio), log = 2.3372 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 41.0338 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.3086E-01 0.7892 0.9994E+00 0.1266E+01 CO2,gas 0.9508E+00 0.8917 0.3479E+02 0.3901E+02 CH4,gas 0.7052E-07 1.0308 0.2983E-05 0.2894E-05 H2,gas 0.1286E-06 1.0221 0.5395E-05 0.5279E-05 H2S,gas 0.1835E-01 0.8567 0.6452E+00 0.7532E+00 S2,gas 0.1308E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1227E-08 1.0000 0.5036E-07 0.5036E-07 SO3,gas 0.5071E-29 1.0000 0.2081E-27 0.2081E-27 SO2,gas 0.1071E-11 1.0000 0.4397E-10 0.4397E-10 HF,gas 0.1095E-06 1.0000 0.4494E-05 0.4494E-05 HCl,gas 0.1069E-08 1.0000 0.4387E-07 0.4387E-07 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 -1.699 0.29014E+04 0.000 2 CO2,gas -6.66 -6.82 -0.16 -0.053 0.26896E+03 1.541 3 CH4,gas 4.54 -2.68 -7.22 -1.806 0.12335E+05 -5.525 4 H2,gas 8.00 1.03 -6.97 -3.981 0.11896E+05 -5.268 5 H2S,gas -6.23 -8.12 -1.89 -0.945 0.32259E+04 -0.190 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.78 -9.00 -2.768 0.15362E+05 -7.298 8 SO3,gas 17.12 -12.26 -29.38 -7.345 0.50167E+05 -27.682 9 SO2,gas 0.83 -11.22 -12.06 -3.215 0.20585E+05 -10.357 10 HF,gas 0.47 -6.57 -7.05 -3.523 0.12031E+05 -5.347 11 HCl,gas 5.19 -3.87 -9.06 -4.528 0.15464E+05 -7.358 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 -0.21 -3.08 -0.514 0.52625E+04 69 diamond -3.10 -4.75 -1.64 -0.470 0.28069E+04 86 gibbsite 4.08 -0.21 -4.29 -0.613 0.73259E+04 89 graphite -3.55 -4.75 -1.20 -0.343 0.20492E+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 -0.21 -4.61 -0.769 0.78794E+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: 0.2000000 MOLES Current total amount of reactant added: 4.5999900 MOLES New total amount of reactant added: 4.7999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 4.7999900 Water: Moles liquid = 0.5424E+02 kg liquid = 0.9771E+00 Moles total = 0.5378E+02 kg total = 0.9688E+00 Activity = 0.9932 Stoichiometric ionic strength = .2176741E+00 Osmotic coef. = 0.9157 True ionic strength = .2905033E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2846E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.85245E-02 -2.0693 0.69428E-02 -2.1585 0.81445E+00 -0.0891 2 H2O 0.99319E+00 -0.0030 0.99319E+00 -0.0030 3 Cl- 0.28967E-01 -1.5381 0.23404E-01 -1.6307 0.80795E+00 -0.0926 4 SO4-- 0.21745E-07 -7.6626 0.10119E-07 -7.9949 0.46533E+00 -0.3322 5 HCO3- 0.27930E-04 -4.5539 0.22610E-04 -4.6457 0.80952E+00 -0.0918 6 HS- 0.14056E-05 -5.8521 0.11359E-05 -5.9447 0.80811E+00 -0.0925 7 Al+++ 0.11095E-05 -5.9549 0.20104E-06 -6.6967 0.18120E+00 -0.7419 8 H4SiO4 0.10107E-02 -2.9954 0.10107E-02 -2.9954 0.10000E+01 0.0000 9 Ca++ 0.20831E-06 -6.6813 0.95983E-07 -7.0178 0.46076E+00 -0.3365 10 Mg++ 0.83885E-10 -10.0763 0.38416E-10 -10.4155 0.45796E+00 -0.3392 11 Fe++ 0.10719E-07 -7.9698 0.49161E-08 -8.3084 0.45862E+00 -0.3385 12 K+ 0.14449E-03 -3.8402 0.11700E-03 -3.9318 0.80977E+00 -0.0916 13 Na+ 0.20374E-01 -1.6909 0.16457E-01 -1.7837 0.80774E+00 -0.0927 14 Mn++ 0.21299E-08 -8.6716 0.97790E-09 -9.0097 0.45913E+00 -0.3381 15 F- 0.49907E-04 -4.3018 0.40212E-04 -4.3956 0.80575E+00 -0.0938 16 HPO4-- 0.18502E-12 -12.7328 0.86114E-13 -13.0649 0.46542E+00 -0.3322 17 SiF6-2 0.69856E-13 -13.1558 0.32414E-13 -13.4893 0.46402E+00 -0.3335 18 HSiO3- 0.16940E-09 -9.7711 0.13686E-09 -9.8637 0.80795E+00 -0.0926 19 Ca(HSiO3)+ 0.36934E-15 -15.4326 0.29917E-15 -15.5241 0.81000E+00 -0.0915 20 Mg(HSiO3)+ 0.18397E-18 -18.7353 0.14902E-18 -18.8268 0.81000E+00 -0.0915 21 NaHSiO3,aq 0.36428E-10 -10.4386 0.36428E-10 -10.4386 0.10000E+01 0.0000 22 AlO+ 0.69570E-09 -9.1576 0.56352E-09 -9.2491 0.81000E+00 -0.0915 23 AlOH+2 0.42376E-07 -7.3729 0.19481E-07 -7.7104 0.45973E+00 -0.3375 24 HAlO2,aq 0.16054E-10 -10.7944 0.16054E-10 -10.7944 0.10000E+01 0.0000 25 AlO2- 0.63503E-14 -14.1972 0.51185E-14 -14.2909 0.80602E+00 -0.0937 26 CH4,aq 0.25750E-08 -8.5892 0.24486E-08 -8.6111 0.95090E+00 -0.0219 27 C2H6,aq 0.25258E-18 -18.5976 0.24018E-18 -18.6195 0.95090E+00 -0.0219 31 CO,aq 0.36454E-10 -10.4383 0.36454E-10 -10.4383 0.10000E+01 0.0000 32 CO2,aq 0.35516E+00 -0.4496 0.33772E+00 -0.4714 0.95090E+00 -0.0219 33 CO3-2 0.61301E-12 -12.2125 0.28445E-12 -12.5460 0.46402E+00 -0.3335 34 CaCO3,aq 0.34234E-15 -15.4655 0.34234E-15 -15.4655 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.68389E-10 -10.1650 0.55395E-10 -10.2565 0.81000E+00 -0.0915 36 CaCl+ 0.44881E-08 -8.3479 0.36354E-08 -8.4395 0.81000E+00 -0.0915 37 CaCl2,aq 0.20214E-10 -10.6944 0.20214E-10 -10.6944 0.10000E+01 0.0000 38 CaF+ 0.69570E-10 -10.1576 0.56352E-10 -10.2491 0.81000E+00 -0.0915 39 CaOH+ 0.12081E-14 -14.9179 0.97857E-15 -15.0094 0.81000E+00 -0.0915 40 CaSO4,aq 0.30840E-12 -12.5109 0.30840E-12 -12.5109 0.10000E+01 0.0000 41 HCl,aq 0.29776E-04 -4.5261 0.29776E-04 -4.5261 0.10000E+01 0.0000 45 HF,aq 0.19112E-02 -2.7187 0.19112E-02 -2.7187 0.10000E+01 0.0000 46 HF2- 0.32116E-07 -7.4933 0.25948E-07 -7.5859 0.80795E+00 -0.0926 47 Fe+3 0.23319E-18 -18.6323 0.42428E-19 -19.3723 0.18195E+00 -0.7401 48 FeCl+ 0.22483E-09 -9.6481 0.18212E-09 -9.7397 0.81000E+00 -0.0915 49 FeCl2,aq 0.13494E-15 -15.8698 0.13494E-15 -15.8698 0.10000E+01 0.0000 50 FeCl+2 0.15433E-18 -18.8116 0.70949E-19 -19.1491 0.45973E+00 -0.3375 51 FeF+ 0.12472E-10 -10.9041 0.10102E-10 -10.9956 0.81000E+00 -0.0915 52 FeF+2 0.33076E-16 -16.4805 0.15206E-16 -16.8180 0.45973E+00 -0.3375 54 FeOH+ 0.28261E-13 -13.5488 0.22892E-13 -13.6403 0.81000E+00 -0.0915 56 FeO+ 0.10319E-17 -17.9864 0.83582E-18 -18.0779 0.81000E+00 -0.0915 57 FeOH+2 0.24105E-17 -17.6179 0.11082E-17 -17.9554 0.45973E+00 -0.3375 60 H2,aq 0.44879E-08 -8.3480 0.42676E-08 -8.3698 0.95090E+00 -0.0219 61 KCl,aq 0.49630E-07 -7.3043 0.49630E-07 -7.3043 0.10000E+01 0.0000 62 KHSO4,aq 0.23240E-13 -13.6338 0.23240E-13 -13.6338 0.10000E+01 0.0000 63 KOH,aq 0.71479E-14 -14.1458 0.71479E-14 -14.1458 0.10000E+01 0.0000 64 KSO4- 0.22738E-10 -10.6432 0.18371E-10 -10.7359 0.80795E+00 -0.0926 65 MgCO3,aq 0.34344E-19 -19.4641 0.34344E-19 -19.4641 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.27969E-13 -13.5533 0.22655E-13 -13.6448 0.81000E+00 -0.0915 67 MgCl+ 0.16281E-11 -11.7883 0.13187E-11 -11.8798 0.81000E+00 -0.0915 68 MgF+ 0.10314E-12 -12.9866 0.83547E-13 -13.0781 0.81000E+00 -0.0915 69 MgOH+ 0.26756E-17 -17.5726 0.21672E-17 -17.6641 0.81000E+00 -0.0915 71 MnF+ 0.81772E-12 -12.0874 0.66235E-12 -12.1789 0.81000E+00 -0.0915 73 MnOH+ 0.52224E-15 -15.2821 0.42301E-15 -15.3736 0.81000E+00 -0.0915 78 MnCl+ 0.17400E-09 -9.7595 0.14094E-09 -9.8510 0.81000E+00 -0.0915 79 MnSO4,aq 0.28566E-14 -14.5442 0.28566E-14 -14.5442 0.10000E+01 0.0000 80 NaCl,aq 0.12764E-03 -3.8940 0.12764E-03 -3.8940 0.10000E+01 0.0000 81 NaF,aq 0.15493E-06 -6.8099 0.15493E-06 -6.8099 0.10000E+01 0.0000 82 NaOH,aq 0.10115E-11 -11.9951 0.10115E-11 -11.9951 0.10000E+01 0.0000 84 OH- 0.10254E-09 -9.9891 0.82652E-10 -10.0827 0.80602E+00 -0.0937 90 H3PO3,aq 0.12334E-19 -19.9089 0.12334E-19 -19.9089 0.10000E+01 0.0000 91 H2PO3- 0.19870E-19 -19.7018 0.16054E-19 -19.7944 0.80795E+00 -0.0926 92 H3PO4,aq 0.29031E-07 -7.5371 0.29031E-07 -7.5371 0.10000E+01 0.0000 93 H2PO4- 0.13634E-07 -7.8654 0.11029E-07 -7.9575 0.80897E+00 -0.0921 95 H4P2O7,aq 0.11188E-16 -16.9512 0.11188E-16 -16.9512 0.10000E+01 0.0000 96 H3P2O7- 0.25464E-16 -16.5941 0.20574E-16 -16.6867 0.80795E+00 -0.0926 97 H2P2O7-2 0.20696E-16 -16.6841 0.96034E-17 -17.0176 0.46402E+00 -0.3335 100 H2S,aq 0.25631E-01 -1.5912 0.24373E-01 -1.6131 0.95090E+00 -0.0219 101 S2-2 0.14436E-13 -13.8405 0.66988E-14 -14.1740 0.46402E+00 -0.3335 102 S3-2 0.11108E-12 -12.9544 0.51543E-13 -13.2878 0.46402E+00 -0.3335 103 S3- 0.45448E-08 -8.3425 0.36720E-08 -8.4351 0.80795E+00 -0.0926 104 S4-2 0.56459E-12 -12.2483 0.26198E-12 -12.5817 0.46402E+00 -0.3335 105 S5-2 0.19135E-11 -11.7182 0.88790E-12 -12.0516 0.46402E+00 -0.3335 106 SO2,aq 0.94238E-11 -11.0258 0.94238E-11 -11.0258 0.10000E+01 0.0000 107 SO3-2 0.11946E-16 -16.9228 0.56499E-17 -17.2480 0.47296E+00 -0.3252 108 HSO3- 0.30399E-11 -11.5171 0.24561E-11 -11.6098 0.80795E+00 -0.0926 109 HSO4- 0.83473E-07 -7.0785 0.67702E-07 -7.1694 0.81106E+00 -0.0909 111 S2O3-2 0.62860E-11 -11.2016 0.29168E-11 -11.5351 0.46402E+00 -0.3335 112 HS2O3- 0.44816E-11 -11.3486 0.36209E-11 -11.4412 0.80795E+00 -0.0926 113 H2S2O3,aq 0.40302E-12 -12.3947 0.40302E-12 -12.3947 0.10000E+01 0.0000 121 S4O6-2 0.43949E-19 -19.3570 0.20393E-19 -19.6905 0.46402E+00 -0.3335 Charge balance for all species = -.5637E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.8524529E-02 0.3912550E+00 0.3873284E+03 0.0000 2 H2O 0.1000000E+01 0.5515309E+02 0.9758794E+06 0.0000 3 Cl- 0.2896730E-01 0.2912477E-01 0.1014146E+04 0.5278 4 SO4-- 0.2174469E-07 0.1043985E-06 0.9849838E-02 -3.6780 5 HCO3- 0.2792969E-04 0.3551860E+00 0.2128594E+05 -2.4872 6 HS- 0.1405578E-05 0.2563265E-01 0.8326047E+03 -3.7862 7 Al+++ 0.1109494E-05 0.1152581E-05 0.3054376E-01 -0.2213 8 H4SiO4 0.1010711E-02 0.1010711E-02 0.9541238E+02 -2.9954 9 Ca++ 0.2083136E-06 0.2129602E-06 0.8382804E-02 -2.7009 10 Mg++ 0.8388532E-10 0.8564451E-10 0.2045055E-05 -6.0986 11 Fe++ 0.1071919E-07 0.1095653E-07 0.6009766E-03 -3.9915 12 K+ 0.1444896E-03 0.1445393E-03 0.5550981E+01 -1.7733 13 Na+ 0.2037383E-01 0.2050163E-01 0.4629226E+03 0.3748 14 Mn++ 0.2129900E-08 0.2304716E-08 0.1243584E-03 -4.6928 15 F- 0.4990664E-04 0.1961361E-02 0.3659740E+02 -2.2372 16 HPO4-- 0.1850231E-12 0.4266521E-07 0.4021933E-02 -8.7480 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.4968124E+00 0.3822954E+00 0.1145170E+00 0.0000000E+00 2 H2O 0.5377616E+02 0.5389011E+02 -.1139467E+00 0.0000000E+00 3 Cl- 0.2845783E-01 0.2845783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2290497E-01 0.1020079E-06 0.2290487E-01 0.0000000E+00 5 HCO3- 0.3470523E+00 0.3470523E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.9376029E-01 0.2504568E-01 0.6871462E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1126188E-05 0.3649164E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9875660E-03 0.1116545E-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 0.1070563E-07 0.2188664E-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- 0.1920096E-02 0.1916447E-02 0.3649164E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2541E-16 Mass of aqueous solution: 0.994843E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 4.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.2189E-07 -7.660 0.2626E-05 -5.581 0.7277E-04 0.5239E-06 quartz 0.1116E-01 -1.952 0.6707 -0.173 18.59 0.2533 sulfur 0.9162E-01 -1.038 2.937 0.468 81.40 1.421 topaz 0.1825E-05 -5.739 0.3358E-03 -3.474 0.9306E-02 0.9401E-04 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 = 3.608368 g Volume = 1.674438 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: 4.7999900 moles log = 0.6812 Original solution: 1000.0103000 g Original solution / Rock added: 208.34 (Water/Rock Ratio), log = 2.3188 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 42.7782 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.2994E-01 0.7801 0.9991E+00 0.1281E+01 CO2,gas 0.9517E+00 0.8875 0.3613E+02 0.4071E+02 CH4,gas 0.8164E-07 1.0320 0.3604E-05 0.3492E-05 H2,gas 0.1280E-06 1.0231 0.5603E-05 0.5477E-05 H2S,gas 0.1840E-01 0.8512 0.6700E+00 0.7871E+00 S2,gas 0.1255E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1270E-08 1.0000 0.5432E-07 0.5432E-07 SO3,gas 0.4341E-29 1.0000 0.1857E-27 0.1857E-27 SO2,gas 0.9526E-12 1.0000 0.4075E-10 0.4075E-10 HF,gas 0.1097E-06 1.0000 0.4693E-05 0.4693E-05 HCl,gas 0.1228E-08 1.0000 0.5254E-07 0.5254E-07 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 -1.699 0.29016E+04 0.000 2 CO2,gas -6.66 -6.80 -0.14 -0.047 0.24088E+03 1.558 3 CH4,gas 4.54 -2.60 -7.14 -1.786 0.12195E+05 -5.443 4 H2,gas 8.00 1.05 -6.95 -3.972 0.11868E+05 -5.252 5 H2S,gas -6.23 -8.10 -1.87 -0.936 0.31979E+04 -0.174 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.75 -8.96 -2.758 0.15306E+05 -7.265 8 SO3,gas 17.12 -12.31 -29.43 -7.358 0.50251E+05 -27.731 9 SO2,gas 0.83 -11.26 -12.09 -3.224 0.20641E+05 -10.390 10 HF,gas 0.47 -6.55 -7.03 -3.514 0.11999E+05 -5.329 11 HCl,gas 5.19 -3.79 -8.98 -4.489 0.15331E+05 -7.280 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 -0.23 -3.10 -0.517 0.52948E+04 69 diamond -3.10 -4.70 -1.59 -0.456 0.27225E+04 86 gibbsite 4.08 -0.23 -4.31 -0.616 0.73584E+04 89 graphite -3.55 -4.70 -1.15 -0.329 0.19648E+04 92 halite 1.57 -3.41 -4.99 -2.494 0.85185E+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 -0.23 -4.63 -0.772 0.79117E+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: 0.2000000 MOLES Current total amount of reactant added: 4.7999900 MOLES New total amount of reactant added: 4.9999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 4.9999900 Water: Moles liquid = 0.5442E+02 kg liquid = 0.9804E+00 Moles total = 0.5394E+02 kg total = 0.9717E+00 Activity = 0.9929 Stoichiometric ionic strength = .2256067E+00 Osmotic coef. = 0.9155 True ionic strength = .3014293E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.2964E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.96868E-02 -2.0138 0.78673E-02 -2.1042 0.81216E+00 -0.0904 2 H2O 0.99293E+00 -0.0031 0.99293E+00 -0.0031 3 Cl- 0.30065E-01 -1.5219 0.24217E-01 -1.6159 0.80549E+00 -0.0939 4 SO4-- 0.15353E-07 -7.8138 0.70655E-08 -8.1509 0.46019E+00 -0.3371 5 HCO3- 0.25626E-04 -4.5913 0.20683E-04 -4.6844 0.80711E+00 -0.0931 6 HS- 0.12898E-05 -5.8895 0.10392E-05 -5.9833 0.80565E+00 -0.0939 7 Al+++ 0.15898E-05 -5.7987 0.28091E-06 -6.5514 0.17669E+00 -0.7528 8 H4SiO4 0.10102E-02 -2.9956 0.10102E-02 -2.9956 0.10000E+01 0.0000 9 Ca++ 0.20751E-06 -6.6830 0.94531E-07 -7.0244 0.45554E+00 -0.3415 10 Mg++ 0.83575E-10 -10.0779 0.37834E-10 -10.4221 0.45269E+00 -0.3442 11 Fe++ 0.13430E-07 -7.8719 0.60890E-08 -8.2155 0.45337E+00 -0.3435 12 K+ 0.14400E-03 -3.8416 0.11626E-03 -3.9346 0.80736E+00 -0.0929 13 Na+ 0.20302E-01 -1.6925 0.16348E-01 -1.7865 0.80527E+00 -0.0941 14 Mn++ 0.21187E-08 -8.6739 0.96164E-09 -9.0170 0.45388E+00 -0.3431 15 F- 0.46016E-04 -4.3371 0.36962E-04 -4.4322 0.80325E+00 -0.0952 16 HPO4-- 0.15075E-12 -12.8217 0.69388E-13 -13.1587 0.46028E+00 -0.3370 17 SiF6-2 0.70280E-13 -13.1532 0.32249E-13 -13.4915 0.45886E+00 -0.3383 18 HSiO3- 0.14991E-09 -9.8242 0.12075E-09 -9.9181 0.80549E+00 -0.0939 19 Ca(HSiO3)+ 0.32189E-15 -15.4923 0.25995E-15 -15.5851 0.80760E+00 -0.0928 20 Mg(HSiO3)+ 0.16033E-18 -18.7950 0.12948E-18 -18.8878 0.80760E+00 -0.0928 21 NaHSiO3,aq 0.31928E-10 -10.4958 0.31928E-10 -10.4958 0.10000E+01 0.0000 22 AlO+ 0.75913E-09 -9.1197 0.61307E-09 -9.2125 0.80760E+00 -0.0928 23 AlOH+2 0.52843E-07 -7.2770 0.24016E-07 -7.6195 0.45449E+00 -0.3425 24 HAlO2,aq 0.15409E-10 -10.8122 0.15409E-10 -10.8122 0.10000E+01 0.0000 25 AlO2- 0.53958E-14 -14.2679 0.43356E-14 -14.3629 0.80352E+00 -0.0950 26 CH4,aq 0.30895E-08 -8.5101 0.29340E-08 -8.5325 0.94966E+00 -0.0224 27 C2H6,aq 0.35026E-18 -18.4556 0.33263E-18 -18.4780 0.94966E+00 -0.0224 31 CO,aq 0.39194E-10 -10.4068 0.39194E-10 -10.4068 0.10000E+01 0.0000 32 CO2,aq 0.36872E+00 -0.4333 0.35016E+00 -0.4557 0.94966E+00 -0.0224 33 CO3-2 0.50044E-12 -12.3006 0.22963E-12 -12.6390 0.45886E+00 -0.3383 34 CaCO3,aq 0.27218E-15 -15.5651 0.27218E-15 -15.5651 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61797E-10 -10.2090 0.49907E-10 -10.3018 0.80760E+00 -0.0928 36 CaCl+ 0.45874E-08 -8.3384 0.37047E-08 -8.4312 0.80760E+00 -0.0928 37 CaCl2,aq 0.21315E-10 -10.6713 0.21315E-10 -10.6713 0.10000E+01 0.0000 38 CaF+ 0.63168E-10 -10.1995 0.51014E-10 -10.2923 0.80760E+00 -0.0928 39 CaOH+ 0.10529E-14 -14.9776 0.85030E-15 -15.0704 0.80760E+00 -0.0928 40 CaSO4,aq 0.21209E-12 -12.6735 0.21209E-12 -12.6735 0.10000E+01 0.0000 41 HCl,aq 0.34912E-04 -4.4570 0.34912E-04 -4.4570 0.10000E+01 0.0000 45 HF,aq 0.19907E-02 -2.7010 0.19907E-02 -2.7010 0.10000E+01 0.0000 46 HF2- 0.30841E-07 -7.5109 0.24843E-07 -7.6048 0.80549E+00 -0.0939 47 Fe+3 0.32960E-18 -18.4820 0.58484E-19 -19.2330 0.17744E+00 -0.7509 48 FeCl+ 0.28900E-09 -9.5391 0.23340E-09 -9.6319 0.80760E+00 -0.0928 49 FeCl2,aq 0.17895E-15 -15.7473 0.17895E-15 -15.7473 0.10000E+01 0.0000 50 FeCl+2 0.22266E-18 -18.6524 0.10119E-18 -18.9948 0.45449E+00 -0.3425 51 FeF+ 0.14241E-10 -10.8465 0.11501E-10 -10.9393 0.80760E+00 -0.0928 52 FeF+2 0.42391E-16 -16.3727 0.19266E-16 -16.7152 0.45449E+00 -0.3425 54 FeOH+ 0.30975E-13 -13.5090 0.25015E-13 -13.6018 0.80760E+00 -0.0928 56 FeO+ 0.11108E-17 -17.9544 0.89704E-18 -18.0472 0.80760E+00 -0.0928 57 FeOH+2 0.29654E-17 -17.5279 0.13477E-17 -17.8704 0.45449E+00 -0.3425 60 H2,aq 0.46587E-08 -8.3317 0.44242E-08 -8.3542 0.94966E+00 -0.0224 61 KCl,aq 0.51030E-07 -7.2922 0.51030E-07 -7.2922 0.10000E+01 0.0000 62 KHSO4,aq 0.18272E-13 -13.7382 0.18272E-13 -13.7382 0.10000E+01 0.0000 63 KOH,aq 0.62665E-14 -14.2030 0.62665E-14 -14.2030 0.10000E+01 0.0000 64 KSO4- 0.15825E-10 -10.8007 0.12747E-10 -10.8946 0.80549E+00 -0.0939 65 MgCO3,aq 0.27305E-19 -19.5638 0.27305E-19 -19.5638 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.25272E-13 -13.5974 0.20410E-13 -13.6902 0.80760E+00 -0.0928 67 MgCl+ 0.16640E-11 -11.7788 0.13439E-11 -11.8716 0.80760E+00 -0.0928 68 MgF+ 0.93650E-13 -13.0285 0.75631E-13 -13.1213 0.80760E+00 -0.0928 69 MgOH+ 0.23318E-17 -17.6323 0.18831E-17 -17.7251 0.80760E+00 -0.0928 71 MnF+ 0.74133E-12 -12.1300 0.59870E-12 -12.2228 0.80760E+00 -0.0928 73 MnOH+ 0.45444E-15 -15.3425 0.36700E-15 -15.4353 0.80760E+00 -0.0928 78 MnCl+ 0.17757E-09 -9.7506 0.14341E-09 -9.8434 0.80760E+00 -0.0928 79 MnSO4,aq 0.19615E-14 -14.7074 0.19615E-14 -14.7074 0.10000E+01 0.0000 80 NaCl,aq 0.13121E-03 -3.8820 0.13121E-03 -3.8820 0.10000E+01 0.0000 81 NaF,aq 0.14147E-06 -6.8493 0.14147E-06 -6.8493 0.10000E+01 0.0000 82 NaOH,aq 0.88651E-12 -12.0523 0.88651E-12 -12.0523 0.10000E+01 0.0000 84 OH- 0.90752E-10 -10.0421 0.72921E-10 -10.1371 0.80352E+00 -0.0950 90 H3PO3,aq 0.13233E-19 -19.8784 0.13233E-19 -19.8784 0.10000E+01 0.0000 91 H2PO3- 0.18870E-19 -19.7242 0.15200E-19 -19.8182 0.80549E+00 -0.0939 92 H3PO4,aq 0.30037E-07 -7.5223 0.30037E-07 -7.5223 0.10000E+01 0.0000 93 H2PO4- 0.12486E-07 -7.9036 0.10070E-07 -7.9970 0.80654E+00 -0.0934 95 H4P2O7,aq 0.11979E-16 -16.9216 0.11979E-16 -16.9216 0.10000E+01 0.0000 96 H3P2O7- 0.24135E-16 -16.6174 0.19441E-16 -16.7113 0.80549E+00 -0.0939 97 H2P2O7-2 0.17452E-16 -16.7581 0.80081E-17 -17.0965 0.45886E+00 -0.3383 100 H2S,aq 0.26606E-01 -1.5750 0.25267E-01 -1.5974 0.94966E+00 -0.0224 101 S2-2 0.11787E-13 -13.9286 0.54084E-14 -14.2669 0.45886E+00 -0.3383 102 S3-2 0.90693E-13 -13.0424 0.41615E-13 -13.3808 0.45886E+00 -0.3383 103 S3- 0.40962E-08 -8.3876 0.32994E-08 -8.4816 0.80549E+00 -0.0939 104 S4-2 0.46097E-12 -12.3363 0.21152E-12 -12.6747 0.45886E+00 -0.3383 105 S5-2 0.15623E-11 -11.8062 0.71687E-12 -12.1446 0.45886E+00 -0.3383 106 SO2,aq 0.87640E-11 -11.0573 0.87640E-11 -11.0573 0.10000E+01 0.0000 107 SO3-2 0.87426E-17 -17.0584 0.40910E-17 -17.3882 0.46794E+00 -0.3298 108 HSO3- 0.25018E-11 -11.6017 0.20152E-11 -11.6957 0.80549E+00 -0.0939 109 HSO4- 0.66242E-07 -7.1789 0.53569E-07 -7.2711 0.80869E+00 -0.0922 111 S2O3-2 0.46028E-11 -11.3370 0.21120E-11 -11.6753 0.45886E+00 -0.3383 112 HS2O3- 0.36884E-11 -11.4332 0.29710E-11 -11.5271 0.80549E+00 -0.0939 113 H2S2O3,aq 0.37470E-12 -12.4263 0.37470E-12 -12.4263 0.10000E+01 0.0000 121 S4O6-2 0.28861E-19 -19.5397 0.13243E-19 -19.8780 0.45886E+00 -0.3383 Charge balance for all species = -.5618E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.9686827E-02 0.4070406E+00 0.4026905E+03 0.0000 2 H2O 0.1000000E+01 0.5513953E+02 0.9749976E+06 0.0000 3 Cl- 0.3006480E-01 0.3023097E-01 0.1051972E+04 0.4883 4 SO4-- 0.1535343E-07 0.7992694E-07 0.7536019E-02 -3.9425 5 HCO3- 0.2562566E-04 0.3687474E+00 0.2208412E+05 -2.5802 6 HS- 0.1289844E-05 0.2660766E-01 0.8637065E+03 -3.8791 7 Al+++ 0.1589826E-05 0.1643443E-05 0.4352308E-01 -0.2389 8 H4SiO4 0.1010185E-02 0.1010185E-02 0.9530001E+02 -2.9956 9 Ca++ 0.2075141E-06 0.2122479E-06 0.8349269E-02 -2.8161 10 Mg++ 0.8357510E-10 0.8535805E-10 0.2036874E-05 -6.2138 11 Fe++ 0.1343049E-07 0.1373377E-07 0.7528156E-03 -4.0071 12 K+ 0.1440048E-03 0.1440559E-03 0.5528774E+01 -1.8304 13 Na+ 0.2030171E-01 0.2043306E-01 0.4610707E+03 0.3177 14 Mn++ 0.2118692E-08 0.2297007E-08 0.1238609E-03 -4.8086 15 F- 0.4601626E-04 0.2036897E-02 0.3798183E+02 -2.3281 16 HPO4-- 0.1507511E-12 0.4252250E-07 0.4005844E-02 -8.9504 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.5183474E+00 0.3990543E+00 0.1192931E+00 0.0000000E+00 2 H2O 0.5393990E+02 0.5405766E+02 -.1177617E+00 0.0000000E+00 3 Cl- 0.2963783E-01 0.2963783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2385997E-01 0.7835873E-07 0.2385989E-01 0.0000000E+00 5 HCO3- 0.3615123E+00 0.3615123E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.9766529E-01 0.2608561E-01 0.7157969E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.1611197E-05 0.3164155E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9903649E-03 0.1116266E-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 0.1346431E-07 0.1912796E-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- 0.2000096E-02 0.1996932E-02 0.3164155E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1313E-16 Mass of aqueous solution: 0.998838E+03 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 4.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.1913E-07 -7.718 0.2295E-05 -5.639 0.6152E-04 0.4579E-06 quartz 0.1116E-01 -1.952 0.6706 -0.174 17.97 0.2532 sulfur 0.9544E-01 -1.020 3.060 0.486 82.02 1.480 topaz 0.1582E-05 -5.801 0.2912E-03 -3.536 0.7805E-02 0.8151E-04 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 = 3.730642 g Volume = 1.733619 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: 4.9999900 moles log = 0.6990 Original solution: 1000.0103000 g Original solution / Rock added: 200.00 (Water/Rock Ratio), log = 2.3010 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 44.5246 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.2910E-01 0.7709 0.9988E+00 0.1296E+01 CO2,gas 0.9525E+00 0.8834 0.3746E+02 0.4241E+02 CH4,gas 0.9387E-07 1.0333 0.4319E-05 0.4179E-05 H2,gas 0.1274E-06 1.0240 0.5808E-05 0.5672E-05 H2S,gas 0.1844E-01 0.8458 0.6946E+00 0.8212E+00 S2,gas 0.1206E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1312E-08 1.0000 0.5841E-07 0.5841E-07 SO3,gas 0.3740E-29 1.0000 0.1665E-27 0.1665E-27 SO2,gas 0.8512E-12 1.0000 0.3790E-10 0.3790E-10 HF,gas 0.1098E-06 1.0000 0.4888E-05 0.4888E-05 HCl,gas 0.1384E-08 1.0000 0.6160E-07 0.6160E-07 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 -1.699 0.29018E+04 -0.001 2 CO2,gas -6.66 -6.79 -0.13 -0.042 0.21405E+03 1.574 3 CH4,gas 4.54 -2.52 -7.06 -1.766 0.12061E+05 -5.365 4 H2,gas 8.00 1.06 -6.93 -3.963 0.11841E+05 -5.236 5 H2S,gas -6.23 -8.09 -1.86 -0.929 0.31712E+04 -0.158 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.72 -8.93 -2.748 0.15252E+05 -7.234 8 SO3,gas 17.12 -12.36 -29.48 -7.369 0.50332E+05 -27.779 9 SO2,gas 0.83 -11.29 -12.12 -3.232 0.20695E+05 -10.421 10 HF,gas 0.47 -6.54 -7.01 -3.505 0.11969E+05 -5.311 11 HCl,gas 5.19 -3.72 -8.91 -4.455 0.15212E+05 -7.210 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 -0.25 -3.12 -0.520 0.53252E+04 69 diamond -3.10 -4.65 -1.55 -0.442 0.26419E+04 86 gibbsite 4.08 -0.25 -4.33 -0.618 0.73890E+04 89 graphite -3.55 -4.65 -1.10 -0.315 0.18841E+04 92 halite 1.57 -3.40 -4.98 -2.488 0.84980E+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 -0.25 -4.65 -0.775 0.79421E+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: 0.2000000 MOLES Current total amount of reactant added: 4.9999900 MOLES New total amount of reactant added: 5.1999900 MOLES Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.5508E-08 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.1999900 Water: Moles liquid = 0.5460E+02 kg liquid = 0.9837E+00 Moles total = 0.5410E+02 kg total = 0.9747E+00 Activity = 0.9927 Stoichiometric ionic strength = .2334909E+00 Osmotic coef. = 0.9154 True ionic strength = .3122976E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3082E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.10842E-01 -1.9649 0.87815E-02 -2.0564 0.80994E+00 -0.0915 2 H2O 0.99267E+00 -0.0032 0.99267E+00 -0.0032 3 Cl- 0.31155E-01 -1.5065 0.25021E-01 -1.6017 0.80312E+00 -0.0952 4 SO4-- 0.11220E-07 -7.9500 0.51082E-08 -8.2917 0.45526E+00 -0.3417 5 HCO3- 0.23829E-04 -4.6229 0.19177E-04 -4.7172 0.80477E+00 -0.0943 6 HS- 0.11996E-05 -5.9209 0.96365E-06 -6.0161 0.80328E+00 -0.0951 7 Al+++ 0.21806E-05 -5.6614 0.37599E-06 -6.4248 0.17243E+00 -0.7634 8 H4SiO4 0.10097E-02 -2.9958 0.10097E-02 -2.9958 0.10000E+01 0.0000 9 Ca++ 0.20672E-06 -6.6846 0.93134E-07 -7.0309 0.45053E+00 -0.3463 10 Mg++ 0.83266E-10 -10.0795 0.37273E-10 -10.4286 0.44764E+00 -0.3491 11 Fe++ 0.16348E-07 -7.7865 0.73291E-08 -8.1349 0.44832E+00 -0.3484 12 K+ 0.14352E-03 -3.8431 0.11554E-03 -3.9373 0.80502E+00 -0.0942 13 Na+ 0.20230E-01 -1.6940 0.16243E-01 -1.7893 0.80289E+00 -0.0953 14 Mn++ 0.21077E-08 -8.6762 0.94602E-09 -9.0241 0.44885E+00 -0.3479 15 F- 0.42975E-04 -4.3668 0.34415E-04 -4.4633 0.80082E+00 -0.0965 16 HPO4-- 0.12564E-12 -12.9009 0.57211E-13 -13.2425 0.45535E+00 -0.3417 17 SiF6-2 0.71893E-13 -13.1433 0.32632E-13 -13.4864 0.45390E+00 -0.3430 18 HSiO3- 0.13466E-09 -9.8707 0.10815E-09 -9.9660 0.80312E+00 -0.0952 19 Ca(HSiO3)+ 0.28486E-15 -15.5454 0.22939E-15 -15.6394 0.80527E+00 -0.0941 20 Mg(HSiO3)+ 0.14188E-18 -18.8481 0.11425E-18 -18.9421 0.80527E+00 -0.0941 21 NaHSiO3,aq 0.28411E-10 -10.5465 0.28411E-10 -10.5465 0.10000E+01 0.0000 22 AlO+ 0.81767E-09 -9.0874 0.65844E-09 -9.1815 0.80527E+00 -0.0941 23 AlOH+2 0.64058E-07 -7.1934 0.28791E-07 -7.5407 0.44946E+00 -0.3473 24 HAlO2,aq 0.14823E-10 -10.8291 0.14823E-10 -10.8291 0.10000E+01 0.0000 25 AlO2- 0.46642E-14 -14.3312 0.37365E-14 -14.4275 0.80110E+00 -0.0963 26 CH4,aq 0.36781E-08 -8.4344 0.34885E-08 -8.4574 0.94846E+00 -0.0230 27 C2H6,aq 0.47899E-18 -18.3197 0.45430E-18 -18.3427 0.94846E+00 -0.0230 31 CO,aq 0.42009E-10 -10.3767 0.42009E-10 -10.3767 0.10000E+01 0.0000 32 CO2,aq 0.38219E+00 -0.4177 0.36250E+00 -0.4407 0.94846E+00 -0.0230 33 CO3-2 0.42024E-12 -12.3765 0.19075E-12 -12.7195 0.45390E+00 -0.3430 34 CaCO3,aq 0.22275E-15 -15.6522 0.22275E-15 -15.6522 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.56615E-10 -10.2471 0.45591E-10 -10.3411 0.80527E+00 -0.0941 36 CaCl+ 0.46831E-08 -8.3295 0.37711E-08 -8.4235 0.80527E+00 -0.0941 37 CaCl2,aq 0.22417E-10 -10.6494 0.22417E-10 -10.6494 0.10000E+01 0.0000 38 CaF+ 0.58113E-10 -10.2357 0.46796E-10 -10.3298 0.80527E+00 -0.0941 39 CaOH+ 0.93177E-15 -15.0307 0.75032E-15 -15.1248 0.80527E+00 -0.0941 40 CaSO4,aq 0.15107E-12 -12.8208 0.15107E-12 -12.8208 0.10000E+01 0.0000 41 HCl,aq 0.40263E-04 -4.3951 0.40263E-04 -4.3951 0.10000E+01 0.0000 45 HF,aq 0.20689E-02 -2.6843 0.20689E-02 -2.6843 0.10000E+01 0.0000 46 HF2- 0.29932E-07 -7.5239 0.24039E-07 -7.6191 0.80312E+00 -0.0952 47 Fe+3 0.44597E-18 -18.3507 0.77233E-19 -19.1122 0.17318E+00 -0.7615 48 FeCl+ 0.36046E-09 -9.4431 0.29026E-09 -9.5372 0.80527E+00 -0.0941 49 FeCl2,aq 0.22994E-15 -15.6384 0.22994E-15 -15.6384 0.10000E+01 0.0000 50 FeCl+2 0.30719E-18 -18.5126 0.13807E-18 -18.8599 0.44946E+00 -0.3473 51 FeF+ 0.16006E-10 -10.7957 0.12890E-10 -10.8898 0.80527E+00 -0.0941 52 FeF+2 0.52706E-16 -16.2781 0.23689E-16 -16.6254 0.44946E+00 -0.3473 54 FeOH+ 0.33490E-13 -13.4751 0.26968E-13 -13.5691 0.80527E+00 -0.0941 56 FeO+ 0.11804E-17 -17.9280 0.95055E-18 -18.0220 0.80527E+00 -0.0941 57 FeOH+2 0.35466E-17 -17.4502 0.15941E-17 -17.7975 0.44946E+00 -0.3473 60 H2,aq 0.48283E-08 -8.3162 0.45794E-08 -8.3392 0.94846E+00 -0.0230 61 KCl,aq 0.52395E-07 -7.2807 0.52395E-07 -7.2807 0.10000E+01 0.0000 62 KHSO4,aq 0.14654E-13 -13.8341 0.14654E-13 -13.8341 0.10000E+01 0.0000 63 KOH,aq 0.55777E-14 -14.2535 0.55777E-14 -14.2535 0.10000E+01 0.0000 64 KSO4- 0.11404E-10 -10.9430 0.91584E-11 -11.0382 0.80312E+00 -0.0952 65 MgCO3,aq 0.22345E-19 -19.6508 0.22345E-19 -19.6508 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.23152E-13 -13.6354 0.18644E-13 -13.7295 0.80527E+00 -0.0941 67 MgCl+ 0.16987E-11 -11.7699 0.13679E-11 -11.8640 0.80527E+00 -0.0941 68 MgF+ 0.86151E-13 -13.0647 0.69375E-13 -13.1588 0.80527E+00 -0.0941 69 MgOH+ 0.20634E-17 -17.6854 0.16616E-17 -17.7795 0.80527E+00 -0.0941 71 MnF+ 0.68099E-12 -12.1669 0.54838E-12 -12.2609 0.80527E+00 -0.0941 73 MnOH+ 0.40157E-15 -15.3962 0.32337E-15 -15.4903 0.80527E+00 -0.0941 78 MnCl+ 0.18101E-09 -9.7423 0.14576E-09 -9.8364 0.80527E+00 -0.0941 79 MnSO4,aq 0.13951E-14 -14.8554 0.13951E-14 -14.8554 0.10000E+01 0.0000 80 NaCl,aq 0.13468E-03 -3.8707 0.13468E-03 -3.8707 0.10000E+01 0.0000 81 NaF,aq 0.13087E-06 -6.8832 0.13087E-06 -6.8832 0.10000E+01 0.0000 82 NaOH,aq 0.78887E-12 -12.1030 0.78887E-12 -12.1030 0.10000E+01 0.0000 84 OH- 0.81529E-10 -10.0887 0.65312E-10 -10.1850 0.80110E+00 -0.0963 90 H3PO3,aq 0.14074E-19 -19.8516 0.14074E-19 -19.8516 0.10000E+01 0.0000 91 H2PO3- 0.18034E-19 -19.7439 0.14484E-19 -19.8391 0.80312E+00 -0.0952 92 H3PO4,aq 0.30856E-07 -7.5107 0.30856E-07 -7.5107 0.10000E+01 0.0000 93 H2PO4- 0.11525E-07 -7.9384 0.92679E-08 -8.0330 0.80419E+00 -0.0946 95 H4P2O7,aq 0.12645E-16 -16.8981 0.12645E-16 -16.8981 0.10000E+01 0.0000 96 H3P2O7- 0.22892E-16 -16.6403 0.18385E-16 -16.7355 0.80312E+00 -0.0952 97 H2P2O7-2 0.14948E-16 -16.8254 0.67847E-17 -17.1685 0.45390E+00 -0.3430 100 H2S,aq 0.27575E-01 -1.5595 0.26154E-01 -1.5825 0.94846E+00 -0.0230 101 S2-2 0.98992E-14 -14.0044 0.44933E-14 -14.3474 0.45390E+00 -0.3430 102 S3-2 0.76169E-13 -13.1182 0.34573E-13 -13.4613 0.45390E+00 -0.3430 103 S3- 0.37446E-08 -8.4266 0.30073E-08 -8.5218 0.80312E+00 -0.0952 104 S4-2 0.38715E-12 -12.4121 0.17573E-12 -12.7552 0.45390E+00 -0.3430 105 S5-2 0.13121E-11 -11.8820 0.59557E-12 -12.2251 0.45390E+00 -0.3430 106 SO2,aq 0.81755E-11 -11.0875 0.81755E-11 -11.0875 0.10000E+01 0.0000 107 SO3-2 0.66122E-17 -17.1797 0.30623E-17 -17.5140 0.46313E+00 -0.3343 108 HSO3- 0.20965E-11 -11.6785 0.16837E-11 -11.7737 0.80312E+00 -0.0952 109 HSO4- 0.53609E-07 -7.2708 0.43230E-07 -7.3642 0.80639E+00 -0.0935 111 S2O3-2 0.34830E-11 -11.4580 0.15809E-11 -11.8011 0.45390E+00 -0.3430 112 HS2O3- 0.30908E-11 -11.5099 0.24823E-11 -11.6051 0.80312E+00 -0.0952 113 H2S2O3,aq 0.34945E-12 -12.4566 0.34945E-12 -12.4566 0.10000E+01 0.0000 121 S4O6-2 0.19677E-19 -19.7060 0.89315E-20 -20.0491 0.45390E+00 -0.3430 Charge balance for all species = -.5599E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1084214E-01 0.4227209E+00 0.4179301E+03 0.0000 2 H2O 0.1000000E+01 0.5512606E+02 0.9741227E+06 0.0000 3 Cl- 0.3115479E-01 0.3132980E-01 0.1089497E+04 0.4547 4 SO4-- 0.1122040E-07 0.6230206E-07 0.5870397E-02 -4.1789 5 HCO3- 0.2382945E-04 0.3822183E+00 0.2287594E+05 -2.6608 6 HS- 0.1199646E-05 0.2757619E-01 0.8945612E+03 -3.9596 7 Al+++ 0.2180581E-05 0.2245471E-05 0.5942767E-01 -0.2555 8 H4SiO4 0.1009663E-02 0.1009663E-02 0.9518859E+02 -2.9958 9 Ca++ 0.2067200E-06 0.2115404E-06 0.8316001E-02 -2.9180 10 Mg++ 0.8326553E-10 0.8507350E-10 0.2028758E-05 -6.3157 11 Fe++ 0.1634783E-07 0.1672432E-07 0.9161439E-03 -4.0221 12 K+ 0.1435232E-03 0.1435756E-03 0.5506745E+01 -1.8808 13 Na+ 0.2023013E-01 0.2036494E-01 0.4592336E+03 0.2671 14 Mn++ 0.2107660E-08 0.2289350E-08 0.1233674E-03 -4.9112 15 F- 0.4297486E-04 0.2112043E-02 0.3935736E+02 -2.4068 16 HPO4-- 0.1256432E-12 0.4238075E-07 0.3989883E-02 -9.1297 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.5398824E+00 0.4158130E+00 0.1240694E+00 0.0000000E+00 2 H2O 0.5410364E+02 0.5422522E+02 -.1215768E+00 0.0000000E+00 3 Cl- 0.3081783E-01 0.3081783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2481497E-01 0.6128395E-07 0.2481491E-01 0.0000000E+00 5 HCO3- 0.3759723E+00 0.3759723E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1015703E+00 0.2712556E-01 0.7444473E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2208776E-05 0.2566576E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9931641E-03 0.1115986E-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 0.1645103E-07 0.1614124E-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- 0.2080096E-02 0.2077529E-02 0.2566576E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4937E-17 Mass of aqueous solution: 0.100283E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.1614E-07 -7.792 0.1937E-05 -5.713 0.5026E-04 0.3864E-06 quartz 0.1116E-01 -1.952 0.6704 -0.174 17.40 0.2532 sulfur 0.9926E-01 -1.003 3.182 0.503 82.59 1.540 topaz 0.1283E-05 -5.892 0.2362E-03 -3.627 0.6130E-02 0.6612E-04 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 = 3.852908 g Volume = 1.792798 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: 5.1999900 moles log = 0.7160 Original solution: 1000.0103000 g Original solution / Rock added: 192.31 (Water/Rock Ratio), log = 2.2840 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 46.2733 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.2833E-01 0.7617 0.9986E+00 0.1311E+01 CO2,gas 0.9532E+00 0.8793 0.3878E+02 0.4411E+02 CH4,gas 0.1073E-06 1.0346 0.5135E-05 0.4963E-05 H2,gas 0.1268E-06 1.0250 0.6012E-05 0.5866E-05 H2S,gas 0.1849E-01 0.8405 0.7190E+00 0.8554E+00 S2,gas 0.1160E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1353E-08 1.0000 0.6260E-07 0.6260E-07 SO3,gas 0.3242E-29 1.0000 0.1500E-27 0.1500E-27 SO2,gas 0.7640E-12 1.0000 0.3535E-10 0.3535E-10 HF,gas 0.1098E-06 1.0000 0.5080E-05 0.5080E-05 HCl,gas 0.1535E-08 1.0000 0.7104E-07 0.7104E-07 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 -1.700 0.29020E+04 -0.001 2 CO2,gas -6.66 -6.77 -0.11 -0.037 0.18838E+03 1.589 3 CH4,gas 4.54 -2.44 -6.99 -1.747 0.11933E+05 -5.289 4 H2,gas 8.00 1.08 -6.92 -3.954 0.11816E+05 -5.221 5 H2S,gas -6.23 -8.07 -1.84 -0.921 0.31456E+04 -0.143 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.69 -8.90 -2.739 0.15201E+05 -7.203 8 SO3,gas 17.12 -12.40 -29.52 -7.381 0.50409E+05 -27.824 9 SO2,gas 0.83 -11.32 -12.15 -3.240 0.20747E+05 -10.452 10 HF,gas 0.47 -6.52 -6.99 -3.497 0.11941E+05 -5.294 11 HCl,gas 5.19 -3.66 -8.85 -4.424 0.15107E+05 -7.148 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 -0.26 -3.14 -0.523 0.53540E+04 69 diamond -3.10 -4.60 -1.50 -0.429 0.25647E+04 86 gibbsite 4.08 -0.27 -4.34 -0.621 0.74180E+04 89 graphite -3.55 -4.60 -1.06 -0.302 0.18069E+04 92 halite 1.57 -3.39 -4.97 -2.483 0.84786E+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 -0.26 -4.67 -0.778 0.79709E+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: 0.2000000 MOLES Current total amount of reactant added: 5.1999900 MOLES New total amount of reactant added: 5.3999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.3999900 Water: Moles liquid = 0.5478E+02 kg liquid = 0.9869E+00 Moles total = 0.5427E+02 kg total = 0.9776E+00 Activity = 0.9924 Stoichiometric ionic strength = .2413271E+00 Osmotic coef. = 0.9152 True ionic strength = .3231050E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3200E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.11990E-01 -1.9212 0.96855E-02 -2.0139 0.80779E+00 -0.0927 2 H2O 0.99242E+00 -0.0033 0.99242E+00 -0.0033 3 Cl- 0.32237E-01 -1.4916 0.25816E-01 -1.5881 0.80081E+00 -0.0965 4 SO4-- 0.84316E-08 -8.0741 0.37986E-08 -8.4204 0.45052E+00 -0.3463 5 HCO3- 0.22392E-04 -4.6499 0.17969E-04 -4.7455 0.80250E+00 -0.0956 6 HS- 0.11275E-05 -5.9479 0.90309E-06 -6.0443 0.80098E+00 -0.0964 7 Al+++ 0.28889E-05 -5.5393 0.48645E-06 -6.3130 0.16839E+00 -0.7737 8 H4SiO4 0.10091E-02 -2.9960 0.10091E-02 -2.9960 0.10000E+01 0.0000 9 Ca++ 0.20593E-06 -6.6863 0.91788E-07 -7.0372 0.44572E+00 -0.3509 10 Mg++ 0.82957E-10 -10.0811 0.36732E-10 -10.4350 0.44278E+00 -0.3538 11 Fe++ 0.19450E-07 -7.7111 0.86258E-08 -8.0642 0.44348E+00 -0.3531 12 K+ 0.14304E-03 -3.8445 0.11483E-03 -3.9399 0.80276E+00 -0.0954 13 Na+ 0.20159E-01 -1.6955 0.16139E-01 -1.7921 0.80058E+00 -0.0966 14 Mn++ 0.20968E-08 -8.6784 0.93100E-09 -9.0310 0.44401E+00 -0.3526 15 F- 0.40537E-04 -4.3921 0.32367E-04 -4.4899 0.79847E+00 -0.0977 16 HPO4-- 0.10665E-12 -12.9720 0.48060E-13 -13.3182 0.45061E+00 -0.3462 17 SiF6-2 0.74450E-13 -13.1281 0.33439E-13 -13.4758 0.44914E+00 -0.3476 18 HSiO3- 0.12241E-09 -9.9122 0.98031E-10 -10.0086 0.80081E+00 -0.0965 19 Ca(HSiO3)+ 0.25519E-15 -15.5931 0.20492E-15 -15.6884 0.80301E+00 -0.0953 20 Mg(HSiO3)+ 0.12709E-18 -18.8959 0.10206E-18 -18.9912 0.80301E+00 -0.0953 21 NaHSiO3,aq 0.25589E-10 -10.5920 0.25589E-10 -10.5920 0.10000E+01 0.0000 22 AlO+ 0.87184E-09 -9.0596 0.70010E-09 -9.1548 0.80301E+00 -0.0953 23 AlOH+2 0.75937E-07 -7.1195 0.33764E-07 -7.4715 0.44464E+00 -0.3520 24 HAlO2,aq 0.14286E-10 -10.8451 0.14286E-10 -10.8451 0.10000E+01 0.0000 25 AlO2- 0.40876E-14 -14.3885 0.32650E-14 -14.4861 0.79875E+00 -0.0976 26 CH4,aq 0.43475E-08 -8.3618 0.41183E-08 -8.3853 0.94730E+00 -0.0235 27 C2H6,aq 0.64665E-18 -18.1893 0.61257E-18 -18.2128 0.94730E+00 -0.0235 31 CO,aq 0.44898E-10 -10.3478 0.44898E-10 -10.3478 0.10000E+01 0.0000 32 CO2,aq 0.39558E+00 -0.4028 0.37473E+00 -0.4263 0.94730E+00 -0.0235 33 CO3-2 0.36080E-12 -12.4427 0.16205E-12 -12.7903 0.44914E+00 -0.3476 34 CaCO3,aq 0.18651E-15 -15.7293 0.18651E-15 -15.7293 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.52430E-10 -10.2804 0.42102E-10 -10.3757 0.80301E+00 -0.0953 36 CaCl+ 0.47755E-08 -8.3210 0.38348E-08 -8.4163 0.80301E+00 -0.0953 37 CaCl2,aq 0.23520E-10 -10.6286 0.23520E-10 -10.6286 0.10000E+01 0.0000 38 CaF+ 0.54016E-10 -10.2675 0.43376E-10 -10.3628 0.80301E+00 -0.0953 39 CaOH+ 0.83471E-15 -15.0785 0.67029E-15 -15.1737 0.80301E+00 -0.0953 40 CaSO4,aq 0.11072E-12 -12.9558 0.11072E-12 -12.9558 0.10000E+01 0.0000 41 HCl,aq 0.45819E-04 -4.3390 0.45819E-04 -4.3390 0.10000E+01 0.0000 45 HF,aq 0.21461E-02 -2.6684 0.21461E-02 -2.6684 0.10000E+01 0.0000 46 HF2- 0.29286E-07 -7.5333 0.23453E-07 -7.6298 0.80081E+00 -0.0965 47 Fe+3 0.58301E-18 -18.2343 0.98611E-19 -19.0061 0.16914E+00 -0.7718 48 FeCl+ 0.43894E-09 -9.3576 0.35247E-09 -9.4529 0.80301E+00 -0.0953 49 FeCl2,aq 0.28809E-15 -15.5405 0.28809E-15 -15.5405 0.10000E+01 0.0000 50 FeCl+2 0.40908E-18 -18.3882 0.18189E-18 -18.7402 0.44464E+00 -0.3520 51 FeF+ 0.17767E-10 -10.7504 0.14267E-10 -10.8457 0.80301E+00 -0.0953 52 FeF+2 0.63978E-16 -16.1940 0.28447E-16 -16.5460 0.44464E+00 -0.3520 54 FeOH+ 0.35827E-13 -13.4458 0.28770E-13 -13.5411 0.80301E+00 -0.0953 56 FeO+ 0.12421E-17 -17.9058 0.99741E-18 -18.0011 0.80301E+00 -0.0953 57 FeOH+2 0.41492E-17 -17.3820 0.18449E-17 -17.7340 0.44464E+00 -0.3520 60 H2,aq 0.49967E-08 -8.3013 0.47334E-08 -8.3248 0.94730E+00 -0.0235 61 KCl,aq 0.53729E-07 -7.2698 0.53729E-07 -7.2698 0.10000E+01 0.0000 62 KHSO4,aq 0.11945E-13 -13.9228 0.11945E-13 -13.9228 0.10000E+01 0.0000 63 KOH,aq 0.50248E-14 -14.2989 0.50248E-14 -14.2989 0.10000E+01 0.0000 64 KSO4- 0.84523E-11 -11.0730 0.67687E-11 -11.1695 0.80081E+00 -0.0965 65 MgCO3,aq 0.18708E-19 -19.7280 0.18708E-19 -19.7280 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.21439E-13 -13.6688 0.17216E-13 -13.7641 0.80301E+00 -0.0953 67 MgCl+ 0.17321E-11 -11.7614 0.13909E-11 -11.8567 0.80301E+00 -0.0953 68 MgF+ 0.80074E-13 -13.0965 0.64301E-13 -13.1918 0.80301E+00 -0.0953 69 MgOH+ 0.18484E-17 -17.7332 0.14843E-17 -17.8285 0.80301E+00 -0.0953 71 MnF+ 0.63208E-12 -12.1992 0.50757E-12 -12.2945 0.80301E+00 -0.0953 73 MnOH+ 0.35922E-15 -15.4446 0.28846E-15 -15.5399 0.80301E+00 -0.0953 78 MnCl+ 0.18431E-09 -9.7344 0.14801E-09 -9.8297 0.80301E+00 -0.0953 79 MnSO4,aq 0.10210E-14 -14.9910 0.10210E-14 -14.9910 0.10000E+01 0.0000 80 NaCl,aq 0.13808E-03 -3.8599 0.13808E-03 -3.8599 0.10000E+01 0.0000 81 NaF,aq 0.12230E-06 -6.9126 0.12230E-06 -6.9126 0.10000E+01 0.0000 82 NaOH,aq 0.71049E-12 -12.1484 0.71049E-12 -12.1484 0.10000E+01 0.0000 84 OH- 0.74117E-10 -10.1301 0.59201E-10 -10.2277 0.79875E+00 -0.0976 90 H3PO3,aq 0.14870E-19 -19.8277 0.14870E-19 -19.8277 0.10000E+01 0.0000 91 H2PO3- 0.17325E-19 -19.7613 0.13874E-19 -19.8578 0.80081E+00 -0.0965 92 H3PO4,aq 0.31532E-07 -7.5013 0.31532E-07 -7.5013 0.10000E+01 0.0000 93 H2PO4- 0.10708E-07 -7.9703 0.85869E-08 -8.0662 0.80191E+00 -0.0959 95 H4P2O7,aq 0.13208E-16 -16.8791 0.13208E-16 -16.8791 0.10000E+01 0.0000 96 H3P2O7- 0.21742E-16 -16.6627 0.17411E-16 -16.7592 0.80081E+00 -0.0965 97 H2P2O7-2 0.12971E-16 -16.8870 0.58257E-17 -17.2347 0.44914E+00 -0.3476 100 H2S,aq 0.28537E-01 -1.5446 0.27033E-01 -1.5681 0.94730E+00 -0.0235 101 S2-2 0.85002E-14 -14.0706 0.38178E-14 -14.4182 0.44914E+00 -0.3476 102 S3-2 0.65404E-13 -13.1844 0.29376E-13 -13.5320 0.44914E+00 -0.3476 103 S3- 0.34616E-08 -8.4607 0.27721E-08 -8.5572 0.80081E+00 -0.0965 104 S4-2 0.33243E-12 -12.4783 0.14931E-12 -12.8259 0.44914E+00 -0.3476 105 S5-2 0.11267E-11 -11.9482 0.50604E-12 -12.2958 0.44914E+00 -0.3476 106 SO2,aq 0.76484E-11 -11.1164 0.76484E-11 -11.1164 0.10000E+01 0.0000 107 SO3-2 0.51349E-17 -17.2895 0.23544E-17 -17.6281 0.45851E+00 -0.3387 108 HSO3- 0.17829E-11 -11.7489 0.14278E-11 -11.8453 0.80081E+00 -0.0965 109 HSO4- 0.44091E-07 -7.3556 0.35457E-07 -7.4503 0.80416E+00 -0.0947 111 S2O3-2 0.27062E-11 -11.5676 0.12155E-11 -11.9153 0.44914E+00 -0.3476 112 HS2O3- 0.26285E-11 -11.5803 0.21050E-11 -11.6768 0.80081E+00 -0.0965 113 H2S2O3,aq 0.32684E-12 -12.4857 0.32684E-12 -12.4857 0.10000E+01 0.0000 121 S4O6-2 0.13834E-19 -19.8590 0.62136E-20 -20.2067 0.44914E+00 -0.3476 Charge balance for all species = -.5580E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1199012E-01 0.4382967E+00 0.4330484E+03 0.0000 2 H2O 0.1000000E+01 0.5511267E+02 0.9732548E+06 0.0000 3 Cl- 0.3223737E-01 0.3242132E-01 0.1126723E+04 0.4258 4 SO4-- 0.8431648E-08 0.4910146E-07 0.4623573E-02 -4.3926 5 HCO3- 0.2239163E-04 0.3955998E+00 0.2366148E+05 -2.7316 6 HS- 0.1127471E-05 0.2853830E-01 0.9251713E+03 -4.0304 7 Al+++ 0.2888882E-05 0.2965705E-05 0.7843820E-01 -0.2713 8 H4SiO4 0.1009145E-02 0.1009146E-02 0.9507808E+02 -2.9960 9 Ca++ 0.2059320E-06 0.2108375E-06 0.8282998E-02 -3.0095 10 Mg++ 0.8295724E-10 0.8479085E-10 0.2020706E-05 -6.4072 11 Fe++ 0.1945022E-07 0.1990697E-07 0.1089779E-02 -4.0364 12 K+ 0.1430449E-03 0.1430986E-03 0.5484890E+01 -1.9261 13 Na+ 0.2015908E-01 0.2029728E-01 0.4574110E+03 0.2218 14 Mn++ 0.2096798E-08 0.2281744E-08 0.1228778E-03 -5.0033 15 F- 0.4053696E-04 0.2186813E-02 0.4072424E+02 -2.4760 16 HPO4-- 0.1066547E-12 0.4223994E-07 0.3974048E-02 -9.2905 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.5614174E+00 0.4325715E+00 0.1288459E+00 0.0000000E+00 2 H2O 0.5426738E+02 0.5439277E+02 -.1253919E+00 0.0000000E+00 3 Cl- 0.3199783E-01 0.3199783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2576997E-01 0.4846008E-07 0.2576992E-01 0.0000000E+00 5 HCO3- 0.3904323E+00 0.3904323E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1054753E+00 0.2816553E-01 0.7730977E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.2926966E-05 0.1848386E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9959638E-03 0.1115706E-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 0.1964694E-07 0.1294533E-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- 0.2160096E-02 0.2158248E-02 0.1848386E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2739E-16 Mass of aqueous solution: 0.100683E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.1295E-07 -7.888 0.1553E-05 -5.809 0.3907E-04 0.3099E-06 quartz 0.1116E-01 -1.952 0.6703 -0.174 16.86 0.2531 sulfur 0.1031 -0.987 3.305 0.519 83.13 1.599 topaz 0.9242E-06 -6.034 0.1701E-03 -3.769 0.4279E-02 0.4762E-04 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 = 3.975166 g Volume = 1.851974 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: 5.3999900 moles log = 0.7324 Original solution: 1000.0103000 g Original solution / Rock added: 185.19 (Water/Rock Ratio), log = 2.2676 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 48.0244 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.2763E-01 0.7524 0.9983E+00 0.1327E+01 CO2,gas 0.9538E+00 0.8752 0.4009E+02 0.4581E+02 CH4,gas 0.1218E-06 1.0359 0.6062E-05 0.5852E-05 H2,gas 0.1261E-06 1.0259 0.6214E-05 0.6057E-05 H2S,gas 0.1853E-01 0.8352 0.7431E+00 0.8897E+00 S2,gas 0.1118E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1393E-08 1.0000 0.6691E-07 0.6691E-07 SO3,gas 0.2827E-29 1.0000 0.1358E-27 0.1358E-27 SO2,gas 0.6887E-12 1.0000 0.3307E-10 0.3307E-10 HF,gas 0.1097E-06 1.0000 0.5269E-05 0.5269E-05 HCl,gas 0.1684E-08 1.0000 0.8085E-07 0.8085E-07 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 -1.700 0.29022E+04 -0.001 2 CO2,gas -6.66 -6.76 -0.10 -0.032 0.16377E+03 1.603 3 CH4,gas 4.54 -2.37 -6.92 -1.729 0.11809E+05 -5.217 4 H2,gas 8.00 1.09 -6.91 -3.946 0.11791E+05 -5.207 5 H2S,gas -6.23 -8.06 -1.83 -0.914 0.31211E+04 -0.129 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.66 -8.87 -2.730 0.15151E+05 -7.175 8 SO3,gas 17.12 -12.44 -29.57 -7.392 0.50483E+05 -27.867 9 SO2,gas 0.83 -11.35 -12.18 -3.248 0.20796E+05 -10.481 10 HF,gas 0.47 -6.50 -6.98 -3.489 0.11913E+05 -5.278 11 HCl,gas 5.19 -3.60 -8.79 -4.396 0.15011E+05 -7.092 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 -0.28 -3.15 -0.525 0.53813E+04 69 diamond -3.10 -4.56 -1.46 -0.417 0.24906E+04 86 gibbsite 4.08 -0.28 -4.36 -0.623 0.74455E+04 89 graphite -3.55 -4.56 -1.01 -0.290 0.17329E+04 92 halite 1.57 -3.38 -4.95 -2.477 0.84602E+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 -0.28 -4.68 -0.781 0.79983E+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: 0.2000000 MOLES Current total amount of reactant added: 5.3999900 MOLES New total amount of reactant added: 5.5999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.5999900 Water: Moles liquid = 0.5497E+02 kg liquid = 0.9902E+00 Moles total = 0.5443E+02 kg total = 0.9806E+00 Activity = 0.9922 Stoichiometric ionic strength = .2491159E+00 Osmotic coef. = 0.9151 True ionic strength = .3338500E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3318E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.13131E-01 -1.8817 0.10579E-01 -1.9755 0.80571E+00 -0.0938 2 H2O 0.99216E+00 -0.0034 0.99216E+00 -0.0034 3 Cl- 0.33313E-01 -1.4774 0.26603E-01 -1.5751 0.79858E+00 -0.0977 4 SO4-- 0.64839E-08 -8.1882 0.28916E-08 -8.5389 0.44596E+00 -0.3507 5 HCO3- 0.21216E-04 -4.6733 0.16979E-04 -4.7701 0.80031E+00 -0.0967 6 HS- 0.10685E-05 -5.9712 0.85345E-06 -6.0688 0.79875E+00 -0.0976 7 Al+++ 0.37210E-05 -5.4293 0.61231E-06 -6.2130 0.16455E+00 -0.7837 8 H4SiO4 0.10086E-02 -2.9963 0.10086E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20515E-06 -6.6879 0.90490E-07 -7.0434 0.44109E+00 -0.3555 10 Mg++ 0.82651E-10 -10.0828 0.36211E-10 -10.4412 0.43812E+00 -0.3584 11 Fe++ 0.22719E-07 -7.6436 0.99698E-08 -8.0013 0.43883E+00 -0.3577 12 K+ 0.14257E-03 -3.8460 0.11414E-03 -3.9426 0.80057E+00 -0.0966 13 Na+ 0.20089E-01 -1.6971 0.16038E-01 -1.7949 0.79834E+00 -0.0978 14 Mn++ 0.20861E-08 -8.6807 0.91656E-09 -9.0378 0.43936E+00 -0.3572 15 F- 0.38543E-04 -4.4141 0.30688E-04 -4.5130 0.79619E+00 -0.0990 16 HPO4-- 0.91916E-13 -13.0366 0.41000E-13 -13.3872 0.44606E+00 -0.3506 17 SiF6-2 0.77805E-13 -13.1090 0.34590E-13 -13.4611 0.44457E+00 -0.3521 18 HSiO3- 0.11236E-09 -9.9494 0.89725E-10 -10.0471 0.79858E+00 -0.0977 19 Ca(HSiO3)+ 0.23089E-15 -15.6366 0.18491E-15 -15.7330 0.80083E+00 -0.0965 20 Mg(HSiO3)+ 0.11499E-18 -18.9394 0.92084E-19 -19.0358 0.80083E+00 -0.0965 21 NaHSiO3,aq 0.23273E-10 -10.6331 0.23273E-10 -10.6331 0.10000E+01 0.0000 22 AlO+ 0.92208E-09 -9.0352 0.73842E-09 -9.1317 0.80083E+00 -0.0965 23 AlOH+2 0.88409E-07 -7.0535 0.38899E-07 -7.4101 0.44000E+00 -0.3566 24 HAlO2,aq 0.13791E-10 -10.8604 0.13791E-10 -10.8604 0.10000E+01 0.0000 25 AlO2- 0.36230E-14 -14.4409 0.28856E-14 -14.5398 0.79648E+00 -0.0988 26 CH4,aq 0.51047E-08 -8.2920 0.48299E-08 -8.3161 0.94617E+00 -0.0240 27 C2H6,aq 0.86264E-18 -18.0642 0.81620E-18 -18.0882 0.94617E+00 -0.0240 31 CO,aq 0.47859E-10 -10.3200 0.47859E-10 -10.3200 0.10000E+01 0.0000 32 CO2,aq 0.40887E+00 -0.3884 0.38686E+00 -0.4124 0.94617E+00 -0.0240 33 CO3-2 0.31533E-12 -12.5012 0.14019E-12 -12.8533 0.44457E+00 -0.3521 34 CaCO3,aq 0.15906E-15 -15.7984 0.15906E-15 -15.7984 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.48974E-10 -10.3100 0.39220E-10 -10.4065 0.80083E+00 -0.0965 36 CaCl+ 0.48647E-08 -8.3129 0.38958E-08 -8.4094 0.80083E+00 -0.0965 37 CaCl2,aq 0.24622E-10 -10.6087 0.24622E-10 -10.6087 0.10000E+01 0.0000 38 CaF+ 0.50627E-10 -10.2956 0.40543E-10 -10.3921 0.80083E+00 -0.0965 39 CaOH+ 0.75525E-15 -15.1219 0.60482E-15 -15.2184 0.80083E+00 -0.0965 40 CaSO4,aq 0.83089E-13 -13.0805 0.83089E-13 -13.0805 0.10000E+01 0.0000 41 HCl,aq 0.51573E-04 -4.2876 0.51573E-04 -4.2876 0.10000E+01 0.0000 45 HF,aq 0.22225E-02 -2.6532 0.22225E-02 -2.6532 0.10000E+01 0.0000 46 HF2- 0.28835E-07 -7.5401 0.23027E-07 -7.6378 0.79858E+00 -0.0977 47 Fe+3 0.74124E-18 -18.1300 0.12253E-18 -18.9117 0.16531E+00 -0.7817 48 FeCl+ 0.52422E-09 -9.2805 0.41981E-09 -9.3769 0.80083E+00 -0.0965 49 FeCl2,aq 0.35358E-15 -15.4515 0.35358E-15 -15.4515 0.10000E+01 0.0000 50 FeCl+2 0.52934E-18 -18.2763 0.23291E-18 -18.6328 0.44000E+00 -0.3566 51 FeF+ 0.19523E-10 -10.7095 0.15635E-10 -10.8059 0.80083E+00 -0.0965 52 FeF+2 0.76168E-16 -16.1182 0.33513E-16 -16.4748 0.44000E+00 -0.3566 54 FeOH+ 0.38005E-13 -13.4202 0.30435E-13 -13.5166 0.80083E+00 -0.0965 56 FeO+ 0.12968E-17 -17.8871 0.10385E-17 -17.9836 0.80083E+00 -0.0965 57 FeOH+2 0.47687E-17 -17.3216 0.20982E-17 -17.6782 0.44000E+00 -0.3566 60 H2,aq 0.51641E-08 -8.2870 0.48861E-08 -8.3110 0.94617E+00 -0.0240 61 KCl,aq 0.55032E-07 -7.2594 0.55032E-07 -7.2594 0.10000E+01 0.0000 62 KHSO4,aq 0.98721E-14 -14.0056 0.98721E-14 -14.0056 0.10000E+01 0.0000 63 KOH,aq 0.45712E-14 -14.3400 0.45712E-14 -14.3400 0.10000E+01 0.0000 64 KSO4- 0.64131E-11 -11.1929 0.51214E-11 -11.2906 0.79858E+00 -0.0977 65 MgCO3,aq 0.15954E-19 -19.7971 0.15954E-19 -19.7971 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.20025E-13 -13.6984 0.16037E-13 -13.7949 0.80083E+00 -0.0965 67 MgCl+ 0.17643E-11 -11.7534 0.14129E-11 -11.8499 0.80083E+00 -0.0965 68 MgF+ 0.75045E-13 -13.1247 0.60098E-13 -13.2211 0.80083E+00 -0.0965 69 MgOH+ 0.16723E-17 -17.7767 0.13393E-17 -17.8731 0.80083E+00 -0.0965 71 MnF+ 0.59159E-12 -12.2280 0.47376E-12 -12.3244 0.80083E+00 -0.0965 73 MnOH+ 0.32457E-15 -15.4887 0.25992E-15 -15.5852 0.80083E+00 -0.0965 78 MnCl+ 0.18749E-09 -9.7270 0.15015E-09 -9.8235 0.80083E+00 -0.0965 79 MnSO4,aq 0.76512E-15 -15.1163 0.76512E-15 -15.1163 0.10000E+01 0.0000 80 NaCl,aq 0.14139E-03 -3.8496 0.14139E-03 -3.8496 0.10000E+01 0.0000 81 NaF,aq 0.11522E-06 -6.9385 0.11522E-06 -6.9385 0.10000E+01 0.0000 82 NaOH,aq 0.64621E-12 -12.1896 0.64621E-12 -12.1896 0.10000E+01 0.0000 84 OH- 0.68031E-10 -10.1673 0.54185E-10 -10.2661 0.79648E+00 -0.0988 90 H3PO3,aq 0.15628E-19 -19.8061 0.15628E-19 -19.8061 0.10000E+01 0.0000 91 H2PO3- 0.16716E-19 -19.7769 0.13349E-19 -19.8746 0.79858E+00 -0.0977 92 H3PO4,aq 0.32094E-07 -7.4936 0.32094E-07 -7.4936 0.10000E+01 0.0000 93 H2PO4- 0.10006E-07 -7.9998 0.80016E-08 -8.0968 0.79970E+00 -0.0971 95 H4P2O7,aq 0.13687E-16 -16.8637 0.13687E-16 -16.8637 0.10000E+01 0.0000 96 H3P2O7- 0.20684E-16 -16.6844 0.16518E-16 -16.7820 0.79858E+00 -0.0977 97 H2P2O7-2 0.11382E-16 -16.9438 0.50599E-17 -17.2959 0.44457E+00 -0.3521 100 H2S,aq 0.29493E-01 -1.5303 0.27905E-01 -1.5543 0.94617E+00 -0.0240 101 S2-2 0.74300E-14 -14.1290 0.33031E-14 -14.4811 0.44457E+00 -0.3521 102 S3-2 0.57170E-13 -13.2428 0.25416E-13 -13.5949 0.44457E+00 -0.3521 103 S3- 0.32288E-08 -8.4910 0.25785E-08 -8.5886 0.79858E+00 -0.0977 104 S4-2 0.29058E-12 -12.5367 0.12918E-12 -12.8888 0.44457E+00 -0.3521 105 S5-2 0.98482E-12 -12.0066 0.43782E-12 -12.3587 0.44457E+00 -0.3521 106 SO2,aq 0.71741E-11 -11.1442 0.71741E-11 -11.1442 0.10000E+01 0.0000 107 SO3-2 0.40754E-17 -17.3898 0.18505E-17 -17.7327 0.45406E+00 -0.3429 108 HSO3- 0.15349E-11 -11.8139 0.12258E-11 -11.9116 0.79858E+00 -0.0977 109 HSO4- 0.36760E-07 -7.4346 0.29481E-07 -7.5305 0.80200E+00 -0.0958 111 S2O3-2 0.21489E-11 -11.6678 0.95534E-12 -12.0198 0.44457E+00 -0.3521 112 HS2O3- 0.22629E-11 -11.6453 0.18071E-11 -11.7430 0.79858E+00 -0.0977 113 H2S2O3,aq 0.30649E-12 -12.5136 0.30649E-12 -12.5136 0.10000E+01 0.0000 Charge balance for all species = -.5562E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1313057E-01 0.4537691E+00 0.4480470E+03 0.0000 2 H2O 0.1000000E+01 0.5509938E+02 0.9723937E+06 0.0000 3 Cl- 0.3331259E-01 0.3350562E-01 0.1163656E+04 0.4005 4 SO4-- 0.6483922E-08 0.3887304E-07 0.3658072E-02 -4.5878 5 HCO3- 0.2121600E-04 0.4088926E+00 0.2444081E+05 -2.7945 6 HS- 0.1068480E-05 0.2949405E-01 0.9555398E+03 -4.0933 7 Al+++ 0.3721035E-05 0.3810379E-05 0.1007136E+00 -0.2864 8 H4SiO4 0.1008631E-02 0.1008632E-02 0.9496848E+02 -2.9963 9 Ca++ 0.2051503E-06 0.2101393E-06 0.8250255E-02 -3.0923 10 Mg++ 0.8265065E-10 0.8451006E-10 0.2012719E-05 -6.4901 11 Fe++ 0.2271937E-07 0.2326315E-07 0.1272689E-02 -4.0502 12 K+ 0.1425697E-03 0.1426247E-03 0.5463208E+01 -1.9670 13 Na+ 0.2008856E-01 0.2023007E-01 0.4556028E+03 0.1807 14 Mn++ 0.2086103E-08 0.2274188E-08 0.1223920E-03 -5.0868 15 F- 0.3854316E-04 0.2261216E-02 0.4208272E+02 -2.5375 16 HPO4-- 0.9191635E-13 0.4210007E-07 0.3958339E-02 -9.4361 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.5829524E+00 0.4493298E+00 0.1336226E+00 0.0000000E+00 2 H2O 0.5443112E+02 0.5456033E+02 -.1292072E+00 0.0000000E+00 3 Cl- 0.3317783E-01 0.3317783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2672497E-01 0.3849274E-07 0.2672493E-01 0.0000000E+00 5 HCO3- 0.4048923E+00 0.4048923E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1093803E+00 0.2920550E-01 0.8017480E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.3773101E-05 0.1002251E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.9987639E-03 0.1115426E-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 0.2303556E-07 0.9556712E-08 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- 0.2240096E-02 0.2239094E-02 0.1002251E-05 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1961E-16 Mass of aqueous solution: 0.101083E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.9557E-08 -8.020 0.1147E-05 -5.941 0.2798E-04 0.2288E-06 quartz 0.1115E-01 -1.953 0.6701 -0.174 16.35 0.2531 sulfur 0.1069 -0.971 3.427 0.535 83.64 1.658 topaz 0.5011E-06 -6.300 0.9223E-04 -4.035 0.2251E-02 0.2582E-04 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 = 4.097416 g Volume = 1.911149 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: 5.5999900 moles log = 0.7482 Original solution: 1000.0103000 g Original solution / Rock added: 178.57 (Water/Rock Ratio), log = 2.2518 Gas composition at saturation ( 4 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 49.7783 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.2698E-01 0.7431 0.9981E+00 0.1343E+01 CO2,gas 0.9545E+00 0.8712 0.4139E+02 0.4751E+02 CH4,gas 0.1377E-06 1.0372 0.7109E-05 0.6854E-05 H2,gas 0.1255E-06 1.0269 0.6415E-05 0.6247E-05 H2S,gas 0.1857E-01 0.8300 0.7671E+00 0.9243E+00 S2,gas 0.1078E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1433E-08 1.0000 0.7132E-07 0.7132E-07 SO3,gas 0.2478E-29 1.0000 0.1233E-27 0.1233E-27 SO2,gas 0.6232E-12 1.0000 0.3102E-10 0.3102E-10 HF,gas 0.1096E-06 1.0000 0.5457E-05 0.5457E-05 HCl,gas 0.1828E-08 1.0000 0.9100E-07 0.9100E-07 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 -1.700 0.29024E+04 -0.001 2 CO2,gas -6.66 -6.74 -0.08 -0.027 0.14014E+03 1.617 3 CH4,gas 4.54 -2.30 -6.85 -1.712 0.11691E+05 -5.148 4 H2,gas 8.00 1.11 -6.89 -3.938 0.11768E+05 -5.193 5 H2S,gas -6.23 -8.04 -1.81 -0.907 0.30976E+04 -0.115 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 -9.270 7 CO,gas 3.21 -5.63 -8.85 -2.722 0.15104E+05 -7.147 8 SO3,gas 17.12 -12.49 -29.61 -7.402 0.50555E+05 -27.909 9 SO2,gas 0.83 -11.38 -12.21 -3.255 0.20844E+05 -10.508 10 HF,gas 0.47 -6.49 -6.96 -3.481 0.11887E+05 -5.263 11 HCl,gas 5.19 -3.55 -8.74 -4.370 0.14923E+05 -7.041 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 -0.29 -3.17 -0.528 0.54075E+04 69 diamond -3.10 -4.52 -1.42 -0.405 0.24195E+04 86 gibbsite 4.08 -0.30 -4.38 -0.625 0.74719E+04 89 graphite -3.55 -4.52 -0.97 -0.278 0.16618E+04 92 halite 1.57 -3.37 -4.94 -2.472 0.84426E+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 -0.29 -4.70 -0.783 0.80244E+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: 0.2000000 MOLES Current total amount of reactant added: 5.5999900 MOLES New total amount of reactant added: 5.7999900 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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.7999900 Water: Moles liquid = 0.5515E+02 kg liquid = 0.9935E+00 Moles total = 0.5459E+02 kg total = 0.9835E+00 Activity = 0.9919 Stoichiometric ionic strength = .2568576E+00 Osmotic coef. = 0.9150 True ionic strength = .3445316E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3436E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.14263E-01 -1.8458 0.11463E-01 -1.9407 0.80369E+00 -0.0949 2 H2O 0.99191E+00 -0.0035 0.99191E+00 -0.0035 3 Cl- 0.34381E-01 -1.4637 0.27381E-01 -1.5625 0.79642E+00 -0.0989 4 SO4-- 0.50841E-08 -8.2938 0.22450E-08 -8.6488 0.44158E+00 -0.3550 5 HCO3- 0.20238E-04 -4.6938 0.16153E-04 -4.7917 0.79818E+00 -0.0979 6 HS- 0.10194E-05 -5.9916 0.81206E-06 -6.0904 0.79659E+00 -0.0988 7 Al+++ 0.46826E-05 -5.3295 0.75349E-06 -6.1229 0.16091E+00 -0.7934 8 H4SiO4 0.10081E-02 -2.9965 0.10081E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.20438E-06 -6.6896 0.89239E-07 -7.0494 0.43664E+00 -0.3599 10 Mg++ 0.82346E-10 -10.0844 0.35708E-10 -10.4472 0.43363E+00 -0.3629 11 Fe++ 0.26139E-07 -7.5827 0.11353E-07 -7.9449 0.43435E+00 -0.3622 12 K+ 0.14210E-03 -3.8474 0.11346E-03 -3.9452 0.79844E+00 -0.0978 13 Na+ 0.20019E-01 -1.6986 0.15938E-01 -1.7976 0.79617E+00 -0.0990 14 Mn++ 0.20756E-08 -8.6829 0.90264E-09 -9.0445 0.43489E+00 -0.3616 15 F- 0.36885E-04 -4.4331 0.29286E-04 -4.5333 0.79397E+00 -0.1002 16 HPO4-- 0.80227E-13 -13.0957 0.35434E-13 -13.4506 0.44167E+00 -0.3549 17 SiF6-2 0.81873E-13 -13.0869 0.36038E-13 -13.4432 0.44017E+00 -0.3564 18 HSiO3- 0.10395E-09 -9.9832 0.82786E-10 -10.0820 0.79642E+00 -0.0989 19 Ca(HSiO3)+ 0.21065E-15 -15.6764 0.16825E-15 -15.7741 0.79870E+00 -0.0976 20 Mg(HSiO3)+ 0.10490E-18 -18.9792 0.83782E-19 -19.0768 0.79870E+00 -0.0976 21 NaHSiO3,aq 0.21340E-10 -10.6708 0.21340E-10 -10.6708 0.10000E+01 0.0000 22 AlO+ 0.96877E-09 -9.0138 0.77376E-09 -9.1114 0.79870E+00 -0.0976 23 AlOH+2 0.10141E-06 -6.9939 0.44166E-07 -7.3549 0.43553E+00 -0.3610 24 HAlO2,aq 0.13334E-10 -10.8751 0.13334E-10 -10.8751 0.10000E+01 0.0000 25 AlO2- 0.32416E-14 -14.4892 0.25747E-14 -14.5893 0.79427E+00 -0.1000 26 CH4,aq 0.59570E-08 -8.2250 0.56298E-08 -8.2495 0.94507E+00 -0.0245 27 C2H6,aq 0.11381E-17 -17.9438 0.10756E-17 -17.9684 0.94507E+00 -0.0245 31 CO,aq 0.50891E-10 -10.2934 0.50891E-10 -10.2934 0.10000E+01 0.0000 32 CO2,aq 0.42208E+00 -0.3746 0.39889E+00 -0.3991 0.94507E+00 -0.0245 33 CO3-2 0.27963E-12 -12.5534 0.12308E-12 -12.9098 0.44017E+00 -0.3564 34 CaCO3,aq 0.13772E-15 -15.8610 0.13772E-15 -15.8610 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.46070E-10 -10.3366 0.36796E-10 -10.4342 0.79870E+00 -0.0976 36 CaCl+ 0.49509E-08 -8.3053 0.39543E-08 -8.4029 0.79870E+00 -0.0976 37 CaCl2,aq 0.25723E-10 -10.5897 0.25723E-10 -10.5897 0.10000E+01 0.0000 38 CaF+ 0.47773E-10 -10.3208 0.38157E-10 -10.4184 0.79870E+00 -0.0976 39 CaOH+ 0.68903E-15 -15.1618 0.55033E-15 -15.2594 0.79870E+00 -0.0976 40 CaSO4,aq 0.63619E-13 -13.1964 0.63619E-13 -13.1964 0.10000E+01 0.0000 41 HCl,aq 0.57517E-04 -4.2402 0.57517E-04 -4.2402 0.10000E+01 0.0000 45 HF,aq 0.22982E-02 -2.6386 0.22982E-02 -2.6386 0.10000E+01 0.0000 46 HF2- 0.28533E-07 -7.5447 0.22724E-07 -7.6435 0.79642E+00 -0.0989 47 Fe+3 0.92107E-18 -18.0357 0.14891E-18 -18.8271 0.16167E+00 -0.7914 48 FeCl+ 0.61607E-09 -9.2104 0.49206E-09 -9.3080 0.79870E+00 -0.0976 49 FeCl2,aq 0.42656E-15 -15.3700 0.42656E-15 -15.3700 0.10000E+01 0.0000 50 FeCl+2 0.66888E-18 -18.1747 0.29132E-18 -18.5356 0.43553E+00 -0.3610 51 FeF+ 0.21273E-10 -10.6722 0.16991E-10 -10.7698 0.79870E+00 -0.0976 52 FeF+2 0.89240E-16 -16.0494 0.38867E-16 -16.4104 0.43553E+00 -0.3610 54 FeOH+ 0.40038E-13 -13.3975 0.31978E-13 -13.4951 0.79870E+00 -0.0976 56 FeO+ 0.13455E-17 -17.8711 0.10747E-17 -17.9687 0.79870E+00 -0.0976 57 FeOH+2 0.54017E-17 -17.2675 0.23526E-17 -17.6285 0.43553E+00 -0.3610 60 H2,aq 0.53303E-08 -8.2732 0.50376E-08 -8.2978 0.94507E+00 -0.0245 61 KCl,aq 0.56304E-07 -7.2495 0.56304E-07 -7.2495 0.10000E+01 0.0000 62 KHSO4,aq 0.82556E-14 -14.0832 0.82556E-14 -14.0832 0.10000E+01 0.0000 63 KOH,aq 0.41926E-14 -14.3775 0.41926E-14 -14.3775 0.10000E+01 0.0000 64 KSO4- 0.49630E-11 -11.3043 0.39526E-11 -11.4031 0.79642E+00 -0.0989 65 MgCO3,aq 0.13813E-19 -19.8597 0.13813E-19 -19.8597 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.18836E-13 -13.7250 0.15045E-13 -13.8226 0.79870E+00 -0.0976 67 MgCl+ 0.17955E-11 -11.7458 0.14341E-11 -11.8434 0.79870E+00 -0.0976 68 MgF+ 0.70811E-13 -13.1499 0.56557E-13 -13.2475 0.79870E+00 -0.0976 69 MgOH+ 0.15256E-17 -17.8166 0.12185E-17 -17.9142 0.79870E+00 -0.0976 71 MnF+ 0.55748E-12 -12.2538 0.44526E-12 -12.3514 0.79870E+00 -0.0976 73 MnOH+ 0.29571E-15 -15.5291 0.23618E-15 -15.6268 0.79870E+00 -0.0976 78 MnCl+ 0.19055E-09 -9.7200 0.15220E-09 -9.8176 0.79870E+00 -0.0976 79 MnSO4,aq 0.58503E-15 -15.2328 0.58503E-15 -15.2328 0.10000E+01 0.0000 80 NaCl,aq 0.14463E-03 -3.8398 0.14463E-03 -3.8398 0.10000E+01 0.0000 81 NaF,aq 0.10928E-06 -6.9615 0.10928E-06 -6.9615 0.10000E+01 0.0000 82 NaOH,aq 0.59253E-12 -12.2273 0.59253E-12 -12.2273 0.10000E+01 0.0000 84 OH- 0.62944E-10 -10.2010 0.49994E-10 -10.3011 0.79427E+00 -0.1000 90 H3PO3,aq 0.16353E-19 -19.7864 0.16353E-19 -19.7864 0.10000E+01 0.0000 91 H2PO3- 0.16187E-19 -19.7908 0.12891E-19 -19.8897 0.79642E+00 -0.0989 92 H3PO4,aq 0.32566E-07 -7.4872 0.32566E-07 -7.4872 0.10000E+01 0.0000 93 H2PO4- 0.93951E-08 -8.0271 0.74931E-08 -8.1253 0.79756E+00 -0.0982 95 H4P2O7,aq 0.14096E-16 -16.8509 0.14096E-16 -16.8509 0.10000E+01 0.0000 96 H3P2O7- 0.19713E-16 -16.7052 0.15700E-16 -16.8041 0.79642E+00 -0.0989 97 H2P2O7-2 0.10083E-16 -16.9964 0.44384E-17 -17.3528 0.44017E+00 -0.3564 100 H2S,aq 0.30442E-01 -1.5165 0.28770E-01 -1.5411 0.94507E+00 -0.0245 101 S2-2 0.65898E-14 -14.1811 0.29006E-14 -14.5375 0.44017E+00 -0.3564 102 S3-2 0.50705E-13 -13.2950 0.22318E-13 -13.6513 0.44017E+00 -0.3564 103 S3- 0.30339E-08 -8.5180 0.24163E-08 -8.6169 0.79642E+00 -0.0989 104 S4-2 0.25772E-12 -12.5889 0.11344E-12 -12.9452 0.44017E+00 -0.3564 105 S5-2 0.87345E-12 -12.0588 0.38447E-12 -12.4151 0.44017E+00 -0.3564 106 SO2,aq 0.67458E-11 -11.1710 0.67458E-11 -11.1710 0.10000E+01 0.0000 107 SO3-2 0.32941E-17 -17.4823 0.14817E-17 -17.8293 0.44979E+00 -0.3470 108 HSO3- 0.13353E-11 -11.8744 0.10634E-11 -11.9733 0.79642E+00 -0.0989 109 HSO4- 0.31006E-07 -7.5086 0.24802E-07 -7.6055 0.79990E+00 -0.0970 111 S2O3-2 0.17378E-11 -11.7600 0.76492E-12 -12.1164 0.44017E+00 -0.3564 112 HS2O3- 0.19686E-11 -11.7058 0.15678E-11 -11.8047 0.79642E+00 -0.0989 113 H2S2O3,aq 0.28812E-12 -12.5404 0.28812E-12 -12.5404 0.10000E+01 0.0000 Charge balance for all species = -.5544E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1426339E-01 0.4691391E+00 0.4629271E+03 0.0000 2 H2O 0.1000000E+01 0.5508617E+02 0.9715394E+06 0.0000 3 Cl- 0.3438055E-01 0.3458276E-01 0.1200298E+04 0.3781 4 SO4-- 0.5084133E-08 0.3070034E-07 0.2887150E-02 -4.7674 5 HCO3- 0.2023789E-04 0.4220977E+00 0.2521399E+05 -2.8510 6 HS- 0.1019420E-05 0.3044349E-01 0.9856692E+03 -4.1497 7 Al+++ 0.4682624E-05 0.4785015E-05 0.1263938E+00 -0.3009 8 H4SiO4 0.1008121E-02 0.1008121E-02 0.9485979E+02 -2.9965 9 Ca++ 0.2043752E-06 0.2094458E-06 0.8217770E-02 -3.1681 10 Mg++ 0.8234600E-10 0.8423113E-10 0.2004794E-05 -6.5659 11 Fe++ 0.2613917E-07 0.2677656E-07 0.1463966E-02 -4.0635 12 K+ 0.1420977E-03 0.1421540E-03 0.5441697E+01 -2.0045 13 Na+ 0.2001856E-01 0.2016330E-01 0.4538089E+03 0.1431 14 Mn++ 0.2075570E-08 0.2266682E-08 0.1219101E-03 -5.1631 15 F- 0.3688550E-04 0.2335263E-02 0.4343303E+02 -2.5926 16 HPO4-- 0.8022681E-13 0.4196111E-07 0.3942753E-02 -9.5692 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6044874E+00 0.4660877E+00 0.1383996E+00 0.0000000E+00 2 H2O 0.5459486E+02 0.5472788E+02 -.1330226E+00 0.0000000E+00 3 Cl- 0.3435783E-01 0.3435783E-01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2767997E-01 0.3050066E-07 0.2767994E-01 0.0000000E+00 5 HCO3- 0.4193523E+00 0.4193523E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1132853E+00 0.3024548E-01 0.8303982E-01 0.0000000E+00 7 Al+++ 0.4775352E-05 0.4753892E-05 0.2146001E-07 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1001564E-02 0.1115146E-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 0.2660240E-07 0.5989873E-08 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- 0.2320096E-02 0.2320075E-02 0.2146001E-07 0.0000000E+00 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.2355E-17 Mass of aqueous solution: 0.101482E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.5990E-08 -8.223 0.7187E-06 -6.143 0.1703E-04 0.1434E-06 quartz 0.1115E-01 -1.953 0.6700 -0.174 15.88 0.2530 sulfur 0.1107 -0.956 3.550 0.550 84.12 1.717 topaz 0.1073E-07 -7.969 0.1975E-05 -5.704 0.4680E-04 0.5529E-06 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 = 4.219656 g Volume = 1.970321 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: 5.7999900 moles log = 0.7634 Original solution: 1000.0103000 g Original solution / Rock added: 172.42 (Water/Rock Ratio), log = 2.2366 Gas composition at saturation ( 4 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 51.5349 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.2639E-01 0.7337 0.9978E+00 0.1360E+01 CO2,gas 0.9550E+00 0.8671 0.4268E+02 0.4922E+02 CH4,gas 0.1548E-06 1.0386 0.8287E-05 0.7979E-05 H2,gas 0.1249E-06 1.0278 0.6614E-05 0.6435E-05 H2S,gas 0.1861E-01 0.8248 0.7909E+00 0.9589E+00 S2,gas 0.1042E-10 1.0000 0.5368E-09 0.5368E-09 CO,gas 0.1472E-08 1.0000 0.7584E-07 0.7584E-07 SO3,gas 0.2182E-29 1.0000 0.1125E-27 0.1125E-27 SO2,gas 0.5661E-12 1.0000 0.2917E-10 0.2917E-10 HF,gas 0.1095E-06 1.0000 0.5643E-05 0.5643E-05 HCl,gas 0.1969E-08 1.0000 0.1015E-06 0.1015E-06 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 1 H2O,gas 1.70 0.00 -1.70 -1.700 0.29026E+04 2 CO2,gas -6.66 -6.73 -0.07 -0.023 0.11743E+03 3 CH4,gas 4.54 -2.24 -6.78 -1.695 0.11578E+05 4 H2,gas 8.00 1.12 -6.88 -3.931 0.11745E+05 5 H2S,gas -6.23 -8.03 -1.80 -0.900 0.30749E+04 6 S2,gas -7.34 -18.30 -10.97 -1.688 0.18730E+05 7 CO,gas 3.21 -5.60 -8.82 -2.714 0.15058E+05 8 SO3,gas 17.12 -12.53 -29.65 -7.412 0.50623E+05 9 SO2,gas 0.83 -11.40 -12.23 -3.262 0.20889E+05 10 HF,gas 0.47 -6.47 -6.95 -3.474 0.11863E+05 11 HCl,gas 5.19 -3.50 -8.69 -4.346 0.14842E+05 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 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 -0.31 -3.18 -0.530 0.54325E+04 69 diamond -3.10 -4.48 -1.38 -0.393 0.23512E+04 86 gibbsite 4.08 -0.31 -4.39 -0.627 0.74971E+04 89 graphite -3.55 -4.48 -0.93 -0.267 0.15934E+04 92 halite 1.57 -3.36 -4.93 -2.467 0.84258E+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 -0.31 -4.71 -0.786 0.80494E+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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.7999900 Water: Moles liquid = 0.5515E+02 kg liquid = 0.9935E+00 Moles total = 0.5459E+02 kg total = 0.9835E+00 Activity = 0.9921 Stoichiometric ionic strength = .2508190E+00 Osmotic coef. = 0.9151 True ionic strength = .3445272E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3436E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.14263E-01 -1.8458 0.11465E-01 -1.9406 0.80386E+00 -0.0948 2 H2O 0.99212E+00 -0.0034 0.99212E+00 -0.0034 3 Cl- 0.34381E-01 -1.4637 0.27387E-01 -1.5625 0.79658E+00 -0.0988 4 SO4-- 0.51892E-08 -8.2849 0.22919E-08 -8.6398 0.44167E+00 -0.3549 5 HCO3- 0.19694E-04 -4.7057 0.15722E-04 -4.8035 0.79834E+00 -0.0978 6 HS- 0.10122E-05 -5.9947 0.80648E-06 -6.0934 0.79676E+00 -0.0987 7 Al+++ 0.46830E-05 -5.3295 0.75371E-06 -6.1228 0.16095E+00 -0.7933 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20438E-06 -6.6896 0.89258E-07 -7.0494 0.43674E+00 -0.3598 10 Mg++ 0.82347E-10 -10.0844 0.35715E-10 -10.4471 0.43372E+00 -0.3628 11 Fe++ 0.26319E-07 -7.5797 0.11434E-07 -7.9418 0.43444E+00 -0.3621 12 K+ 0.14210E-03 -3.8474 0.11348E-03 -3.9451 0.79861E+00 -0.0977 13 Na+ 0.20019E-01 -1.6986 0.15941E-01 -1.7975 0.79633E+00 -0.0989 14 Mn++ 0.20755E-08 -8.6829 0.90282E-09 -9.0444 0.43498E+00 -0.3615 15 F- 0.36872E-04 -4.4333 0.29281E-04 -4.5334 0.79414E+00 -0.1001 16 HPO4-- 0.80189E-13 -13.0959 0.35425E-13 -13.4507 0.44177E+00 -0.3548 17 SiF6-2 0.81799E-13 -13.0873 0.36013E-13 -13.4435 0.44026E+00 -0.3563 18 HSiO3- 0.10393E-09 -9.9833 0.82789E-10 -10.0820 0.79658E+00 -0.0988 19 Ca(HSiO3)+ 0.21066E-15 -15.6764 0.16829E-15 -15.7739 0.79887E+00 -0.0975 20 Mg(HSiO3)+ 0.10490E-18 -18.9792 0.83804E-19 -19.0767 0.79887E+00 -0.0975 21 NaHSiO3,aq 0.21346E-10 -10.6707 0.21346E-10 -10.6707 0.10000E+01 0.0000 22 AlO+ 0.96872E-09 -9.0138 0.77389E-09 -9.1113 0.79887E+00 -0.0975 23 AlOH+2 0.10142E-06 -6.9939 0.44181E-07 -7.3548 0.43562E+00 -0.3609 24 HAlO2,aq 0.13336E-10 -10.8750 0.13336E-10 -10.8750 0.10000E+01 0.0000 25 AlO2- 0.32410E-14 -14.4893 0.25748E-14 -14.5893 0.79444E+00 -0.0999 26 CH4,aq 0.56365E-08 -8.2490 0.53317E-08 -8.2731 0.94592E+00 -0.0241 27 C2H6,aq 0.10267E-17 -17.9885 0.97122E-18 -18.0127 0.94592E+00 -0.0241 31 CO,aq 0.49188E-10 -10.3081 0.49188E-10 -10.3081 0.10000E+01 0.0000 32 CO2,aq 0.41043E+00 -0.3868 0.38823E+00 -0.4109 0.94592E+00 -0.0241 33 CO3-2 0.27206E-12 -12.5653 0.11978E-12 -12.9216 0.44026E+00 -0.3563 34 CaCO3,aq 0.13406E-15 -15.8727 0.13406E-15 -15.8727 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.44841E-10 -10.3483 0.35822E-10 -10.4458 0.79887E+00 -0.0975 36 CaCl+ 0.49520E-08 -8.3052 0.39560E-08 -8.4027 0.79887E+00 -0.0975 37 CaCl2,aq 0.25740E-10 -10.5894 0.25740E-10 -10.5894 0.10000E+01 0.0000 38 CaF+ 0.47766E-10 -10.3209 0.38159E-10 -10.4184 0.79887E+00 -0.0975 39 CaOH+ 0.68906E-15 -15.1617 0.55047E-15 -15.2593 0.79887E+00 -0.0975 40 CaSO4,aq 0.64962E-13 -13.1873 0.64962E-13 -13.1873 0.10000E+01 0.0000 41 HCl,aq 0.57539E-04 -4.2400 0.57539E-04 -4.2400 0.10000E+01 0.0000 45 HF,aq 0.22982E-02 -2.6386 0.22982E-02 -2.6386 0.10000E+01 0.0000 46 HF2- 0.28523E-07 -7.5448 0.22721E-07 -7.6436 0.79658E+00 -0.0988 47 Fe+3 0.93068E-18 -18.0312 0.15049E-18 -18.8225 0.16170E+00 -0.7913 48 FeCl+ 0.62044E-09 -9.2073 0.49565E-09 -9.3048 0.79887E+00 -0.0975 49 FeCl2,aq 0.42977E-15 -15.3668 0.42977E-15 -15.3668 0.10000E+01 0.0000 50 FeCl+2 0.67601E-18 -18.1700 0.29449E-18 -18.5309 0.43562E+00 -0.3609 51 FeF+ 0.21416E-10 -10.6693 0.17109E-10 -10.7668 0.79887E+00 -0.0975 52 FeF+2 0.90157E-16 -16.0450 0.39275E-16 -16.4059 0.43562E+00 -0.3609 54 FeOH+ 0.40315E-13 -13.3945 0.32206E-13 -13.4921 0.79887E+00 -0.0975 56 FeO+ 0.13594E-17 -17.8667 0.10860E-17 -17.9642 0.79887E+00 -0.0975 57 FeOH+2 0.54583E-17 -17.2629 0.23778E-17 -17.6238 0.43562E+00 -0.3609 60 H2,aq 0.52899E-08 -8.2766 0.50038E-08 -8.3007 0.94592E+00 -0.0241 61 KCl,aq 0.56329E-07 -7.2493 0.56329E-07 -7.2493 0.10000E+01 0.0000 62 KHSO4,aq 0.84313E-14 -14.0741 0.84313E-14 -14.0741 0.10000E+01 0.0000 63 KOH,aq 0.41936E-14 -14.3774 0.41936E-14 -14.3774 0.10000E+01 0.0000 64 KSO4- 0.50666E-11 -11.2953 0.40360E-11 -11.3941 0.79658E+00 -0.0988 65 MgCO3,aq 0.13445E-19 -19.8714 0.13445E-19 -19.8714 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.18334E-13 -13.7367 0.14646E-13 -13.8343 0.79887E+00 -0.0975 67 MgCl+ 0.17959E-11 -11.7457 0.14347E-11 -11.8432 0.79887E+00 -0.0975 68 MgF+ 0.70800E-13 -13.1500 0.56560E-13 -13.2475 0.79887E+00 -0.0975 69 MgOH+ 0.15257E-17 -17.8165 0.12188E-17 -17.9141 0.79887E+00 -0.0975 71 MnF+ 0.55738E-12 -12.2538 0.44528E-12 -12.3514 0.79887E+00 -0.0975 73 MnOH+ 0.29571E-15 -15.5291 0.23624E-15 -15.6267 0.79887E+00 -0.0975 78 MnCl+ 0.19059E-09 -9.7199 0.15226E-09 -9.8174 0.79887E+00 -0.0975 79 MnSO4,aq 0.59736E-15 -15.2238 0.59736E-15 -15.2238 0.10000E+01 0.0000 80 NaCl,aq 0.14469E-03 -3.8396 0.14469E-03 -3.8396 0.10000E+01 0.0000 81 NaF,aq 0.10928E-06 -6.9614 0.10928E-06 -6.9614 0.10000E+01 0.0000 82 NaOH,aq 0.59268E-12 -12.2272 0.59268E-12 -12.2272 0.10000E+01 0.0000 84 OH- 0.62933E-10 -10.2011 0.49996E-10 -10.3011 0.79444E+00 -0.0999 90 H3PO3,aq 0.16241E-19 -19.7894 0.16241E-19 -19.7894 0.10000E+01 0.0000 91 H2PO3- 0.16070E-19 -19.7940 0.12801E-19 -19.8927 0.79658E+00 -0.0988 92 H3PO4,aq 0.32569E-07 -7.4872 0.32569E-07 -7.4872 0.10000E+01 0.0000 93 H2PO4- 0.93924E-08 -8.0272 0.74925E-08 -8.1254 0.79772E+00 -0.0981 95 H4P2O7,aq 0.14096E-16 -16.8509 0.14096E-16 -16.8509 0.10000E+01 0.0000 96 H3P2O7- 0.19705E-16 -16.7054 0.15696E-16 -16.8042 0.79658E+00 -0.0988 97 H2P2O7-2 0.10077E-16 -16.9966 0.44367E-17 -17.3529 0.44026E+00 -0.3563 100 H2S,aq 0.30211E-01 -1.5198 0.28578E-01 -1.5440 0.94592E+00 -0.0241 101 S2-2 0.65420E-14 -14.1843 0.28802E-14 -14.5406 0.44026E+00 -0.3563 102 S3-2 0.50337E-13 -13.2981 0.22161E-13 -13.6544 0.44026E+00 -0.3563 103 S3- 0.30226E-08 -8.5196 0.24077E-08 -8.6184 0.79658E+00 -0.0988 104 S4-2 0.25585E-12 -12.5920 0.11264E-12 -12.9483 0.44026E+00 -0.3563 105 S5-2 0.86712E-12 -12.0619 0.38176E-12 -12.4182 0.44026E+00 -0.3563 106 SO2,aq 0.68400E-11 -11.1649 0.68400E-11 -11.1649 0.10000E+01 0.0000 107 SO3-2 0.33390E-17 -17.4764 0.15021E-17 -17.8233 0.44988E+00 -0.3469 108 HSO3- 0.13537E-11 -11.8685 0.10783E-11 -11.9672 0.79658E+00 -0.0988 109 HSO4- 0.31652E-07 -7.4996 0.25324E-07 -7.5965 0.80007E+00 -0.0969 111 S2O3-2 0.17614E-11 -11.7541 0.77550E-12 -12.1104 0.44026E+00 -0.3563 112 HS2O3- 0.19958E-11 -11.6999 0.15898E-11 -11.7987 0.79658E+00 -0.0988 113 H2S2O3,aq 0.29221E-12 -12.5343 0.29221E-12 -12.5343 0.10000E+01 0.0000 Charge balance for all species = -.5544E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1426289E-01 0.4572588E+00 0.4514342E+03 0.0000 2 H2O 0.1000000E+01 0.5509782E+02 0.9722403E+06 0.0000 3 Cl- 0.3438067E-01 0.3458296E-01 0.1200917E+04 0.3782 4 SO4-- 0.5189189E-08 0.3177584E-07 0.2989817E-02 -4.7586 5 HCO3- 0.1969374E-04 0.4104485E+00 0.2453063E+05 -2.8629 6 HS- 0.1012204E-05 0.3021231E-01 0.9786830E+03 -4.1528 7 Al+++ 0.4683001E-05 0.4785404E-05 0.1264685E+00 -0.3010 8 H4SiO4 0.1008549E-02 0.1008550E-02 0.9494846E+02 -2.9963 9 Ca++ 0.2043766E-06 0.2094470E-06 0.8222008E-02 -3.1681 10 Mg++ 0.8234661E-10 0.8423163E-10 0.2005828E-05 -6.5659 11 Fe++ 0.2631902E-07 0.2696092E-07 0.1474797E-02 -4.0606 12 K+ 0.1420985E-03 0.1421548E-03 0.5444504E+01 -2.0045 13 Na+ 0.2001862E-01 0.2016341E-01 0.4540430E+03 0.1431 14 Mn++ 0.2075544E-08 0.2266695E-08 0.1219730E-03 -5.1632 15 F- 0.3687179E-04 0.2335276E-02 0.4345541E+02 -2.5928 16 HPO4-- 0.8018925E-13 0.4196136E-07 0.3944786E-02 -9.5695 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6044874E+00 0.4542820E+00 0.1383996E+00 0.1180570E-01 2 H2O 0.5459486E+02 0.5473913E+02 -.1330218E+00 -.1124944E-01 3 Cl- 0.3435783E-01 0.3435783E-01 0.0000000E+00 0.2463532E-10 4 SO4-- 0.2767997E-01 0.3156898E-07 0.2767994E-01 -.2228002E-08 5 HCO3- 0.4193523E+00 0.4077765E+00 0.0000000E+00 0.1157585E-01 6 HS- 0.1132853E+00 0.3001562E-01 0.8303982E-01 0.2298508E-03 7 Al+++ 0.4775352E-05 0.4754251E-05 0.2110081E-07 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1001984E-02 0.1115104E-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 0.2678540E-07 0.5806869E-08 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- 0.2320096E-02 0.2320074E-02 0.2110081E-07 0.1369224E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8249E-17 Mass of aqueous solution: 0.101430E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) pyrite 0.5807E-08 -8.236 0.6967E-06 -6.157 0.1651E-04 0.1390E-06 quartz 0.1115E-01 -1.953 0.6700 -0.174 15.88 0.2530 sulfur 0.1107 -0.956 3.550 0.550 84.12 1.717 topaz 0.1055E-07 -7.977 0.1942E-05 -5.712 0.4602E-04 0.5436E-06 H2O,gas 0.3264E-03 -3.486 0.5879E-02 -2.231 1.124 0.1296 CO2,gas 0.1158E-01 -1.936 0.5095 -0.293 97.38 6.235 CH4,gas 0.1836E-08 -8.736 0.2944E-07 -7.531 0.5628E-05 0.1185E-05 H2,gas 0.1552E-08 -8.809 0.3135E-08 -8.504 0.5993E-06 0.9887E-06 H2S,gas 0.2298E-03 -3.639 0.7833E-02 -2.106 1.497 0.1170 S2,gas 0.1302E-12 -12.885 0.8351E-11 -11.078 0.1596E-08 0.8081E-10 CO,gas 0.1779E-10 -10.750 0.4982E-09 -9.303 0.9522E-07 0.1104E-07 SO3,gas 0.2786E-31 -31.555 0.2231E-29 -29.652 0.4264E-27 0.1729E-28 SO2,gas 0.7177E-14 -14.144 0.4598E-12 -12.337 0.8788E-10 0.4453E-11 HF,gas 0.1369E-08 -8.864 0.2738E-07 -7.562 0.5234E-05 0.8496E-06 HCl,gas 0.2464E-10 -10.608 0.8982E-09 -9.047 0.1717E-06 0.1529E-07 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 H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9541E+00 0.4771E+02 0.8707 1.618 CH4,gas 0.1513E-06 0.7565E-05 1.0374 -5.105 H2,gas 0.1279E-06 0.6397E-05 1.0270 -5.182 H2S,gas 0.1895E-01 0.9473E+00 0.8293 -0.105 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1466E-08 0.7330E-07 1.0000 -7.135 SO3,gas 0.2296E-29 0.1148E-27 1.0000 -27.940 SO2,gas 0.5916E-12 0.2958E-10 1.0000 -10.529 HF,gas 0.1129E-06 0.5643E-05 1.0000 -5.248 HCl,gas 0.2031E-08 0.1015E-06 1.0000 -6.993 Current weight percent of gas: 0.051339 % Solid products produced: Mass = 4.219631 g Volume = 1.970312 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: 5.7999900 moles log = 0.7634 Original solution: 1000.0103000 g Original solution / Rock added: 172.42 (Water/Rock Ratio), log = 2.2366 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 0.00000E+00 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 -0.15165E-11 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 -0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.60662E-11 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 -0.11374E-11 11 HCl,gas 5.19 5.19 0.00 0.000 -0.15165E-11 145 pyrite -21.25 -21.25 0.00 0.000 -0.60662E-11 150 quartz -2.99 -2.99 0.00 0.000 0.75827E-12 172 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 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 -0.31 -3.18 -0.530 0.54324E+04 69 diamond -3.10 -4.50 -1.39 -0.399 0.23815E+04 86 gibbsite 4.08 -0.31 -4.39 -0.627 0.74968E+04 89 graphite -3.55 -4.50 -0.95 -0.272 0.16238E+04 92 halite 1.57 -3.36 -4.93 -2.467 0.84255E+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 -0.31 -4.71 -0.786 0.80493E+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: 0.2000000 MOLES Current total amount of reactant added: 5.7999900 MOLES New total amount of reactant added: 5.9999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.9999900 Water: Moles liquid = 0.5533E+02 kg liquid = 0.9968E+00 Moles total = 0.5476E+02 kg total = 0.9865E+00 Activity = 0.9921 Stoichiometric ionic strength = .2516377E+00 Osmotic coef. = 0.9150 True ionic strength = .3551410E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3554E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.15388E-01 -1.8128 0.12342E-01 -1.9086 0.80208E+00 -0.0958 2 H2O 0.99211E+00 -0.0034 0.99211E+00 -0.0034 3 Cl- 0.35442E-01 -1.4505 0.28164E-01 -1.5503 0.79467E+00 -0.0998 4 SO4-- 0.42341E-08 -8.3732 0.18526E-08 -8.7322 0.43755E+00 -0.3590 5 HCO3- 0.18330E-04 -4.7368 0.14599E-04 -4.8357 0.79646E+00 -0.0988 6 HS- 0.96332E-06 -6.0162 0.76569E-06 -6.1159 0.79485E+00 -0.0997 7 Al+++ 0.57798E-05 -5.2381 0.91043E-06 -6.0408 0.15752E+00 -0.8027 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20361E-06 -6.6912 0.88072E-07 -7.0552 0.43255E+00 -0.3640 10 Mg++ 0.82045E-10 -10.0859 0.35238E-10 -10.4530 0.42950E+00 -0.3670 11 Fe++ 0.30133E-07 -7.5210 0.12964E-07 -7.8873 0.43023E+00 -0.3663 12 K+ 0.14163E-03 -3.8488 0.11284E-03 -3.9475 0.79673E+00 -0.0987 13 Na+ 0.19949E-01 -1.7001 0.15848E-01 -1.8000 0.79441E+00 -0.1000 14 Mn++ 0.20651E-08 -8.6851 0.88961E-09 -9.0508 0.43078E+00 -0.3657 15 F- 0.35460E-04 -4.4503 0.28090E-04 -4.5514 0.79218E+00 -0.1012 16 HPO4-- 0.70712E-13 -13.1505 0.30947E-13 -13.5094 0.43765E+00 -0.3589 17 SiF6-2 0.86431E-13 -13.0633 0.37695E-13 -13.4237 0.43612E+00 -0.3604 18 HSiO3- 0.96779E-10 -10.0142 0.76907E-10 -10.1140 0.79467E+00 -0.0998 19 Ca(HSiO3)+ 0.19354E-15 -15.7132 0.15425E-15 -15.8118 0.79700E+00 -0.0985 20 Mg(HSiO3)+ 0.96373E-19 -19.0160 0.76809E-19 -19.1146 0.79700E+00 -0.0985 21 NaHSiO3,aq 0.19713E-10 -10.7053 0.19713E-10 -10.7053 0.10000E+01 0.0000 22 AlO+ 0.10122E-08 -8.9947 0.80669E-09 -9.0933 0.79700E+00 -0.0985 23 AlOH+2 0.11491E-06 -6.9396 0.49576E-07 -7.3047 0.43143E+00 -0.3651 24 HAlO2,aq 0.12914E-10 -10.8889 0.12914E-10 -10.8889 0.10000E+01 0.0000 25 AlO2- 0.29227E-14 -14.5342 0.23161E-14 -14.6352 0.79248E+00 -0.1010 26 CH4,aq 0.61480E-08 -8.2113 0.58148E-08 -8.2355 0.94581E+00 -0.0242 27 C2H6,aq 0.11950E-17 -17.9226 0.11303E-17 -17.9468 0.94581E+00 -0.0242 31 CO,aq 0.50250E-10 -10.2989 0.50250E-10 -10.2989 0.10000E+01 0.0000 32 CO2,aq 0.41030E+00 -0.3869 0.38806E+00 -0.4111 0.94581E+00 -0.0242 33 CO3-2 0.23690E-12 -12.6254 0.10332E-12 -12.9858 0.43612E+00 -0.3604 34 CaCO3,aq 0.11410E-15 -15.9427 0.11410E-15 -15.9427 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.41180E-10 -10.3853 0.32820E-10 -10.4839 0.79700E+00 -0.0985 36 CaCl+ 0.50366E-08 -8.2979 0.40142E-08 -8.3964 0.79700E+00 -0.0985 37 CaCl2,aq 0.26860E-10 -10.5709 0.26860E-10 -10.5709 0.10000E+01 0.0000 38 CaF+ 0.45320E-10 -10.3437 0.36120E-10 -10.4422 0.79700E+00 -0.0985 39 CaOH+ 0.63307E-15 -15.1985 0.50456E-15 -15.2971 0.79700E+00 -0.0985 40 CaSO4,aq 0.51812E-13 -13.2856 0.51812E-13 -13.2856 0.10000E+01 0.0000 41 HCl,aq 0.63697E-04 -4.1959 0.63697E-04 -4.1959 0.10000E+01 0.0000 45 HF,aq 0.23734E-02 -2.6246 0.23734E-02 -2.6246 0.10000E+01 0.0000 46 HF2- 0.28325E-07 -7.5478 0.22509E-07 -7.6476 0.79467E+00 -0.0998 47 Fe+3 0.11479E-17 -17.9401 0.18169E-18 -18.7407 0.15828E+00 -0.8006 48 FeCl+ 0.72513E-09 -9.1396 0.57793E-09 -9.2381 0.79700E+00 -0.0985 49 FeCl2,aq 0.51533E-15 -15.2879 0.51533E-15 -15.2879 0.10000E+01 0.0000 50 FeCl+2 0.84748E-18 -18.0719 0.36563E-18 -18.4370 0.43143E+00 -0.3651 51 FeF+ 0.23350E-10 -10.6317 0.18610E-10 -10.7303 0.79700E+00 -0.0985 52 FeF+2 0.10544E-15 -15.9770 0.45488E-16 -16.3421 0.43143E+00 -0.3651 54 FeOH+ 0.42562E-13 -13.3710 0.33922E-13 -13.4695 0.79700E+00 -0.0985 56 FeO+ 0.14196E-17 -17.8478 0.11314E-17 -17.9464 0.79700E+00 -0.0985 57 FeOH+2 0.61812E-17 -17.2089 0.26667E-17 -17.5740 0.43143E+00 -0.3651 60 H2,aq 0.54070E-08 -8.2670 0.51140E-08 -8.2912 0.94581E+00 -0.0242 61 KCl,aq 0.57601E-07 -7.2396 0.57601E-07 -7.2396 0.10000E+01 0.0000 62 KHSO4,aq 0.72951E-14 -14.1370 0.72951E-14 -14.1370 0.10000E+01 0.0000 63 KOH,aq 0.38737E-14 -14.4119 0.38737E-14 -14.4119 0.10000E+01 0.0000 64 KSO4- 0.40823E-11 -11.3891 0.32440E-11 -11.4889 0.79467E+00 -0.0998 65 MgCO3,aq 0.11443E-19 -19.9415 0.11443E-19 -19.9415 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.16836E-13 -13.7738 0.13418E-13 -13.8723 0.79700E+00 -0.0985 67 MgCl+ 0.18265E-11 -11.7384 0.14557E-11 -11.8369 0.79700E+00 -0.0985 68 MgF+ 0.67170E-13 -13.1728 0.53535E-13 -13.2714 0.79700E+00 -0.0985 69 MgOH+ 0.14016E-17 -17.8534 0.11171E-17 -17.9519 0.79700E+00 -0.0985 71 MnF+ 0.52812E-12 -12.2773 0.42092E-12 -12.3758 0.79700E+00 -0.0985 73 MnOH+ 0.27132E-15 -15.5665 0.21624E-15 -15.6651 0.79700E+00 -0.0985 78 MnCl+ 0.19359E-09 -9.7131 0.15429E-09 -9.8117 0.79700E+00 -0.0985 79 MnSO4,aq 0.47580E-15 -15.3226 0.47580E-15 -15.3226 0.10000E+01 0.0000 80 NaCl,aq 0.14792E-03 -3.8300 0.14792E-03 -3.8300 0.10000E+01 0.0000 81 NaF,aq 0.10422E-06 -6.9820 0.10422E-06 -6.9820 0.10000E+01 0.0000 82 NaOH,aq 0.54734E-12 -12.2617 0.54734E-12 -12.2617 0.10000E+01 0.0000 84 OH- 0.58606E-10 -10.2321 0.46444E-10 -10.3331 0.79248E+00 -0.1010 90 H3PO3,aq 0.16804E-19 -19.7746 0.16804E-19 -19.7746 0.10000E+01 0.0000 91 H2PO3- 0.15483E-19 -19.8102 0.12304E-19 -19.9100 0.79467E+00 -0.0998 92 H3PO4,aq 0.32970E-07 -7.4819 0.32970E-07 -7.4819 0.10000E+01 0.0000 93 H2PO4- 0.88536E-08 -8.0529 0.70459E-08 -8.1521 0.79583E+00 -0.0992 95 H4P2O7,aq 0.14445E-16 -16.8403 0.14445E-16 -16.8403 0.10000E+01 0.0000 96 H3P2O7- 0.18804E-16 -16.7258 0.14943E-16 -16.8256 0.79467E+00 -0.0998 97 H2P2O7-2 0.89966E-17 -17.0459 0.39236E-17 -17.4063 0.43612E+00 -0.3604 100 H2S,aq 0.30881E-01 -1.5103 0.29207E-01 -1.5345 0.94581E+00 -0.0242 101 S2-2 0.58246E-14 -14.2347 0.25402E-14 -14.5951 0.43612E+00 -0.3604 102 S3-2 0.44817E-13 -13.3486 0.19546E-13 -13.7090 0.43612E+00 -0.3604 103 S3- 0.28455E-08 -8.5458 0.22612E-08 -8.6457 0.79467E+00 -0.0998 104 S4-2 0.22779E-12 -12.6425 0.99345E-13 -13.0029 0.43612E+00 -0.3604 105 S5-2 0.77203E-12 -12.1124 0.33670E-12 -12.4728 0.43612E+00 -0.3604 106 SO2,aq 0.65482E-11 -11.1839 0.65482E-11 -11.1839 0.10000E+01 0.0000 107 SO3-2 0.27833E-17 -17.5554 0.12410E-17 -17.9062 0.44587E+00 -0.3508 108 HSO3- 0.12068E-11 -11.9184 0.95899E-12 -12.0182 0.79467E+00 -0.0998 109 HSO4- 0.27606E-07 -7.5590 0.22036E-07 -7.6569 0.79822E+00 -0.0979 111 S2O3-2 0.14690E-11 -11.8330 0.64067E-12 -12.1934 0.43612E+00 -0.3604 112 HS2O3- 0.17791E-11 -11.7498 0.14138E-11 -11.8496 0.79467E+00 -0.0998 113 H2S2O3,aq 0.27974E-12 -12.5532 0.27974E-12 -12.5532 0.10000E+01 0.0000 Charge balance for all species = -.5525E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1538753E-01 0.4590051E+00 0.4531333E+03 0.0000 2 H2O 0.1000000E+01 0.5509795E+02 0.9721892E+06 0.0000 3 Cl- 0.3544158E-01 0.3565326E-01 0.1238015E+04 0.3583 4 SO4-- 0.4234073E-08 0.2612069E-07 0.2457583E-02 -4.9150 5 HCO3- 0.1832967E-04 0.4103183E+00 0.2452150E+05 -2.9271 6 HS- 0.9633176E-06 0.3088148E-01 0.1000305E+04 -4.2073 7 Al+++ 0.5779798E-05 0.5895736E-05 0.1558038E+00 -0.3149 8 H4SiO4 0.1008530E-02 0.1008530E-02 0.9494141E+02 -2.9963 9 Ca++ 0.2036094E-06 0.2087594E-06 0.8194565E-02 -3.2379 10 Mg++ 0.8204464E-10 0.8395510E-10 0.1999133E-05 -6.6358 11 Fe++ 0.3013328E-07 0.3088180E-07 0.1689182E-02 -4.0700 12 K+ 0.1416305E-03 0.1416881E-03 0.5426331E+01 -2.0389 13 Na+ 0.1994920E-01 0.2009722E-01 0.4525275E+03 0.1086 14 Mn++ 0.2065138E-08 0.2259254E-08 0.1215659E-03 -5.2336 15 F- 0.3545973E-04 0.2408994E-02 0.4482470E+02 -2.6428 16 HPO4-- 0.7071153E-13 0.4182360E-07 0.3931620E-02 -9.6922 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6260224E+00 0.4575190E+00 0.1431769E+00 0.2532647E-01 2 H2O 0.5475860E+02 0.5491956E+02 -.1368364E+00 -.2412229E-01 3 Cl- 0.3553783E-01 0.3553783E-01 0.0000000E+00 0.5850566E-10 4 SO4-- 0.2863497E-01 0.2603612E-07 0.2863495E-01 -.5154979E-08 5 HCO3- 0.4338123E+00 0.4089898E+00 0.0000000E+00 0.2482253E-01 6 HS- 0.1171903E+00 0.3078150E-01 0.8590484E-01 0.5039541E-03 7 Al+++ 0.4775352E-05 0.5876648E-05 -.1101296E-05 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1005265E-02 0.1114776E-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 0.3078182E-07 0.1810454E-08 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- 0.2400096E-02 0.2401194E-02 -.1101296E-05 0.3033392E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2732E-16 Mass of aqueous solution: 0.101770E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.7002E-03 -3.155 0.1261E-01 -1.899 1.124 0.2781 CO2,gas 0.2482E-01 -1.605 1.092 0.038 97.35 13.37 CH4,gas 0.4295E-08 -8.367 0.6889E-07 -7.162 0.6138E-05 0.2772E-05 H2,gas 0.3403E-08 -8.468 0.6874E-08 -8.163 0.6125E-06 0.2168E-05 H2S,gas 0.5039E-03 -3.298 0.1717E-01 -1.765 1.530 0.2566 S2,gas 0.2794E-12 -12.554 0.1792E-10 -10.747 0.1596E-08 0.1734E-09 CO,gas 0.3898E-10 -10.409 0.1092E-08 -8.962 0.9729E-07 0.2419E-07 SO3,gas 0.5598E-31 -31.252 0.4482E-29 -29.348 0.3994E-27 0.3474E-28 SO2,gas 0.1474E-13 -13.832 0.9442E-12 -12.025 0.8414E-10 0.9146E-11 HF,gas 0.3033E-08 -8.518 0.6067E-07 -7.217 0.5406E-05 0.1882E-05 HCl,gas 0.5851E-10 -10.233 0.2133E-08 -8.671 0.1901E-06 0.3630E-07 pyrite 0.1810E-08 -8.742 0.2172E-06 -6.663 0.5003E-05 0.4334E-07 quartz 0.1115E-01 -1.953 0.6698 -0.174 15.43 0.2529 sulfur 0.1145 -0.941 3.672 0.565 84.58 1.777 topaz -.5506E-06 1.000 -.1013E-03 1.000 -.2334E-02 -.2837E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9537E+00 0.4769E+02 0.8707 1.618 CH4,gas 0.1650E-06 0.8250E-05 1.0374 -5.068 H2,gas 0.1308E-06 0.6538E-05 1.0270 -5.173 H2S,gas 0.1936E-01 0.9681E+00 0.8293 -0.095 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1498E-08 0.7488E-07 1.0000 -7.126 SO3,gas 0.2151E-29 0.1076E-27 1.0000 -27.968 SO2,gas 0.5663E-12 0.2832E-10 1.0000 -10.548 HF,gas 0.1165E-06 0.5827E-05 1.0000 -5.235 HCl,gas 0.2248E-08 0.1124E-06 1.0000 -6.949 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 Current weight percent of gas: 0.109682 % Solid products produced: Mass = 4.341835 g Volume = 2.029472 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: 5.9999900 moles log = 0.7782 Original solution: 1000.0103000 g Original solution / Rock added: 166.67 (Water/Rock Ratio), log = 2.2219 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 1 H2O,gas 1.70 1.70 0.00 0.000 0.00000E+00 2 CO2,gas -6.66 -6.66 0.00 0.000 -0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 -0.30331E-11 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 0.60662E-11 7 CO,gas 3.21 3.21 0.00 0.000 0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.60662E-11 9 SO2,gas 0.83 0.83 0.00 0.000 0.26539E-11 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 0.00 0.000 -0.15165E-11 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 0.00000E+00 172 sulfur -9.15 -9.15 0.00 0.000 0.30331E-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 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 -0.32 -3.20 -0.533 0.54562E+04 69 diamond -3.10 -4.48 -1.38 -0.393 0.23495E+04 86 gibbsite 4.08 -0.33 -4.40 -0.629 0.75206E+04 89 graphite -3.55 -4.48 -0.93 -0.266 0.15918E+04 92 halite 1.57 -3.35 -4.92 -2.462 0.84091E+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+03 214 topaz -16.55 -16.55 0.00 0.000 0.00000E+00 237 boehmite 4.41 -0.32 -4.73 -0.788 0.80731E+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 = 11 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 5.9999900 Water: Moles liquid = 0.5533E+02 kg liquid = 0.9968E+00 Moles total = 0.5476E+02 kg total = 0.9865E+00 Activity = 0.9921 Stoichiometric ionic strength = .2516319E+00 Osmotic coef. = 0.9150 True ionic strength = .3551079E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3554E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.15391E-01 -1.8127 0.12345E-01 -1.9085 0.80209E+00 -0.0958 2 H2O 0.99211E+00 -0.0034 0.99211E+00 -0.0034 3 Cl- 0.35442E-01 -1.4505 0.28164E-01 -1.5503 0.79467E+00 -0.0998 4 SO4-- 0.42321E-08 -8.3734 0.18518E-08 -8.7324 0.43757E+00 -0.3590 5 HCO3- 0.18326E-04 -4.7369 0.14596E-04 -4.8358 0.79647E+00 -0.0988 6 HS- 0.96310E-06 -6.0163 0.76552E-06 -6.1160 0.79485E+00 -0.0997 7 Al+++ 0.46967E-05 -5.3282 0.73987E-06 -6.1308 0.15753E+00 -0.8026 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20361E-06 -6.6912 0.88074E-07 -7.0552 0.43256E+00 -0.3639 10 Mg++ 0.82045E-10 -10.0859 0.35239E-10 -10.4530 0.42951E+00 -0.3670 11 Fe++ 0.30145E-07 -7.5208 0.12970E-07 -7.8871 0.43024E+00 -0.3663 12 K+ 0.14163E-03 -3.8488 0.11284E-03 -3.9475 0.79674E+00 -0.0987 13 Na+ 0.19949E-01 -1.7001 0.15848E-01 -1.8000 0.79442E+00 -0.1000 14 Mn++ 0.20651E-08 -8.6851 0.88964E-09 -9.0508 0.43079E+00 -0.3657 15 F- 0.35436E-04 -4.4506 0.28072E-04 -4.5517 0.79219E+00 -0.1012 16 HPO4-- 0.70682E-13 -13.1507 0.30935E-13 -13.5096 0.43766E+00 -0.3589 17 SiF6-2 0.86156E-13 -13.0647 0.37576E-13 -13.4251 0.43614E+00 -0.3604 18 HSiO3- 0.96757E-10 -10.0143 0.76890E-10 -10.1141 0.79467E+00 -0.0998 19 Ca(HSiO3)+ 0.19350E-15 -15.7133 0.15422E-15 -15.8118 0.79701E+00 -0.0985 20 Mg(HSiO3)+ 0.96354E-19 -19.0161 0.76795E-19 -19.1147 0.79701E+00 -0.0985 21 NaHSiO3,aq 0.19708E-10 -10.7053 0.19708E-10 -10.7053 0.10000E+01 0.0000 22 AlO+ 0.82218E-09 -9.0850 0.65528E-09 -9.1836 0.79701E+00 -0.0985 23 AlOH+2 0.93361E-07 -7.0298 0.40280E-07 -7.3949 0.43144E+00 -0.3651 24 HAlO2,aq 0.10488E-10 -10.9793 0.10488E-10 -10.9793 0.10000E+01 0.0000 25 AlO2- 0.23730E-14 -14.6247 0.18806E-14 -14.7257 0.79249E+00 -0.1010 26 CH4,aq 0.61480E-08 -8.2113 0.58148E-08 -8.2355 0.94581E+00 -0.0242 27 C2H6,aq 0.11951E-17 -17.9226 0.11303E-17 -17.9468 0.94581E+00 -0.0242 31 CO,aq 0.50250E-10 -10.2989 0.50250E-10 -10.2989 0.10000E+01 0.0000 32 CO2,aq 0.41030E+00 -0.3869 0.38806E+00 -0.4111 0.94581E+00 -0.0242 33 CO3-2 0.23679E-12 -12.6256 0.10327E-12 -12.9860 0.43614E+00 -0.3604 34 CaCO3,aq 0.11405E-15 -15.9429 0.11405E-15 -15.9429 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.41171E-10 -10.3854 0.32814E-10 -10.4839 0.79701E+00 -0.0985 36 CaCl+ 0.50368E-08 -8.2978 0.40143E-08 -8.3964 0.79701E+00 -0.0985 37 CaCl2,aq 0.26861E-10 -10.5709 0.26861E-10 -10.5709 0.10000E+01 0.0000 38 CaF+ 0.45291E-10 -10.3440 0.36097E-10 -10.4425 0.79701E+00 -0.0985 39 CaOH+ 0.63295E-15 -15.1986 0.50446E-15 -15.2972 0.79701E+00 -0.0985 40 CaSO4,aq 0.51791E-13 -13.2857 0.51791E-13 -13.2857 0.10000E+01 0.0000 41 HCl,aq 0.63712E-04 -4.1958 0.63712E-04 -4.1958 0.10000E+01 0.0000 45 HF,aq 0.23723E-02 -2.6248 0.23723E-02 -2.6248 0.10000E+01 0.0000 46 HF2- 0.28293E-07 -7.5483 0.22484E-07 -7.6481 0.79467E+00 -0.0998 47 Fe+3 0.11486E-17 -17.9398 0.18181E-18 -18.7404 0.15829E+00 -0.8006 48 FeCl+ 0.72545E-09 -9.1394 0.57819E-09 -9.2379 0.79701E+00 -0.0985 49 FeCl2,aq 0.51556E-15 -15.2877 0.51556E-15 -15.2877 0.10000E+01 0.0000 50 FeCl+2 0.84802E-18 -18.0716 0.36587E-18 -18.4367 0.43144E+00 -0.3651 51 FeF+ 0.23344E-10 -10.6318 0.18605E-10 -10.7304 0.79701E+00 -0.0985 52 FeF+2 0.10543E-15 -15.9770 0.45487E-16 -16.3421 0.43144E+00 -0.3651 54 FeOH+ 0.42571E-13 -13.3709 0.33929E-13 -13.4694 0.79701E+00 -0.0985 56 FeO+ 0.14199E-17 -17.8477 0.11317E-17 -17.9463 0.79701E+00 -0.0985 57 FeOH+2 0.61837E-17 -17.2088 0.26679E-17 -17.5738 0.43144E+00 -0.3651 60 H2,aq 0.54070E-08 -8.2670 0.51140E-08 -8.2912 0.94581E+00 -0.0242 61 KCl,aq 0.57601E-07 -7.2396 0.57601E-07 -7.2396 0.10000E+01 0.0000 62 KHSO4,aq 0.72936E-14 -14.1371 0.72936E-14 -14.1371 0.10000E+01 0.0000 63 KOH,aq 0.38729E-14 -14.4120 0.38729E-14 -14.4120 0.10000E+01 0.0000 64 KSO4- 0.40805E-11 -11.3893 0.32426E-11 -11.4891 0.79467E+00 -0.0998 65 MgCO3,aq 0.11438E-19 -19.9416 0.11438E-19 -19.9416 0.10000E+01 0.0000 66 Mg(HCO3)+ 0.16832E-13 -13.7739 0.13416E-13 -13.8724 0.79701E+00 -0.0985 67 MgCl+ 0.18265E-11 -11.7384 0.14557E-11 -11.8369 0.79701E+00 -0.0985 68 MgF+ 0.67126E-13 -13.1731 0.53500E-13 -13.2716 0.79701E+00 -0.0985 69 MgOH+ 0.14013E-17 -17.8535 0.11169E-17 -17.9520 0.79701E+00 -0.0985 71 MnF+ 0.52778E-12 -12.2775 0.42064E-12 -12.3761 0.79701E+00 -0.0985 73 MnOH+ 0.27127E-15 -15.5666 0.21620E-15 -15.6651 0.79701E+00 -0.0985 78 MnCl+ 0.19359E-09 -9.7131 0.15429E-09 -9.8117 0.79701E+00 -0.0985 79 MnSO4,aq 0.47561E-15 -15.3228 0.47561E-15 -15.3228 0.10000E+01 0.0000 80 NaCl,aq 0.14792E-03 -3.8300 0.14792E-03 -3.8300 0.10000E+01 0.0000 81 NaF,aq 0.10415E-06 -6.9823 0.10415E-06 -6.9823 0.10000E+01 0.0000 82 NaOH,aq 0.54722E-12 -12.2618 0.54722E-12 -12.2618 0.10000E+01 0.0000 84 OH- 0.58593E-10 -10.2322 0.46434E-10 -10.3332 0.79249E+00 -0.1010 90 H3PO3,aq 0.16804E-19 -19.7746 0.16804E-19 -19.7746 0.10000E+01 0.0000 91 H2PO3- 0.15480E-19 -19.8102 0.12302E-19 -19.9100 0.79467E+00 -0.0998 92 H3PO4,aq 0.32972E-07 -7.4819 0.32972E-07 -7.4819 0.10000E+01 0.0000 93 H2PO4- 0.88520E-08 -8.0530 0.70447E-08 -8.1521 0.79584E+00 -0.0992 95 H4P2O7,aq 0.14447E-16 -16.8402 0.14447E-16 -16.8402 0.10000E+01 0.0000 96 H3P2O7- 0.18801E-16 -16.7258 0.14941E-16 -16.8256 0.79467E+00 -0.0998 97 H2P2O7-2 0.89933E-17 -17.0461 0.39223E-17 -17.4065 0.43614E+00 -0.3604 100 H2S,aq 0.30881E-01 -1.5103 0.29207E-01 -1.5345 0.94581E+00 -0.0242 101 S2-2 0.58219E-14 -14.2349 0.25391E-14 -14.5953 0.43614E+00 -0.3604 102 S3-2 0.44796E-13 -13.3488 0.19537E-13 -13.7091 0.43614E+00 -0.3604 103 S3- 0.28448E-08 -8.5459 0.22607E-08 -8.6458 0.79467E+00 -0.0998 104 S4-2 0.22768E-12 -12.6427 0.99302E-13 -13.0030 0.43614E+00 -0.3604 105 S5-2 0.77167E-12 -12.1126 0.33655E-12 -12.4729 0.43614E+00 -0.3604 106 SO2,aq 0.65482E-11 -11.1839 0.65482E-11 -11.1839 0.10000E+01 0.0000 107 SO3-2 0.27820E-17 -17.5556 0.12404E-17 -17.9064 0.44588E+00 -0.3508 108 HSO3- 0.12065E-11 -11.9185 0.95878E-12 -12.0183 0.79467E+00 -0.0998 109 HSO4- 0.27600E-07 -7.5591 0.22031E-07 -7.6570 0.79823E+00 -0.0979 111 S2O3-2 0.14683E-11 -11.8332 0.64039E-12 -12.1936 0.43614E+00 -0.3604 112 HS2O3- 0.17787E-11 -11.7499 0.14135E-11 -11.8497 0.79467E+00 -0.0998 113 H2S2O3,aq 0.27974E-12 -12.5532 0.27974E-12 -12.5532 0.10000E+01 0.0000 Charge balance for all species = -.5525E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1539078E-01 0.4590069E+00 0.4531352E+03 0.0000 2 H2O 0.1000000E+01 0.5509795E+02 0.9721892E+06 0.0000 3 Cl- 0.3544156E-01 0.3565326E-01 0.1238016E+04 0.3582 4 SO4-- 0.4232099E-08 0.2611204E-07 0.2456770E-02 -4.9154 5 HCO3- 0.1832555E-04 0.4103179E+00 0.2452148E+05 -2.9273 6 HS- 0.9631014E-06 0.3088148E-01 0.1000305E+04 -4.2075 7 Al+++ 0.4696670E-05 0.4790864E-05 0.1266058E+00 -0.4053 8 H4SiO4 0.1008530E-02 0.1008530E-02 0.9494141E+02 -2.9963 9 Ca++ 0.2036093E-06 0.2087594E-06 0.8194566E-02 -3.2381 10 Mg++ 0.8204464E-10 0.8395510E-10 0.1999133E-05 -6.6359 11 Fe++ 0.3014549E-07 0.3089432E-07 0.1689866E-02 -4.0700 12 K+ 0.1416305E-03 0.1416881E-03 0.5426332E+01 -2.0390 13 Na+ 0.1994919E-01 0.2009722E-01 0.4525275E+03 0.1085 14 Mn++ 0.2065133E-08 0.2259254E-08 0.1215659E-03 -5.2338 15 F- 0.3543560E-04 0.2407889E-02 0.4480415E+02 -2.6432 16 HPO4-- 0.7068206E-13 0.4182360E-07 0.3931620E-02 -9.6925 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6260224E+00 0.4575208E+00 0.1431747E+00 0.2532685E-01 2 H2O 0.5475860E+02 0.5491956E+02 -.1368353E+00 -.2412265E-01 3 Cl- 0.3553783E-01 0.3553783E-01 0.0000000E+00 0.5851968E-10 4 SO4-- 0.2863497E-01 0.2602750E-07 0.2863495E-01 -.5155067E-08 5 HCO3- 0.4338123E+00 0.4089894E+00 0.0000000E+00 0.2482290E-01 6 HS- 0.1171903E+00 0.3078149E-01 0.8590484E-01 0.5039619E-03 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1005265E-02 0.1114776E-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 0.3079429E-07 0.1797976E-08 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- 0.2400096E-02 0.2400093E-02 0.0000000E+00 0.3032056E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.2023E-16 Mass of aqueous solution: 0.101770E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 5.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.7002E-03 -3.155 0.1261E-01 -1.899 1.124 0.2781 CO2,gas 0.2482E-01 -1.605 1.092 0.038 97.35 13.37 CH4,gas 0.4295E-08 -8.367 0.6889E-07 -7.162 0.6138E-05 0.2772E-05 H2,gas 0.3403E-08 -8.468 0.6874E-08 -8.163 0.6125E-06 0.2168E-05 H2S,gas 0.5040E-03 -3.298 0.1717E-01 -1.765 1.530 0.2566 S2,gas 0.2794E-12 -12.554 0.1792E-10 -10.747 0.1596E-08 0.1734E-09 CO,gas 0.3898E-10 -10.409 0.1092E-08 -8.962 0.9729E-07 0.2419E-07 SO3,gas 0.5599E-31 -31.252 0.4482E-29 -29.348 0.3994E-27 0.3474E-28 SO2,gas 0.1474E-13 -13.831 0.9443E-12 -12.025 0.8414E-10 0.9146E-11 HF,gas 0.3032E-08 -8.518 0.6064E-07 -7.217 0.5404E-05 0.1881E-05 HCl,gas 0.5852E-10 -10.233 0.2134E-08 -8.671 0.1901E-06 0.3631E-07 pyrite 0.1798E-08 -8.745 0.2157E-06 -6.666 0.4968E-05 0.4304E-07 quartz 0.1115E-01 -1.953 0.6698 -0.174 15.43 0.2529 sulfur 0.1145 -0.941 3.672 0.565 84.57 1.777 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9537E+00 0.4769E+02 0.8707 1.618 CH4,gas 0.1650E-06 0.8250E-05 1.0374 -5.068 H2,gas 0.1308E-06 0.6538E-05 1.0270 -5.173 H2S,gas 0.1936E-01 0.9681E+00 0.8293 -0.095 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1498E-08 0.7488E-07 1.0000 -7.126 SO3,gas 0.2151E-29 0.1076E-27 1.0000 -27.968 SO2,gas 0.5663E-12 0.2832E-10 1.0000 -10.548 HF,gas 0.1165E-06 0.5825E-05 1.0000 -5.235 HCl,gas 0.2248E-08 0.1124E-06 1.0000 -6.949 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 Current weight percent of gas: 0.109684 % Solid products produced: Mass = 4.341903 g Volume = 2.029488 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: 5.9999900 moles log = 0.7782 Original solution: 1000.0103000 g Original solution / Rock added: 166.67 (Water/Rock Ratio), log = 2.2219 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.94784E-11 2 CO2,gas -6.66 -6.66 0.00 0.000 0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.33364E-10 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 0.22748E-11 8 SO3,gas 17.12 17.12 0.00 0.000 -0.60662E-11 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 -0.11374E-11 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-11 145 pyrite -21.25 -21.25 0.00 0.000 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 -0.75827E-12 172 sulfur -9.15 -9.15 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 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 -0.41 -3.29 -0.548 0.56105E+04 69 diamond -3.10 -4.48 -1.38 -0.393 0.23495E+04 86 gibbsite 4.08 -0.42 -4.49 -0.642 0.76749E+04 89 graphite -3.55 -4.48 -0.93 -0.266 0.15918E+04 92 halite 1.57 -3.35 -4.92 -2.462 0.84091E+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+03 214 topaz -16.55 -16.73 -0.18 -0.020 0.30931E+03 237 boehmite 4.41 -0.41 -4.82 -0.803 0.82275E+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: 0.2000000 MOLES Current total amount of reactant added: 5.9999900 MOLES New total amount of reactant added: 6.1999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 6.1999900 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5492E+02 kg total = 0.9894E+00 Activity = 0.9921 Stoichiometric ionic strength = .2524351E+00 Osmotic coef. = 0.9150 True ionic strength = .3656207E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3672E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.16512E-01 -1.7822 0.13215E-01 -1.8789 0.80038E+00 -0.0967 2 H2O 0.99211E+00 -0.0034 0.99211E+00 -0.0034 3 Cl- 0.36495E-01 -1.4378 0.28934E-01 -1.5386 0.79282E+00 -0.1008 4 SO4-- 0.35007E-08 -8.4558 0.15180E-08 -8.8187 0.43361E+00 -0.3629 5 HCO3- 0.17150E-04 -4.7657 0.13628E-04 -4.8656 0.79465E+00 -0.0998 6 HS- 0.92072E-06 -6.0359 0.73013E-06 -6.1366 0.79300E+00 -0.1007 7 Al+++ 0.46884E-05 -5.3290 0.72332E-06 -6.1407 0.15428E+00 -0.8117 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20285E-06 -6.6928 0.86930E-07 -7.0608 0.42855E+00 -0.3680 10 Mg++ 0.81745E-10 -10.0875 0.34779E-10 -10.4587 0.42546E+00 -0.3711 11 Fe++ 0.34157E-07 -7.4665 0.14558E-07 -7.8369 0.42619E+00 -0.3704 12 K+ 0.14117E-03 -3.8503 0.11222E-03 -3.9499 0.79493E+00 -0.0997 13 Na+ 0.19880E-01 -1.7016 0.15756E-01 -1.8025 0.79256E+00 -0.1010 14 Mn++ 0.20549E-08 -8.6872 0.87692E-09 -9.0570 0.42675E+00 -0.3698 15 F- 0.34206E-04 -4.4659 0.27033E-04 -4.5681 0.79029E+00 -0.1022 16 HPO4-- 0.62882E-13 -13.2015 0.27273E-13 -13.5643 0.43371E+00 -0.3628 17 SiF6-2 0.91079E-13 -13.0406 0.39361E-13 -13.4049 0.43216E+00 -0.3644 18 HSiO3- 0.90592E-10 -10.0429 0.71824E-10 -10.1437 0.79282E+00 -0.1008 19 Ca(HSiO3)+ 0.17881E-15 -15.7476 0.14219E-15 -15.8471 0.79520E+00 -0.0995 20 Mg(HSiO3)+ 0.89032E-19 -19.0505 0.70798E-19 -19.1500 0.79520E+00 -0.0995 21 NaHSiO3,aq 0.18303E-10 -10.7375 0.18303E-10 -10.7375 0.10000E+01 0.0000 22 AlO+ 0.70295E-09 -9.1531 0.55898E-09 -9.2526 0.79520E+00 -0.0995 23 AlOH+2 0.86063E-07 -7.0652 0.36784E-07 -7.4343 0.42741E+00 -0.3692 24 HAlO2,aq 0.83570E-11 -11.0779 0.83570E-11 -11.0779 0.10000E+01 0.0000 25 AlO2- 0.17706E-14 -14.7519 0.13998E-14 -14.8539 0.79059E+00 -0.1020 26 CH4,aq 0.66800E-08 -8.1752 0.63172E-08 -8.1995 0.94569E+00 -0.0242 27 C2H6,aq 0.13816E-17 -17.8596 0.13066E-17 -17.8839 0.94569E+00 -0.0242 31 CO,aq 0.51286E-10 -10.2900 0.51286E-10 -10.2900 0.10000E+01 0.0000 32 CO2,aq 0.41017E+00 -0.3870 0.38790E+00 -0.4113 0.94569E+00 -0.0242 33 CO3-2 0.20843E-12 -12.6811 0.90074E-13 -13.0454 0.43216E+00 -0.3644 34 CaCO3,aq 0.98181E-16 -16.0080 0.98181E-16 -16.0080 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.38029E-10 -10.4199 0.30241E-10 -10.5194 0.79520E+00 -0.0995 36 CaCl+ 0.51188E-08 -8.2908 0.40705E-08 -8.3904 0.79520E+00 -0.0995 37 CaCl2,aq 0.27981E-10 -10.5531 0.27981E-10 -10.5531 0.10000E+01 0.0000 38 CaF+ 0.43146E-10 -10.3651 0.34310E-10 -10.4646 0.79520E+00 -0.0995 39 CaOH+ 0.58489E-15 -15.2329 0.46510E-15 -15.3325 0.79520E+00 -0.0995 40 CaSO4,aq 0.41902E-13 -13.3778 0.41902E-13 -13.3778 0.10000E+01 0.0000 41 HCl,aq 0.70069E-04 -4.1545 0.70069E-04 -4.1545 0.10000E+01 0.0000 45 HF,aq 0.24456E-02 -2.6116 0.24456E-02 -2.6116 0.10000E+01 0.0000 46 HF2- 0.28154E-07 -7.5505 0.22321E-07 -7.6513 0.79282E+00 -0.1008 47 Fe+3 0.13945E-17 -17.8556 0.21620E-18 -18.6651 0.15504E+00 -0.8096 48 FeCl+ 0.83842E-09 -9.0765 0.66671E-09 -9.1761 0.79520E+00 -0.0995 49 FeCl2,aq 0.61075E-15 -15.2141 0.61075E-15 -15.2141 0.10000E+01 0.0000 50 FeCl+2 0.10457E-17 -17.9806 0.44696E-18 -18.3497 0.42741E+00 -0.3692 51 FeF+ 0.25289E-10 -10.5971 0.20110E-10 -10.6966 0.79520E+00 -0.0995 52 FeF+2 0.12187E-15 -15.9141 0.52089E-16 -16.2833 0.42741E+00 -0.3692 54 FeOH+ 0.44736E-13 -13.3493 0.35574E-13 -13.4489 0.79520E+00 -0.0995 56 FeO+ 0.14766E-17 -17.8307 0.11742E-17 -17.9303 0.79520E+00 -0.0995 57 FeOH+2 0.69336E-17 -17.1590 0.29635E-17 -17.5282 0.42741E+00 -0.3692 60 H2,aq 0.55215E-08 -8.2579 0.52216E-08 -8.2822 0.94569E+00 -0.0242 61 KCl,aq 0.58847E-07 -7.2303 0.58847E-07 -7.2303 0.10000E+01 0.0000 62 KHSO4,aq 0.63648E-14 -14.1962 0.63648E-14 -14.1962 0.10000E+01 0.0000 63 KOH,aq 0.35976E-14 -14.4440 0.35976E-14 -14.4440 0.10000E+01 0.0000 64 KSO4- 0.33340E-11 -11.4770 0.26433E-11 -11.5779 0.79282E+00 -0.1008 66 Mg(HCO3)+ 0.15547E-13 -13.8084 0.12363E-13 -13.9079 0.79520E+00 -0.0995 67 MgCl+ 0.18561E-11 -11.7314 0.14760E-11 -11.8309 0.79520E+00 -0.0995 68 MgF+ 0.63944E-13 -13.1942 0.50848E-13 -13.2937 0.79520E+00 -0.0995 69 MgOH+ 0.12949E-17 -17.8878 0.10297E-17 -17.9873 0.79520E+00 -0.0995 71 MnF+ 0.50212E-12 -12.2992 0.39929E-12 -12.3987 0.79520E+00 -0.0995 73 MnOH+ 0.25034E-15 -15.6015 0.19907E-15 -15.7010 0.79520E+00 -0.0995 78 MnCl+ 0.19649E-09 -9.7067 0.15624E-09 -9.8062 0.79520E+00 -0.0995 79 MnSO4,aq 0.38429E-15 -15.4153 0.38429E-15 -15.4153 0.10000E+01 0.0000 80 NaCl,aq 0.15109E-03 -3.8208 0.15109E-03 -3.8208 0.10000E+01 0.0000 81 NaF,aq 0.99720E-07 -7.0012 0.99720E-07 -7.0012 0.10000E+01 0.0000 82 NaOH,aq 0.50821E-12 -12.2940 0.50821E-12 -12.2940 0.10000E+01 0.0000 84 OH- 0.54863E-10 -10.2607 0.43374E-10 -10.3628 0.79059E+00 -0.1020 90 H3PO3,aq 0.17336E-19 -19.7611 0.17336E-19 -19.7611 0.10000E+01 0.0000 91 H2PO3- 0.14952E-19 -19.8253 0.11854E-19 -19.9261 0.79282E+00 -0.1008 92 H3PO4,aq 0.33313E-07 -7.4774 0.33313E-07 -7.4774 0.10000E+01 0.0000 93 H2PO4- 0.83737E-08 -8.0771 0.66488E-08 -8.1773 0.79401E+00 -0.1002 95 H4P2O7,aq 0.14748E-16 -16.8313 0.14748E-16 -16.8313 0.10000E+01 0.0000 96 H3P2O7- 0.17970E-16 -16.7454 0.14247E-16 -16.8463 0.79282E+00 -0.1008 97 H2P2O7-2 0.80844E-17 -17.0924 0.34938E-17 -17.4567 0.43216E+00 -0.3644 100 H2S,aq 0.31534E-01 -1.5012 0.29822E-01 -1.5255 0.94569E+00 -0.0242 101 S2-2 0.52346E-14 -14.2811 0.22622E-14 -14.6455 0.43216E+00 -0.3644 102 S3-2 0.40277E-13 -13.3949 0.17406E-13 -13.7593 0.43216E+00 -0.3644 103 S3- 0.26915E-08 -8.5700 0.21339E-08 -8.6708 0.79282E+00 -0.1008 104 S4-2 0.20472E-12 -12.6888 0.88471E-13 -13.0532 0.43216E+00 -0.3644 105 S5-2 0.69382E-12 -12.1588 0.29985E-12 -12.5231 0.43216E+00 -0.3644 106 SO2,aq 0.62810E-11 -11.2020 0.62810E-11 -11.2020 0.10000E+01 0.0000 107 SO3-2 0.23487E-17 -17.6292 0.10382E-17 -17.9837 0.44203E+00 -0.3546 108 HSO3- 0.10836E-11 -11.9651 0.85906E-12 -12.0660 0.79282E+00 -0.1008 109 HSO4- 0.24274E-07 -7.6149 0.19333E-07 -7.7137 0.79645E+00 -0.0988 111 S2O3-2 0.12402E-11 -11.9065 0.53599E-12 -12.2708 0.43216E+00 -0.3644 112 HS2O3- 0.15975E-11 -11.7966 0.12665E-11 -11.8974 0.79282E+00 -0.1008 113 H2S2O3,aq 0.26832E-12 -12.5713 0.26832E-12 -12.5713 0.10000E+01 0.0000 Charge balance for all species = -.5507E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1651152E-01 0.4607352E+00 0.4548166E+03 0.0000 2 H2O 0.1000000E+01 0.5509808E+02 0.9721387E+06 0.0000 3 Cl- 0.3649534E-01 0.3671656E-01 0.1274868E+04 0.3403 4 SO4-- 0.3500742E-08 0.2139637E-07 0.2012984E-02 -5.0609 5 HCO3- 0.1714988E-04 0.4101911E+00 0.2451257E+05 -2.9866 6 HS- 0.9207173E-06 0.3153490E-01 0.1021415E+04 -4.2577 7 Al+++ 0.4688412E-05 0.4775187E-05 0.1261847E+00 -0.5039 8 H4SiO4 0.1008511E-02 0.1008511E-02 0.9493447E+02 -2.9963 9 Ca++ 0.2028483E-06 0.2080763E-06 0.8167308E-02 -3.3030 10 Mg++ 0.8174476E-10 0.8368039E-10 0.1992483E-05 -6.7008 11 Fe++ 0.3415714E-07 0.3502089E-07 0.1915479E-02 -4.0791 12 K+ 0.1411657E-03 0.1412245E-03 0.5408282E+01 -2.0710 13 Na+ 0.1988027E-01 0.2003146E-01 0.4510223E+03 0.0764 14 Mn++ 0.2054873E-08 0.2251861E-08 0.1211615E-03 -5.2992 15 F- 0.3420633E-04 0.2480005E-02 0.4614353E+02 -2.6892 16 HPO4-- 0.6288225E-13 0.4168675E-07 0.3918542E-02 -9.8064 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6475574E+00 0.4607511E+00 0.1479498E+00 0.3885652E-01 2 H2O 0.5492234E+02 0.5509998E+02 -.1406488E+00 -.3699278E-01 3 Cl- 0.3671783E-01 0.3671783E-01 0.0000000E+00 0.9874033E-10 4 SO4-- 0.2958997E-01 0.2139711E-07 0.2958995E-01 -.8505957E-08 5 HCO3- 0.4482723E+00 0.4102053E+00 0.0000000E+00 0.3806709E-01 6 HS- 0.1210953E+00 0.3153599E-01 0.8876986E-01 0.7894460E-03 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1008546E-02 0.1114447E-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 0.3502210E-07 -.2429834E-08 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- 0.2480096E-02 0.2480091E-02 0.0000000E+00 0.4795618E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4605E-16 Mass of aqueous solution: 0.102109E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 6.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1074E-02 -2.969 0.1935E-01 -1.713 1.124 0.4266 CO2,gas 0.3807E-01 -1.419 1.675 0.224 97.31 20.50 CH4,gas 0.7158E-08 -8.145 0.1148E-06 -6.940 0.6669E-05 0.4621E-05 H2,gas 0.5331E-08 -8.273 0.1077E-07 -7.968 0.6255E-06 0.3396E-05 H2S,gas 0.7894E-03 -3.103 0.2690E-01 -1.570 1.563 0.4019 S2,gas 0.4287E-12 -12.368 0.2749E-10 -10.561 0.1597E-08 0.2660E-09 CO,gas 0.6104E-10 -10.214 0.1710E-08 -8.767 0.9930E-07 0.3787E-07 SO3,gas 0.8069E-31 -31.093 0.6460E-29 -29.190 0.3753E-27 0.5007E-28 SO2,gas 0.2169E-13 -13.664 0.1390E-11 -11.857 0.8071E-10 0.1346E-10 HF,gas 0.4796E-08 -8.319 0.9591E-07 -7.018 0.5571E-05 0.2976E-05 HCl,gas 0.9874E-10 -10.006 0.3600E-08 -8.444 0.2091E-06 0.6127E-07 pyrite -.2430E-08 1.000 -.2915E-06 1.000 -.6530E-05 -.5817E-07 quartz 0.1114E-01 -1.953 0.6696 -0.174 15.00 0.2529 sulfur 0.1184 -0.927 3.795 0.579 85.00 1.836 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9533E+00 0.4767E+02 0.8707 1.618 CH4,gas 0.1793E-06 0.8963E-05 1.0374 -5.032 H2,gas 0.1335E-06 0.6675E-05 1.0270 -5.164 H2S,gas 0.1977E-01 0.9885E+00 0.8293 -0.086 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1529E-08 0.7643E-07 1.0000 -7.117 SO3,gas 0.2021E-29 0.1010E-27 1.0000 -27.996 SO2,gas 0.5432E-12 0.2716E-10 1.0000 -10.566 HF,gas 0.1201E-06 0.6005E-05 1.0000 -5.221 HCl,gas 0.2473E-08 0.1236E-06 1.0000 -6.908 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 Current weight percent of gas: 0.167587 % Solid products produced: Mass = 4.464176 g Volume = 2.088663 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: 6.1999900 moles log = 0.7924 Original solution: 1000.0103000 g Original solution / Rock added: 161.29 (Water/Rock Ratio), log = 2.2076 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 1 H2O,gas 1.70 1.70 0.00 0.000 0.00000E+00 2 CO2,gas -6.66 -6.66 0.00 0.000 -0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 -0.60662E-11 7 CO,gas 3.21 3.21 0.00 0.000 -0.22748E-11 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 0.26539E-11 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-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 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 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 -0.51 -3.38 -0.564 0.57789E+04 69 diamond -3.10 -4.46 -1.36 -0.388 0.23190E+04 86 gibbsite 4.08 -0.51 -4.59 -0.656 0.78434E+04 89 graphite -3.55 -4.46 -0.91 -0.261 0.15612E+04 92 halite 1.57 -3.34 -4.92 -2.458 0.83934E+04 145 pyrite -21.25 -21.25 0.00 0.000 -0.60662E-11 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -16.90 -0.35 -0.039 0.60095E+03 237 boehmite 4.41 -0.51 -4.92 -0.820 0.83959E+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 = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 6.1999900 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5492E+02 kg total = 0.9894E+00 Activity = 0.9921 Stoichiometric ionic strength = .2524351E+00 Osmotic coef. = 0.9150 True ionic strength = .3656207E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3672E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.16512E-01 -1.7822 0.13215E-01 -1.8789 0.80038E+00 -0.0967 2 H2O 0.99211E+00 -0.0034 0.99211E+00 -0.0034 3 Cl- 0.36495E-01 -1.4378 0.28934E-01 -1.5386 0.79282E+00 -0.1008 4 SO4-- 0.35007E-08 -8.4558 0.15180E-08 -8.8187 0.43361E+00 -0.3629 5 HCO3- 0.17150E-04 -4.7657 0.13628E-04 -4.8656 0.79465E+00 -0.0998 6 HS- 0.92072E-06 -6.0359 0.73013E-06 -6.1366 0.79300E+00 -0.1007 7 Al+++ 0.46884E-05 -5.3290 0.72332E-06 -6.1407 0.15428E+00 -0.8117 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20285E-06 -6.6928 0.86930E-07 -7.0608 0.42855E+00 -0.3680 10 Mg++ 0.81745E-10 -10.0875 0.34779E-10 -10.4587 0.42546E+00 -0.3711 11 Fe++ 0.31787E-07 -7.4977 0.13548E-07 -7.8681 0.42619E+00 -0.3704 12 K+ 0.14117E-03 -3.8503 0.11222E-03 -3.9499 0.79493E+00 -0.0997 13 Na+ 0.19880E-01 -1.7016 0.15756E-01 -1.8025 0.79256E+00 -0.1010 14 Mn++ 0.20549E-08 -8.6872 0.87692E-09 -9.0570 0.42675E+00 -0.3698 15 F- 0.34206E-04 -4.4659 0.27033E-04 -4.5681 0.79029E+00 -0.1022 16 HPO4-- 0.62882E-13 -13.2015 0.27273E-13 -13.5643 0.43371E+00 -0.3628 17 SiF6-2 0.91079E-13 -13.0406 0.39361E-13 -13.4049 0.43216E+00 -0.3644 18 HSiO3- 0.90592E-10 -10.0429 0.71824E-10 -10.1437 0.79282E+00 -0.1008 19 Ca(HSiO3)+ 0.17881E-15 -15.7476 0.14219E-15 -15.8471 0.79520E+00 -0.0995 20 Mg(HSiO3)+ 0.89031E-19 -19.0505 0.70798E-19 -19.1500 0.79520E+00 -0.0995 21 NaHSiO3,aq 0.18303E-10 -10.7375 0.18303E-10 -10.7375 0.10000E+01 0.0000 22 AlO+ 0.70295E-09 -9.1531 0.55898E-09 -9.2526 0.79520E+00 -0.0995 23 AlOH+2 0.86063E-07 -7.0652 0.36784E-07 -7.4343 0.42741E+00 -0.3692 24 HAlO2,aq 0.83570E-11 -11.0779 0.83570E-11 -11.0779 0.10000E+01 0.0000 25 AlO2- 0.17706E-14 -14.7519 0.13998E-14 -14.8539 0.79059E+00 -0.1020 26 CH4,aq 0.66800E-08 -8.1752 0.63172E-08 -8.1995 0.94569E+00 -0.0242 27 C2H6,aq 0.13816E-17 -17.8596 0.13066E-17 -17.8839 0.94569E+00 -0.0242 31 CO,aq 0.51286E-10 -10.2900 0.51286E-10 -10.2900 0.10000E+01 0.0000 32 CO2,aq 0.41017E+00 -0.3870 0.38790E+00 -0.4113 0.94569E+00 -0.0242 33 CO3-2 0.20842E-12 -12.6811 0.90074E-13 -13.0454 0.43216E+00 -0.3644 34 CaCO3,aq 0.98181E-16 -16.0080 0.98181E-16 -16.0080 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.38029E-10 -10.4199 0.30241E-10 -10.5194 0.79520E+00 -0.0995 36 CaCl+ 0.51188E-08 -8.2908 0.40705E-08 -8.3904 0.79520E+00 -0.0995 37 CaCl2,aq 0.27981E-10 -10.5531 0.27981E-10 -10.5531 0.10000E+01 0.0000 38 CaF+ 0.43146E-10 -10.3651 0.34310E-10 -10.4646 0.79520E+00 -0.0995 39 CaOH+ 0.58489E-15 -15.2329 0.46510E-15 -15.3325 0.79520E+00 -0.0995 40 CaSO4,aq 0.41902E-13 -13.3778 0.41902E-13 -13.3778 0.10000E+01 0.0000 41 HCl,aq 0.70069E-04 -4.1545 0.70069E-04 -4.1545 0.10000E+01 0.0000 45 HF,aq 0.24456E-02 -2.6116 0.24456E-02 -2.6116 0.10000E+01 0.0000 46 HF2- 0.28154E-07 -7.5505 0.22321E-07 -7.6513 0.79282E+00 -0.1008 47 Fe+3 0.12978E-17 -17.8868 0.20120E-18 -18.6964 0.15504E+00 -0.8096 48 FeCl+ 0.78025E-09 -9.1078 0.62045E-09 -9.2073 0.79520E+00 -0.0995 49 FeCl2,aq 0.56837E-15 -15.2454 0.56837E-15 -15.2454 0.10000E+01 0.0000 50 FeCl+2 0.97319E-18 -18.0118 0.41595E-18 -18.3810 0.42741E+00 -0.3692 51 FeF+ 0.23535E-10 -10.6283 0.18715E-10 -10.7278 0.79520E+00 -0.0995 52 FeF+2 0.11342E-15 -15.9453 0.48475E-16 -16.3145 0.42741E+00 -0.3692 54 FeOH+ 0.41632E-13 -13.3806 0.33105E-13 -13.4801 0.79520E+00 -0.0995 56 FeO+ 0.13742E-17 -17.8620 0.10928E-17 -17.9615 0.79520E+00 -0.0995 57 FeOH+2 0.64525E-17 -17.1903 0.27579E-17 -17.5594 0.42741E+00 -0.3692 60 H2,aq 0.55215E-08 -8.2579 0.52216E-08 -8.2822 0.94569E+00 -0.0242 61 KCl,aq 0.58847E-07 -7.2303 0.58847E-07 -7.2303 0.10000E+01 0.0000 62 KHSO4,aq 0.63648E-14 -14.1962 0.63648E-14 -14.1962 0.10000E+01 0.0000 63 KOH,aq 0.35976E-14 -14.4440 0.35976E-14 -14.4440 0.10000E+01 0.0000 64 KSO4- 0.33340E-11 -11.4770 0.26433E-11 -11.5779 0.79282E+00 -0.1008 66 Mg(HCO3)+ 0.15547E-13 -13.8084 0.12363E-13 -13.9079 0.79520E+00 -0.0995 67 MgCl+ 0.18561E-11 -11.7314 0.14760E-11 -11.8309 0.79520E+00 -0.0995 68 MgF+ 0.63944E-13 -13.1942 0.50848E-13 -13.2937 0.79520E+00 -0.0995 69 MgOH+ 0.12949E-17 -17.8878 0.10297E-17 -17.9873 0.79520E+00 -0.0995 71 MnF+ 0.50212E-12 -12.2992 0.39929E-12 -12.3987 0.79520E+00 -0.0995 73 MnOH+ 0.25034E-15 -15.6015 0.19907E-15 -15.7010 0.79520E+00 -0.0995 78 MnCl+ 0.19649E-09 -9.7067 0.15624E-09 -9.8062 0.79520E+00 -0.0995 79 MnSO4,aq 0.38429E-15 -15.4153 0.38429E-15 -15.4153 0.10000E+01 0.0000 80 NaCl,aq 0.15109E-03 -3.8208 0.15109E-03 -3.8208 0.10000E+01 0.0000 81 NaF,aq 0.99720E-07 -7.0012 0.99720E-07 -7.0012 0.10000E+01 0.0000 82 NaOH,aq 0.50821E-12 -12.2940 0.50821E-12 -12.2940 0.10000E+01 0.0000 84 OH- 0.54863E-10 -10.2607 0.43374E-10 -10.3628 0.79059E+00 -0.1020 90 H3PO3,aq 0.17336E-19 -19.7611 0.17336E-19 -19.7611 0.10000E+01 0.0000 91 H2PO3- 0.14952E-19 -19.8253 0.11854E-19 -19.9261 0.79282E+00 -0.1008 92 H3PO4,aq 0.33313E-07 -7.4774 0.33313E-07 -7.4774 0.10000E+01 0.0000 93 H2PO4- 0.83737E-08 -8.0771 0.66488E-08 -8.1773 0.79401E+00 -0.1002 95 H4P2O7,aq 0.14748E-16 -16.8313 0.14748E-16 -16.8313 0.10000E+01 0.0000 96 H3P2O7- 0.17970E-16 -16.7454 0.14247E-16 -16.8463 0.79282E+00 -0.1008 97 H2P2O7-2 0.80844E-17 -17.0924 0.34938E-17 -17.4567 0.43216E+00 -0.3644 100 H2S,aq 0.31534E-01 -1.5012 0.29822E-01 -1.5255 0.94569E+00 -0.0242 101 S2-2 0.52346E-14 -14.2811 0.22622E-14 -14.6455 0.43216E+00 -0.3644 102 S3-2 0.40277E-13 -13.3949 0.17406E-13 -13.7593 0.43216E+00 -0.3644 103 S3- 0.26915E-08 -8.5700 0.21339E-08 -8.6708 0.79282E+00 -0.1008 104 S4-2 0.20472E-12 -12.6888 0.88471E-13 -13.0532 0.43216E+00 -0.3644 105 S5-2 0.69382E-12 -12.1588 0.29985E-12 -12.5231 0.43216E+00 -0.3644 106 SO2,aq 0.62810E-11 -11.2020 0.62810E-11 -11.2020 0.10000E+01 0.0000 107 SO3-2 0.23487E-17 -17.6292 0.10382E-17 -17.9837 0.44203E+00 -0.3546 108 HSO3- 0.10836E-11 -11.9651 0.85906E-12 -12.0660 0.79282E+00 -0.1008 109 HSO4- 0.24274E-07 -7.6149 0.19333E-07 -7.7137 0.79645E+00 -0.0988 111 S2O3-2 0.12402E-11 -11.9065 0.53599E-12 -12.2708 0.43216E+00 -0.3644 112 HS2O3- 0.15975E-11 -11.7966 0.12665E-11 -11.8974 0.79282E+00 -0.1008 113 H2S2O3,aq 0.26832E-12 -12.5713 0.26832E-12 -12.5713 0.10000E+01 0.0000 Charge balance for all species = -.5507E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1651152E-01 0.4607352E+00 0.4548166E+03 0.0000 2 H2O 0.1000000E+01 0.5509808E+02 0.9721387E+06 0.0000 3 Cl- 0.3649534E-01 0.3671656E-01 0.1274868E+04 0.3403 4 SO4-- 0.3500741E-08 0.2139637E-07 0.2012984E-02 -5.0609 5 HCO3- 0.1714987E-04 0.4101911E+00 0.2451257E+05 -2.9866 6 HS- 0.9207169E-06 0.3153489E-01 0.1021415E+04 -4.2577 7 Al+++ 0.4688412E-05 0.4775187E-05 0.1261847E+00 -0.5039 8 H4SiO4 0.1008511E-02 0.1008511E-02 0.9493447E+02 -2.9963 9 Ca++ 0.2028483E-06 0.2080763E-06 0.8167308E-02 -3.3030 10 Mg++ 0.8174476E-10 0.8368039E-10 0.1992483E-05 -6.7008 11 Fe++ 0.3178732E-07 0.3259114E-07 0.1782583E-02 -4.1103 12 K+ 0.1411657E-03 0.1412245E-03 0.5408282E+01 -2.0710 13 Na+ 0.1988027E-01 0.2003146E-01 0.4510223E+03 0.0764 14 Mn++ 0.2054873E-08 0.2251861E-08 0.1211615E-03 -5.2992 15 F- 0.3420632E-04 0.2480005E-02 0.4614353E+02 -2.6892 16 HPO4-- 0.6288221E-13 0.4168675E-07 0.3918542E-02 -9.8064 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6475574E+00 0.4607511E+00 0.1479498E+00 0.3885652E-01 2 H2O 0.5492234E+02 0.5509998E+02 -.1406488E+00 -.3699278E-01 3 Cl- 0.3671783E-01 0.3671783E-01 0.0000000E+00 0.9874036E-10 4 SO4-- 0.2958997E-01 0.2139711E-07 0.2958995E-01 -.8505955E-08 5 HCO3- 0.4482723E+00 0.4102053E+00 0.0000000E+00 0.3806709E-01 6 HS- 0.1210953E+00 0.3153599E-01 0.8876986E-01 0.7894459E-03 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1008546E-02 0.1114447E-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 0.3259227E-07 0.0000000E+00 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- 0.2480096E-02 0.2480091E-02 0.0000000E+00 0.4795618E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1437E-16 Mass of aqueous solution: 0.102109E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 6.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1074E-02 -2.969 0.1935E-01 -1.713 1.124 0.4266 CO2,gas 0.3807E-01 -1.419 1.675 0.224 97.31 20.50 CH4,gas 0.7158E-08 -8.145 0.1148E-06 -6.940 0.6669E-05 0.4621E-05 H2,gas 0.5331E-08 -8.273 0.1077E-07 -7.968 0.6255E-06 0.3396E-05 H2S,gas 0.7894E-03 -3.103 0.2690E-01 -1.570 1.563 0.4019 S2,gas 0.4287E-12 -12.368 0.2749E-10 -10.561 0.1597E-08 0.2660E-09 CO,gas 0.6104E-10 -10.214 0.1710E-08 -8.767 0.9930E-07 0.3787E-07 SO3,gas 0.8069E-31 -31.093 0.6460E-29 -29.190 0.3753E-27 0.5007E-28 SO2,gas 0.2169E-13 -13.664 0.1390E-11 -11.857 0.8071E-10 0.1346E-10 HF,gas 0.4796E-08 -8.319 0.9591E-07 -7.018 0.5571E-05 0.2976E-05 HCl,gas 0.9874E-10 -10.006 0.3600E-08 -8.444 0.2091E-06 0.6127E-07 quartz 0.1114E-01 -1.953 0.6696 -0.174 15.00 0.2529 sulfur 0.1184 -0.927 3.795 0.579 85.00 1.836 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9533E+00 0.4767E+02 0.8707 1.618 CH4,gas 0.1793E-06 0.8963E-05 1.0374 -5.032 H2,gas 0.1335E-06 0.6675E-05 1.0270 -5.164 H2S,gas 0.1977E-01 0.9885E+00 0.8293 -0.086 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1529E-08 0.7643E-07 1.0000 -7.117 SO3,gas 0.2021E-29 0.1010E-27 1.0000 -27.996 SO2,gas 0.5432E-12 0.2716E-10 1.0000 -10.566 HF,gas 0.1201E-06 0.6005E-05 1.0000 -5.221 HCl,gas 0.2473E-08 0.1236E-06 1.0000 -6.908 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.167587 % Solid products produced: Mass = 4.464176 g Volume = 2.088663 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: 6.1999900 moles log = 0.7924 Original solution: 1000.0103000 g Original solution / Rock added: 161.29 (Water/Rock Ratio), log = 2.2076 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 -0.15165E-11 5 H2S,gas -6.23 -6.23 0.00 0.000 0.00000E+00 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 -0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 -0.34122E-11 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-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 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 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 -0.51 -3.38 -0.564 0.57789E+04 69 diamond -3.10 -4.46 -1.36 -0.388 0.23190E+04 86 gibbsite 4.08 -0.51 -4.59 -0.656 0.78434E+04 89 graphite -3.55 -4.46 -0.91 -0.261 0.15612E+04 92 halite 1.57 -3.34 -4.92 -2.458 0.83934E+04 145 pyrite -21.25 -21.28 -0.03 -0.007 0.53321E+02 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -16.90 -0.35 -0.039 0.60095E+03 237 boehmite 4.41 -0.51 -4.92 -0.820 0.83959E+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: 0.2000000 MOLES Current total amount of reactant added: 6.1999900 MOLES New total amount of reactant added: 6.3999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 6.3999900 Water: Moles liquid = 0.5569E+02 kg liquid = 0.1003E+01 Moles total = 0.5509E+02 kg total = 0.9924E+00 Activity = 0.9921 Stoichiometric ionic strength = .2532288E+00 Osmotic coef. = 0.9150 True ionic strength = .3760664E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3790E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.17625E-01 -1.7539 0.14077E-01 -1.8515 0.79872E+00 -0.0976 2 H2O 0.99210E+00 -0.0034 0.99210E+00 -0.0034 3 Cl- 0.37542E-01 -1.4255 0.29697E-01 -1.5273 0.79102E+00 -0.1018 4 SO4-- 0.29319E-08 -8.5329 0.12601E-08 -8.8996 0.42980E+00 -0.3667 5 HCO3- 0.16129E-04 -4.7924 0.12788E-04 -4.8932 0.79289E+00 -0.1008 6 HS- 0.88373E-06 -6.0537 0.69921E-06 -6.1554 0.79121E+00 -0.1017 7 Al+++ 0.46793E-05 -5.3298 0.70739E-06 -6.1503 0.15118E+00 -0.8205 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20209E-06 -6.6944 0.85823E-07 -7.0664 0.42467E+00 -0.3719 10 Mg++ 0.81447E-10 -10.0891 0.34334E-10 -10.4643 0.42155E+00 -0.3752 11 Fe++ 0.31670E-07 -7.4994 0.13374E-07 -7.8737 0.42229E+00 -0.3744 12 K+ 0.14070E-03 -3.8517 0.11160E-03 -3.9523 0.79317E+00 -0.1006 13 Na+ 0.19812E-01 -1.7031 0.15666E-01 -1.8050 0.79075E+00 -0.1020 14 Mn++ 0.20448E-08 -8.6894 0.86463E-09 -9.0632 0.42285E+00 -0.3738 15 F- 0.33144E-04 -4.4796 0.26132E-04 -4.5828 0.78845E+00 -0.1032 16 HPO4-- 0.56396E-13 -13.2487 0.24245E-13 -13.6154 0.42990E+00 -0.3666 17 SiF6-2 0.96550E-13 -13.0152 0.41356E-13 -13.3835 0.42833E+00 -0.3682 18 HSiO3- 0.85238E-10 -10.0694 0.67425E-10 -10.1712 0.79102E+00 -0.1018 19 Ca(HSiO3)+ 0.16609E-15 -15.7797 0.13178E-15 -15.8801 0.79344E+00 -0.1005 20 Mg(HSiO3)+ 0.82692E-19 -19.0825 0.65611E-19 -19.1830 0.79344E+00 -0.1005 21 NaHSiO3,aq 0.17084E-10 -10.7674 0.17084E-10 -10.7674 0.10000E+01 0.0000 22 AlO+ 0.60720E-09 -9.2167 0.48178E-09 -9.3172 0.79344E+00 -0.1005 23 AlOH+2 0.79739E-07 -7.0983 0.33771E-07 -7.4715 0.42352E+00 -0.3731 24 HAlO2,aq 0.67616E-11 -11.1699 0.67616E-11 -11.1699 0.10000E+01 0.0000 25 AlO2- 0.13480E-14 -14.8703 0.10632E-14 -14.9734 0.78876E+00 -0.1031 26 CH4,aq 0.72320E-08 -8.1407 0.68384E-08 -8.1650 0.94558E+00 -0.0243 27 C2H6,aq 0.15872E-17 -17.7994 0.15008E-17 -17.8237 0.94558E+00 -0.0243 31 CO,aq 0.52297E-10 -10.2815 0.52297E-10 -10.2815 0.10000E+01 0.0000 32 CO2,aq 0.41005E+00 -0.3872 0.38774E+00 -0.4115 0.94558E+00 -0.0243 33 CO3-2 0.18525E-12 -12.7323 0.79347E-13 -13.1005 0.42833E+00 -0.3682 34 CaCO3,aq 0.85387E-16 -16.0686 0.85387E-16 -16.0686 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.35309E-10 -10.4521 0.28016E-10 -10.5526 0.79344E+00 -0.1005 36 CaCl+ 0.51983E-08 -8.2841 0.41245E-08 -8.3846 0.79344E+00 -0.1005 37 CaCl2,aq 0.29100E-10 -10.5361 0.29100E-10 -10.5361 0.10000E+01 0.0000 38 CaF+ 0.41269E-10 -10.3844 0.32744E-10 -10.4849 0.79344E+00 -0.1005 39 CaOH+ 0.54328E-15 -15.2650 0.43106E-15 -15.3655 0.79344E+00 -0.1005 40 CaSO4,aq 0.34342E-13 -13.4642 0.34342E-13 -13.4642 0.10000E+01 0.0000 41 HCl,aq 0.76606E-04 -4.1157 0.76606E-04 -4.1157 0.10000E+01 0.0000 45 HF,aq 0.25184E-02 -2.5989 0.25184E-02 -2.5989 0.10000E+01 0.0000 46 HF2- 0.28089E-07 -7.5515 0.22219E-07 -7.6533 0.79102E+00 -0.1018 47 Fe+3 0.13788E-17 -17.8605 0.20948E-18 -18.6789 0.15193E+00 -0.8183 48 FeCl+ 0.79229E-09 -9.1011 0.62864E-09 -9.2016 0.79344E+00 -0.1005 49 FeCl2,aq 0.59105E-15 -15.2284 0.59105E-15 -15.2284 0.10000E+01 0.0000 50 FeCl+2 0.10495E-17 -17.9790 0.44448E-18 -18.3521 0.42352E+00 -0.3731 51 FeF+ 0.22509E-10 -10.6476 0.17859E-10 -10.7481 0.79344E+00 -0.1005 52 FeF+2 0.11520E-15 -15.9386 0.48789E-16 -16.3117 0.42352E+00 -0.3731 54 FeOH+ 0.38667E-13 -13.4127 0.30680E-13 -13.5131 0.79344E+00 -0.1005 56 FeO+ 0.12637E-17 -17.8984 0.10027E-17 -17.9988 0.79344E+00 -0.1005 57 FeOH+2 0.63646E-17 -17.1962 0.26955E-17 -17.5694 0.42352E+00 -0.3731 60 H2,aq 0.56332E-08 -8.2492 0.53267E-08 -8.2735 0.94558E+00 -0.0243 61 KCl,aq 0.60067E-07 -7.2214 0.60067E-07 -7.2214 0.10000E+01 0.0000 62 KHSO4,aq 0.55974E-14 -14.2520 0.55974E-14 -14.2520 0.10000E+01 0.0000 63 KOH,aq 0.33588E-14 -14.4738 0.33588E-14 -14.4738 0.10000E+01 0.0000 64 KSO4- 0.27588E-11 -11.5593 0.21822E-11 -11.6611 0.79102E+00 -0.1018 66 Mg(HCO3)+ 0.14434E-13 -13.8406 0.11452E-13 -13.9411 0.79344E+00 -0.1005 67 MgCl+ 0.18848E-11 -11.7247 0.14955E-11 -11.8252 0.79344E+00 -0.1005 68 MgF+ 0.61157E-13 -13.2136 0.48524E-13 -13.3140 0.79344E+00 -0.1005 69 MgOH+ 0.12027E-17 -17.9199 0.95423E-18 -18.0203 0.79344E+00 -0.1005 71 MnF+ 0.47965E-12 -12.3191 0.38058E-12 -12.4196 0.79344E+00 -0.1005 73 MnOH+ 0.23223E-15 -15.6341 0.18426E-15 -15.7346 0.79344E+00 -0.1005 78 MnCl+ 0.19928E-09 -9.7005 0.15812E-09 -9.8010 0.79344E+00 -0.1005 79 MnSO4,aq 0.31454E-15 -15.5023 0.31454E-15 -15.5023 0.10000E+01 0.0000 80 NaCl,aq 0.15418E-03 -3.8120 0.15418E-03 -3.8120 0.10000E+01 0.0000 81 NaF,aq 0.95847E-07 -7.0184 0.95847E-07 -7.0184 0.10000E+01 0.0000 82 NaOH,aq 0.47436E-12 -12.3239 0.47436E-12 -12.3239 0.10000E+01 0.0000 84 OH- 0.51623E-10 -10.2872 0.40718E-10 -10.3902 0.78876E+00 -0.1031 90 H3PO3,aq 0.17839E-19 -19.7486 0.17839E-19 -19.7486 0.10000E+01 0.0000 91 H2PO3- 0.14477E-19 -19.8393 0.11452E-19 -19.9411 0.79102E+00 -0.1018 92 H3PO4,aq 0.33603E-07 -7.4736 0.33603E-07 -7.4736 0.10000E+01 0.0000 93 H2PO4- 0.79473E-08 -8.0998 0.62961E-08 -8.2009 0.79223E+00 -0.1011 95 H4P2O7,aq 0.15006E-16 -16.8237 0.15006E-16 -16.8237 0.10000E+01 0.0000 96 H3P2O7- 0.17205E-16 -16.7644 0.13609E-16 -16.8662 0.79102E+00 -0.1018 97 H2P2O7-2 0.73144E-17 -17.1358 0.31330E-17 -17.5040 0.42833E+00 -0.3682 100 H2S,aq 0.32172E-01 -1.4925 0.30421E-01 -1.5168 0.94558E+00 -0.0243 101 S2-2 0.47480E-14 -14.3235 0.20337E-14 -14.6917 0.42833E+00 -0.3682 102 S3-2 0.36533E-13 -13.4373 0.15648E-13 -13.8055 0.42833E+00 -0.3682 103 S3- 0.25578E-08 -8.5921 0.20233E-08 -8.6940 0.79102E+00 -0.1018 104 S4-2 0.18569E-12 -12.7312 0.79537E-13 -13.0994 0.42833E+00 -0.3682 105 S5-2 0.62934E-12 -12.2011 0.26957E-12 -12.5693 0.42833E+00 -0.3682 106 SO2,aq 0.60356E-11 -11.2193 0.60356E-11 -11.2193 0.10000E+01 0.0000 107 SO3-2 0.20059E-17 -17.6977 0.87920E-18 -18.0559 0.43831E+00 -0.3582 108 HSO3- 0.97967E-12 -12.0089 0.77495E-12 -12.1107 0.79102E+00 -0.1018 109 HSO4- 0.21512E-07 -7.6673 0.17096E-07 -7.7671 0.79472E+00 -0.0998 111 S2O3-2 0.10597E-11 -11.9748 0.45390E-12 -12.3430 0.42833E+00 -0.3682 112 HS2O3- 0.14443E-11 -11.8403 0.11425E-11 -11.9421 0.79102E+00 -0.1018 113 H2S2O3,aq 0.25784E-12 -12.5887 0.25784E-12 -12.5887 0.10000E+01 0.0000 Charge balance for all species = -.5489E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1762505E-01 0.4624439E+00 0.4564789E+03 0.0000 2 H2O 0.1000000E+01 0.5509820E+02 0.9720887E+06 0.0000 3 Cl- 0.3754206E-01 0.3777291E-01 0.1311476E+04 0.3242 4 SO4-- 0.2931882E-08 0.1740031E-07 0.1636944E-02 -5.1966 5 HCO3- 0.1612870E-04 0.4100677E+00 0.2450388E+05 -3.0417 6 HS- 0.8837285E-06 0.3217310E-01 0.1042030E+04 -4.3039 7 Al+++ 0.4679259E-05 0.4759612E-05 0.1257664E+00 -0.5959 8 H4SiO4 0.1008492E-02 0.1008492E-02 0.9492762E+02 -2.9963 9 Ca++ 0.2020937E-06 0.2073977E-06 0.8140234E-02 -3.3634 10 Mg++ 0.8144705E-10 0.8340746E-10 0.1985878E-05 -6.7613 11 Fe++ 0.3167000E-07 0.3248485E-07 0.1776674E-02 -4.1708 12 K+ 0.1407038E-03 0.1407639E-03 0.5390354E+01 -2.1009 13 Na+ 0.1981185E-01 0.1996612E-01 0.4495272E+03 0.0464 14 Mn++ 0.2044758E-08 0.2244517E-08 0.1207599E-03 -5.3602 15 F- 0.3314372E-04 0.2551651E-02 0.4747404E+02 -2.7313 16 HPO4-- 0.5639632E-13 0.4155079E-07 0.3905552E-02 -9.9124 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6690924E+00 0.4639731E+00 0.1527248E+00 0.5239444E-01 2 H2O 0.5508608E+02 0.5528040E+02 -.1444622E+00 -.4985995E-01 3 Cl- 0.3789783E-01 0.3789783E-01 0.0000000E+00 0.1455635E-09 4 SO4-- 0.3054497E-01 0.1745785E-07 0.3054496E-01 -.1230238E-07 5 HCO3- 0.4627323E+00 0.4114238E+00 0.0000000E+00 0.5130855E-01 6 HS- 0.1250003E+00 0.3227950E-01 0.9163489E-01 0.1085912E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1011827E-02 0.1114119E-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 0.3259227E-07 0.0000000E+00 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- 0.2560096E-02 0.2560089E-02 0.0000000E+00 0.6658705E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1139E-16 Mass of aqueous solution: 0.102449E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 6.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1449E-02 -2.839 0.2609E-01 -1.584 1.124 0.5752 CO2,gas 0.5131E-01 -1.290 2.258 0.354 97.28 27.63 CH4,gas 0.1045E-07 -7.981 0.1676E-06 -6.776 0.7220E-05 0.6745E-05 H2,gas 0.7333E-08 -8.135 0.1481E-07 -7.829 0.6381E-06 0.4671E-05 H2S,gas 0.1086E-02 -2.964 0.3701E-01 -1.432 1.594 0.5528 S2,gas 0.5780E-12 -12.238 0.3706E-10 -10.431 0.1597E-08 0.3587E-09 CO,gas 0.8392E-10 -10.076 0.2351E-08 -8.629 0.1013E-06 0.5207E-07 SO3,gas 0.1025E-30 -30.989 0.8206E-29 -29.086 0.3535E-27 0.6359E-28 SO2,gas 0.2811E-13 -13.551 0.1801E-11 -11.745 0.7757E-10 0.1744E-10 HF,gas 0.6659E-08 -8.177 0.1332E-06 -6.876 0.5737E-05 0.4132E-05 HCl,gas 0.1456E-09 -9.837 0.5307E-08 -8.275 0.2286E-06 0.9032E-07 quartz 0.1114E-01 -1.953 0.6694 -0.174 14.59 0.2528 sulfur 0.1222 -0.913 3.917 0.593 85.41 1.895 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9529E+00 0.4765E+02 0.8707 1.618 CH4,gas 0.1941E-06 0.9703E-05 1.0374 -4.997 H2,gas 0.1362E-06 0.6809E-05 1.0270 -5.155 H2S,gas 0.2017E-01 0.1008E+01 0.8293 -0.078 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1559E-08 0.7793E-07 1.0000 -7.108 SO3,gas 0.1903E-29 0.9517E-28 1.0000 -28.021 SO2,gas 0.5220E-12 0.2610E-10 1.0000 -10.583 HF,gas 0.1237E-06 0.6183E-05 1.0000 -5.209 HCl,gas 0.2703E-08 0.1352E-06 1.0000 -6.869 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.225053 % Solid products produced: Mass = 4.586449 g Volume = 2.147839 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: 6.3999900 moles log = 0.8062 Original solution: 1000.0103000 g Original solution / Rock added: 156.25 (Water/Rock Ratio), log = 2.1938 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 1 H2O,gas 1.70 1.70 0.00 0.000 0.00000E+00 2 CO2,gas -6.66 -6.66 0.00 0.000 0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.00000E+00 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 -0.11374E-11 11 HCl,gas 5.19 5.19 0.00 0.000 -0.15165E-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 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 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 -0.60 -3.48 -0.579 0.59360E+04 69 diamond -3.10 -4.44 -1.34 -0.383 0.22897E+04 86 gibbsite 4.08 -0.61 -4.69 -0.669 0.80005E+04 89 graphite -3.55 -4.44 -0.90 -0.256 0.15320E+04 92 halite 1.57 -3.33 -4.91 -2.453 0.83784E+04 145 pyrite -21.25 -21.33 -0.08 -0.020 0.14182E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.06 -0.51 -0.057 0.87166E+03 245 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: 0.2000000 MOLES Current total amount of reactant added: 6.3999900 MOLES New total amount of reactant added: 6.5999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 6.5999900 Water: Moles liquid = 0.5587E+02 kg liquid = 0.1007E+01 Moles total = 0.5525E+02 kg total = 0.9953E+00 Activity = 0.9921 Stoichiometric ionic strength = .2540135E+00 Osmotic coef. = 0.9150 True ionic strength = .3864449E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.3908E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18731E-01 -1.7274 0.14931E-01 -1.8259 0.79711E+00 -0.0985 2 H2O 0.99209E+00 -0.0035 0.99209E+00 -0.0035 3 Cl- 0.38582E-01 -1.4136 0.30452E-01 -1.5164 0.78928E+00 -0.1028 4 SO4-- 0.24825E-08 -8.6051 0.10578E-08 -8.9756 0.42611E+00 -0.3705 5 HCO3- 0.15233E-04 -4.8172 0.12052E-04 -4.9189 0.79118E+00 -0.1017 6 HS- 0.85114E-06 -6.0700 0.67195E-06 -6.1727 0.78947E+00 -0.1027 7 Al+++ 0.46694E-05 -5.3307 0.69208E-06 -6.1598 0.14822E+00 -0.8291 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20135E-06 -6.6961 0.84752E-07 -7.0718 0.42093E+00 -0.3758 10 Mg++ 0.81152E-10 -10.0907 0.33903E-10 -10.4698 0.41777E+00 -0.3791 11 Fe++ 0.31554E-07 -7.5010 0.13206E-07 -7.8792 0.41852E+00 -0.3783 12 K+ 0.14025E-03 -3.8531 0.11100E-03 -3.9547 0.79146E+00 -0.1016 13 Na+ 0.19744E-01 -1.7046 0.15578E-01 -1.8075 0.78900E+00 -0.1029 14 Mn++ 0.20348E-08 -8.6915 0.85276E-09 -9.0692 0.41909E+00 -0.3777 15 F- 0.32217E-04 -4.4919 0.25344E-04 -4.5961 0.78666E+00 -0.1042 16 HPO4-- 0.50939E-13 -13.2930 0.21711E-13 -13.6633 0.42621E+00 -0.3704 17 SiF6-2 0.10256E-12 -12.9890 0.43549E-13 -13.3610 0.42464E+00 -0.3720 18 HSiO3- 0.80542E-10 -10.0940 0.63570E-10 -10.1967 0.78928E+00 -0.1028 19 Ca(HSiO3)+ 0.15497E-15 -15.8097 0.12270E-15 -15.9112 0.79174E+00 -0.1014 20 Mg(HSiO3)+ 0.77152E-19 -19.1127 0.61084E-19 -19.2141 0.79174E+00 -0.1014 21 NaHSiO3,aq 0.16017E-10 -10.7954 0.16017E-10 -10.7954 0.10000E+01 0.0000 22 AlO+ 0.52921E-09 -9.2764 0.41900E-09 -9.3778 0.79174E+00 -0.1014 23 AlOH+2 0.74211E-07 -7.1295 0.31151E-07 -7.5065 0.41976E+00 -0.3770 24 HAlO2,aq 0.55443E-11 -11.2561 0.55443E-11 -11.2561 0.10000E+01 0.0000 25 AlO2- 0.10445E-14 -14.9811 0.82198E-15 -15.0851 0.78698E+00 -0.1040 26 CH4,aq 0.78033E-08 -8.1077 0.73778E-08 -8.1321 0.94547E+00 -0.0244 27 C2H6,aq 0.18128E-17 -17.7416 0.17140E-17 -17.7660 0.94547E+00 -0.0244 31 CO,aq 0.53283E-10 -10.2734 0.53283E-10 -10.2734 0.10000E+01 0.0000 32 CO2,aq 0.40993E+00 -0.3873 0.38758E+00 -0.4116 0.94547E+00 -0.0244 33 CO3-2 0.16604E-12 -12.7798 0.70506E-13 -13.1518 0.42464E+00 -0.3720 34 CaCO3,aq 0.74926E-16 -16.1254 0.74926E-16 -16.1254 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.32932E-10 -10.4824 0.26074E-10 -10.5838 0.79174E+00 -0.1014 36 CaCl+ 0.52753E-08 -8.2778 0.41766E-08 -8.3792 0.79174E+00 -0.1014 37 CaCl2,aq 0.30217E-10 -10.5198 0.30217E-10 -10.5198 0.10000E+01 0.0000 38 CaF+ 0.39609E-10 -10.4022 0.31360E-10 -10.5036 0.79174E+00 -0.1014 39 CaOH+ 0.50692E-15 -15.2951 0.40134E-15 -15.3965 0.79174E+00 -0.1014 40 CaSO4,aq 0.28469E-13 -13.5456 0.28469E-13 -13.5456 0.10000E+01 0.0000 41 HCl,aq 0.83317E-04 -4.0793 0.83317E-04 -4.0793 0.10000E+01 0.0000 45 HF,aq 0.25905E-02 -2.5866 0.25905E-02 -2.5866 0.10000E+01 0.0000 46 HF2- 0.28084E-07 -7.5515 0.22166E-07 -7.6543 0.78928E+00 -0.1028 47 Fe+3 0.14587E-17 -17.8360 0.21731E-18 -18.6629 0.14897E+00 -0.8269 48 FeCl+ 0.80396E-09 -9.0948 0.63653E-09 -9.1962 0.79174E+00 -0.1014 49 FeCl2,aq 0.61368E-15 -15.2121 0.61368E-15 -15.2121 0.10000E+01 0.0000 50 FeCl+2 0.11264E-17 -17.9483 0.47281E-18 -18.3253 0.41976E+00 -0.3770 51 FeF+ 0.21602E-10 -10.6655 0.17103E-10 -10.7669 0.79174E+00 -0.1014 52 FeF+2 0.11693E-15 -15.9321 0.49085E-16 -16.3091 0.41976E+00 -0.3770 54 FeOH+ 0.36076E-13 -13.4428 0.28563E-13 -13.5442 0.79174E+00 -0.1014 56 FeO+ 0.11678E-17 -17.9326 0.92460E-18 -18.0340 0.79174E+00 -0.1014 57 FeOH+2 0.62806E-17 -17.2020 0.26364E-17 -17.5790 0.41976E+00 -0.3770 60 H2,aq 0.57424E-08 -8.2409 0.54293E-08 -8.2653 0.94547E+00 -0.0244 61 KCl,aq 0.61261E-07 -7.2128 0.61261E-07 -7.2128 0.10000E+01 0.0000 62 KHSO4,aq 0.49567E-14 -14.3048 0.49567E-14 -14.3048 0.10000E+01 0.0000 63 KOH,aq 0.31497E-14 -14.5017 0.31497E-14 -14.5017 0.10000E+01 0.0000 64 KSO4- 0.23084E-11 -11.6367 0.18220E-11 -11.7394 0.78928E+00 -0.1028 66 Mg(HCO3)+ 0.13461E-13 -13.8709 0.10658E-13 -13.9723 0.79174E+00 -0.1014 67 MgCl+ 0.19126E-11 -11.7184 0.15143E-11 -11.8198 0.79174E+00 -0.1014 68 MgF+ 0.58694E-13 -13.2314 0.46470E-13 -13.3328 0.79174E+00 -0.1014 69 MgOH+ 0.11221E-17 -17.9500 0.88839E-18 -18.0514 0.79174E+00 -0.1014 71 MnF+ 0.45979E-12 -12.3374 0.36403E-12 -12.4389 0.79174E+00 -0.1014 73 MnOH+ 0.21641E-15 -15.6647 0.17134E-15 -15.7661 0.79174E+00 -0.1014 78 MnCl+ 0.20197E-09 -9.6947 0.15991E-09 -9.7961 0.79174E+00 -0.1014 79 MnSO4,aq 0.26042E-15 -15.5843 0.26042E-15 -15.5843 0.10000E+01 0.0000 80 NaCl,aq 0.15721E-03 -3.8035 0.15721E-03 -3.8035 0.10000E+01 0.0000 81 NaF,aq 0.92431E-07 -7.0342 0.92431E-07 -7.0342 0.10000E+01 0.0000 82 NaOH,aq 0.44472E-12 -12.3519 0.44472E-12 -12.3519 0.10000E+01 0.0000 84 OH- 0.48782E-10 -10.3117 0.38390E-10 -10.4158 0.78698E+00 -0.1040 90 H3PO3,aq 0.18317E-19 -19.7372 0.18317E-19 -19.7372 0.10000E+01 0.0000 91 H2PO3- 0.14046E-19 -19.8525 0.11086E-19 -19.9552 0.78928E+00 -0.1028 92 H3PO4,aq 0.33851E-07 -7.4704 0.33851E-07 -7.4704 0.10000E+01 0.0000 93 H2PO4- 0.75647E-08 -8.1212 0.59799E-08 -8.2233 0.79051E+00 -0.1021 95 H4P2O7,aq 0.15228E-16 -16.8174 0.15228E-16 -16.8174 0.10000E+01 0.0000 96 H3P2O7- 0.16498E-16 -16.7826 0.13021E-16 -16.8853 0.78928E+00 -0.1028 97 H2P2O7-2 0.66557E-17 -17.1768 0.28263E-17 -17.5488 0.42464E+00 -0.3720 100 H2S,aq 0.32796E-01 -1.4842 0.31007E-01 -1.5085 0.94547E+00 -0.0244 101 S2-2 0.43395E-14 -14.3626 0.18427E-14 -14.7345 0.42464E+00 -0.3720 102 S3-2 0.33390E-13 -13.4764 0.14179E-13 -13.8484 0.42464E+00 -0.3720 103 S3- 0.24401E-08 -8.6126 0.19259E-08 -8.7154 0.78928E+00 -0.1028 104 S4-2 0.16971E-12 -12.7703 0.72066E-13 -13.1423 0.42464E+00 -0.3720 105 S5-2 0.57519E-12 -12.2402 0.24425E-12 -12.6122 0.42464E+00 -0.3720 106 SO2,aq 0.58095E-11 -11.2359 0.58095E-11 -11.2359 0.10000E+01 0.0000 107 SO3-2 0.17305E-17 -17.7618 0.75228E-18 -18.1236 0.43472E+00 -0.3618 108 HSO3- 0.89103E-12 -12.0501 0.70327E-12 -12.1529 0.78928E+00 -0.1028 109 HSO4- 0.19194E-07 -7.7168 0.15221E-07 -7.8176 0.79303E+00 -0.1007 111 S2O3-2 0.91460E-12 -12.0388 0.38837E-12 -12.4108 0.42464E+00 -0.3720 112 HS2O3- 0.13136E-11 -11.8815 0.10368E-11 -11.9843 0.78928E+00 -0.1028 113 H2S2O3,aq 0.24818E-12 -12.6052 0.24818E-12 -12.6052 0.10000E+01 0.0000 Charge balance for all species = -.5472E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1873138E-01 0.4641336E+00 0.4581225E+03 0.0000 2 H2O 0.1000000E+01 0.5509832E+02 0.9720392E+06 0.0000 3 Cl- 0.3858181E-01 0.3882240E-01 0.1347843E+04 0.3095 4 SO4-- 0.2482477E-08 0.1395935E-07 0.1313164E-02 -5.3238 5 HCO3- 0.1523335E-04 0.4099478E+00 0.2449541E+05 -3.0930 6 HS- 0.8511377E-06 0.3279662E-01 0.1062169E+04 -4.3468 7 Al+++ 0.4669394E-05 0.4744139E-05 0.1253509E+00 -0.6821 8 H4SiO4 0.1008474E-02 0.1008474E-02 0.9492087E+02 -2.9963 9 Ca++ 0.2013454E-06 0.2067234E-06 0.8113340E-02 -3.4200 10 Mg++ 0.8115155E-10 0.8313631E-10 0.1979317E-05 -6.8179 11 Fe++ 0.3155364E-07 0.3237924E-07 0.1770804E-02 -4.2274 12 K+ 0.1402450E-03 0.1403063E-03 0.5372545E+01 -2.1288 13 Na+ 0.1974391E-01 0.1990122E-01 0.4480420E+03 0.0184 14 Mn++ 0.2034786E-08 0.2237220E-08 0.1203609E-03 -5.4173 15 F- 0.3221702E-04 0.2622831E-02 0.4879577E+02 -2.7702 16 HPO4-- 0.5093878E-13 0.4141571E-07 0.3892649E-02 -10.0115 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.6906274E+00 0.4671872E+00 0.1574998E+00 0.6594035E-01 2 H2O 0.5524982E+02 0.5546082E+02 -.1482757E+00 -.6272429E-01 3 Cl- 0.3907783E-01 0.3907783E-01 0.0000000E+00 0.1992444E-09 4 SO4-- 0.3149997E-01 0.1405119E-07 0.3149997E-01 -.1656521E-07 5 HCO3- 0.4771923E+00 0.4126450E+00 0.0000000E+00 0.6454739E-01 6 HS- 0.1289053E+00 0.3301240E-01 0.9449991E-01 0.1392986E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1015109E-02 0.1113791E-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 0.3259227E-07 0.0000000E+00 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- 0.2640096E-02 0.2640087E-02 0.0000000E+00 0.8620184E-08 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1419E-16 Mass of aqueous solution: 0.102788E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 6.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1823E-02 -2.739 0.3283E-01 -1.484 1.124 0.7240 CO2,gas 0.6455E-01 -1.190 2.841 0.453 97.25 34.77 CH4,gas 0.1419E-07 -7.848 0.2276E-06 -6.643 0.7790E-05 0.9158E-05 H2,gas 0.9406E-08 -8.027 0.1900E-07 -7.721 0.6505E-06 0.5992E-05 H2S,gas 0.1393E-02 -2.856 0.4747E-01 -1.324 1.625 0.7091 S2,gas 0.7274E-12 -12.138 0.4664E-10 -10.331 0.1597E-08 0.4514E-09 CO,gas 0.1076E-09 -9.968 0.3014E-08 -8.521 0.1032E-06 0.6677E-07 SO3,gas 0.1218E-30 -30.914 0.9752E-29 -29.011 0.3339E-27 0.7558E-28 SO2,gas 0.3405E-13 -13.468 0.2181E-11 -11.661 0.7467E-10 0.2113E-10 HF,gas 0.8620E-08 -8.064 0.1724E-06 -6.763 0.5902E-05 0.5349E-05 HCl,gas 0.1992E-09 -9.701 0.7264E-08 -8.139 0.2487E-06 0.1236E-06 quartz 0.1114E-01 -1.953 0.6692 -0.174 14.21 0.2527 sulfur 0.1260 -0.900 4.040 0.606 85.79 1.954 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9525E+00 0.4763E+02 0.8707 1.618 CH4,gas 0.2094E-06 0.1047E-04 1.0374 -4.964 H2,gas 0.1388E-06 0.6941E-05 1.0270 -5.147 H2S,gas 0.2056E-01 0.1028E+01 0.8293 -0.069 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1588E-08 0.7940E-07 1.0000 -7.100 SO3,gas 0.1798E-29 0.8988E-28 1.0000 -28.046 SO2,gas 0.5025E-12 0.2512E-10 1.0000 -10.600 HF,gas 0.1272E-06 0.6360E-05 1.0000 -5.197 HCl,gas 0.2940E-08 0.1470E-06 1.0000 -6.833 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.282086 % Solid products produced: Mass = 4.708722 g Volume = 2.207015 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: 6.5999900 moles log = 0.8195 Original solution: 1000.0103000 g Original solution / Rock added: 151.52 (Water/Rock Ratio), log = 2.1805 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 0.00000E+00 3 CH4,gas 4.54 4.54 0.00 0.000 0.15165E-11 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 0.60662E-11 7 CO,gas 3.21 3.21 0.00 0.000 0.22748E-11 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 0.18957E-11 11 HCl,gas 5.19 5.19 0.00 0.000 -0.15165E-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 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 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 -0.69 -3.56 -0.594 0.60832E+04 69 diamond -3.10 -4.43 -1.32 -0.378 0.22617E+04 86 gibbsite 4.08 -0.69 -4.77 -0.682 0.81476E+04 89 graphite -3.55 -4.43 -0.88 -0.252 0.15039E+04 92 halite 1.57 -3.32 -4.90 -2.449 0.83640E+04 145 pyrite -21.25 -21.38 -0.13 -0.031 0.22434E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.20 -0.66 -0.073 0.11241E+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: 0.2000000 MOLES Current total amount of reactant added: 6.5999900 MOLES New total amount of reactant added: 6.7999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 6.7999900 Water: Moles liquid = 0.5606E+02 kg liquid = 0.1010E+01 Moles total = 0.5541E+02 kg total = 0.9983E+00 Activity = 0.9921 Stoichiometric ionic strength = .2547891E+00 Osmotic coef. = 0.9150 True ionic strength = .3967566E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4026E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.19831E-01 -1.7027 0.15776E-01 -1.8020 0.79554E+00 -0.0993 2 H2O 0.99208E+00 -0.0035 0.99208E+00 -0.0035 3 Cl- 0.39615E-01 -1.4021 0.31200E-01 -1.5058 0.78758E+00 -0.1037 4 SO4-- 0.21225E-08 -8.6731 0.89689E-09 -9.0473 0.42256E+00 -0.3741 5 HCO3- 0.14442E-04 -4.8404 0.11402E-04 -4.9430 0.78951E+00 -0.1026 6 HS- 0.82218E-06 -6.0850 0.64769E-06 -6.1886 0.78777E+00 -0.1036 7 Al+++ 0.46590E-05 -5.3317 0.67735E-06 -6.1692 0.14539E+00 -0.8375 8 H4SiO4 0.10085E-02 -2.9963 0.10085E-02 -2.9963 0.10000E+01 0.0000 9 Ca++ 0.20060E-06 -6.6977 0.83715E-07 -7.0772 0.41731E+00 -0.3795 10 Mg++ 0.80858E-10 -10.0923 0.33486E-10 -10.4751 0.41413E+00 -0.3829 11 Fe++ 0.31438E-07 -7.5025 0.13043E-07 -7.8846 0.41488E+00 -0.3821 12 K+ 0.13979E-03 -3.8545 0.11040E-03 -3.9570 0.78980E+00 -0.1025 13 Na+ 0.19676E-01 -1.7061 0.15491E-01 -1.8099 0.78730E+00 -0.1039 14 Mn++ 0.20250E-08 -8.6936 0.84128E-09 -9.0751 0.41546E+00 -0.3815 15 F- 0.31403E-04 -4.5030 0.24649E-04 -4.6082 0.78493E+00 -0.1052 16 HPO4-- 0.46298E-13 -13.3344 0.19568E-13 -13.7084 0.42266E+00 -0.3740 17 SiF6-2 0.10909E-12 -12.9622 0.45936E-13 -13.3378 0.42106E+00 -0.3757 18 HSiO3- 0.76391E-10 -10.1170 0.60165E-10 -10.2207 0.78758E+00 -0.1037 19 Ca(HSiO3)+ 0.14518E-15 -15.8381 0.11470E-15 -15.9404 0.79008E+00 -0.1023 20 Mg(HSiO3)+ 0.72271E-19 -19.1410 0.57100E-19 -19.2434 0.79008E+00 -0.1023 21 NaHSiO3,aq 0.15074E-10 -10.8218 0.15074E-10 -10.8218 0.10000E+01 0.0000 22 AlO+ 0.46491E-09 -9.3326 0.36732E-09 -9.4350 0.79008E+00 -0.1023 23 AlOH+2 0.69339E-07 -7.1590 0.28855E-07 -7.5398 0.41614E+00 -0.3808 24 HAlO2,aq 0.46001E-11 -11.3372 0.46001E-11 -11.3372 0.10000E+01 0.0000 25 AlO2- 0.82198E-15 -15.0851 0.64546E-15 -15.1901 0.78524E+00 -0.1050 26 CH4,aq 0.83936E-08 -8.0761 0.79350E-08 -8.1005 0.94536E+00 -0.0244 27 C2H6,aq 0.20591E-17 -17.6863 0.19466E-17 -17.7107 0.94536E+00 -0.0244 31 CO,aq 0.54245E-10 -10.2656 0.54245E-10 -10.2656 0.10000E+01 0.0000 32 CO2,aq 0.40982E+00 -0.3874 0.38743E+00 -0.4118 0.94536E+00 -0.0244 33 CO3-2 0.14993E-12 -12.8241 0.63129E-13 -13.1998 0.42106E+00 -0.3757 34 CaCO3,aq 0.66265E-16 -16.1787 0.66265E-16 -16.1787 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.30838E-10 -10.5109 0.24365E-10 -10.6132 0.79008E+00 -0.1023 36 CaCl+ 0.53499E-08 -8.2717 0.42268E-08 -8.3740 0.79008E+00 -0.1023 37 CaCl2,aq 0.31331E-10 -10.5040 0.31331E-10 -10.5040 0.10000E+01 0.0000 38 CaF+ 0.38131E-10 -10.4187 0.30127E-10 -10.5210 0.79008E+00 -0.1023 39 CaOH+ 0.47488E-15 -15.3234 0.37519E-15 -15.4257 0.79008E+00 -0.1023 40 CaSO4,aq 0.23842E-13 -13.6227 0.23842E-13 -13.6227 0.10000E+01 0.0000 41 HCl,aq 0.90195E-04 -4.0448 0.90195E-04 -4.0448 0.10000E+01 0.0000 45 HF,aq 0.26620E-02 -2.5748 0.26620E-02 -2.5748 0.10000E+01 0.0000 46 HF2- 0.28128E-07 -7.5509 0.22153E-07 -7.6546 0.78758E+00 -0.1037 47 Fe+3 0.15376E-17 -17.8132 0.22471E-18 -18.6484 0.14614E+00 -0.8352 48 FeCl+ 0.81527E-09 -9.0887 0.64413E-09 -9.1910 0.79008E+00 -0.1023 49 FeCl2,aq 0.63627E-15 -15.1964 0.63627E-15 -15.1964 0.10000E+01 0.0000 50 FeCl+2 0.12038E-17 -17.9195 0.50093E-18 -18.3002 0.41614E+00 -0.3808 51 FeF+ 0.20794E-10 -10.6821 0.16429E-10 -10.7844 0.79008E+00 -0.1023 52 FeF+2 0.11863E-15 -15.9258 0.49365E-16 -16.3066 0.41614E+00 -0.3808 54 FeOH+ 0.33793E-13 -13.4712 0.26699E-13 -13.5735 0.79008E+00 -0.1023 56 FeO+ 0.10839E-17 -17.9650 0.85641E-18 -18.0673 0.79008E+00 -0.1023 57 FeOH+2 0.62002E-17 -17.2076 0.25801E-17 -17.5884 0.41614E+00 -0.3808 60 H2,aq 0.58491E-08 -8.2329 0.55295E-08 -8.2573 0.94536E+00 -0.0244 61 KCl,aq 0.62431E-07 -7.2046 0.62431E-07 -7.2046 0.10000E+01 0.0000 62 KHSO4,aq 0.44168E-14 -14.3549 0.44168E-14 -14.3549 0.10000E+01 0.0000 63 KOH,aq 0.29650E-14 -14.5280 0.29650E-14 -14.5280 0.10000E+01 0.0000 64 KSO4- 0.19510E-11 -11.7097 0.15366E-11 -11.8134 0.78758E+00 -0.1037 66 Mg(HCO3)+ 0.12604E-13 -13.8995 0.99585E-14 -14.0018 0.79008E+00 -0.1023 67 MgCl+ 0.19395E-11 -11.7123 0.15324E-11 -11.8146 0.79008E+00 -0.1023 68 MgF+ 0.56499E-13 -13.2480 0.44639E-13 -13.3503 0.79008E+00 -0.1023 69 MgOH+ 0.10511E-17 -17.9784 0.83044E-18 -18.0807 0.79008E+00 -0.1023 71 MnF+ 0.44208E-12 -12.3545 0.34928E-12 -12.4568 0.79008E+00 -0.1023 73 MnOH+ 0.20248E-15 -15.6936 0.15998E-15 -15.7959 0.79008E+00 -0.1023 78 MnCl+ 0.20458E-09 -9.6891 0.16163E-09 -9.7915 0.79008E+00 -0.1023 79 MnSO4,aq 0.21783E-15 -15.6619 0.21783E-15 -15.6619 0.10000E+01 0.0000 80 NaCl,aq 0.16017E-03 -3.7954 0.16017E-03 -3.7954 0.10000E+01 0.0000 81 NaF,aq 0.89395E-07 -7.0487 0.89395E-07 -7.0487 0.10000E+01 0.0000 82 NaOH,aq 0.41855E-12 -12.3783 0.41855E-12 -12.3783 0.10000E+01 0.0000 84 OH- 0.46270E-10 -10.3347 0.36333E-10 -10.4397 0.78524E+00 -0.1050 90 H3PO3,aq 0.18771E-19 -19.7265 0.18771E-19 -19.7265 0.10000E+01 0.0000 91 H2PO3- 0.13653E-19 -19.8648 0.10753E-19 -19.9685 0.78758E+00 -0.1037 92 H3PO4,aq 0.34062E-07 -7.4677 0.34062E-07 -7.4677 0.10000E+01 0.0000 93 H2PO4- 0.72194E-08 -8.1415 0.56949E-08 -8.2445 0.78883E+00 -0.1030 95 H4P2O7,aq 0.15419E-16 -16.8120 0.15419E-16 -16.8120 0.10000E+01 0.0000 96 H3P2O7- 0.15843E-16 -16.8002 0.12478E-16 -16.9039 0.78758E+00 -0.1037 97 H2P2O7-2 0.60876E-17 -17.2156 0.25633E-17 -17.5912 0.42106E+00 -0.3757 100 H2S,aq 0.33405E-01 -1.4762 0.31580E-01 -1.5006 0.94536E+00 -0.0244 101 S2-2 0.39924E-14 -14.3988 0.16811E-14 -14.7744 0.42106E+00 -0.3757 102 S3-2 0.30719E-13 -13.5126 0.12935E-13 -13.8882 0.42106E+00 -0.3757 103 S3- 0.23356E-08 -8.6316 0.18395E-08 -8.7353 0.78758E+00 -0.1037 104 S4-2 0.15614E-12 -12.8065 0.65744E-13 -13.1821 0.42106E+00 -0.3757 105 S5-2 0.52918E-12 -12.2764 0.22282E-12 -12.6521 0.42106E+00 -0.3757 106 SO2,aq 0.56007E-11 -11.2518 0.56007E-11 -11.2518 0.10000E+01 0.0000 107 SO3-2 0.15063E-17 -17.8221 0.64961E-18 -18.1873 0.43126E+00 -0.3653 108 HSO3- 0.81473E-12 -12.0890 0.64167E-12 -12.1927 0.78758E+00 -0.1037 109 HSO4- 0.17230E-07 -7.7637 0.13636E-07 -7.8653 0.79140E+00 -0.1016 111 S2O3-2 0.79649E-12 -12.0988 0.33537E-12 -12.4745 0.42106E+00 -0.3757 112 HS2O3- 0.12012E-11 -11.9204 0.94601E-12 -12.0241 0.78758E+00 -0.1037 113 H2S2O3,aq 0.23925E-12 -12.6211 0.23925E-12 -12.6211 0.10000E+01 0.0000 Charge balance for all species = -.5454E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1983053E-01 0.4658046E+00 0.4597477E+03 0.0000 2 H2O 0.1000000E+01 0.5509843E+02 0.9719902E+06 0.0000 3 Cl- 0.3961466E-01 0.3986509E-01 0.1383971E+04 0.2962 4 SO4-- 0.2122527E-08 0.1095269E-07 0.1030272E-02 -5.4433 5 HCO3- 0.1444182E-04 0.4098312E+00 0.2448716E+05 -3.1410 6 HS- 0.8221785E-06 0.3340595E-01 0.1081846E+04 -4.3866 7 Al+++ 0.4658958E-05 0.4728767E-05 0.1249382E+00 -0.7632 8 H4SiO4 0.1008456E-02 0.1008456E-02 0.9491421E+02 -2.9963 9 Ca++ 0.2006034E-06 0.2060536E-06 0.8086625E-02 -3.4732 10 Mg++ 0.8085830E-10 0.8286692E-10 0.1972800E-05 -6.8711 11 Fe++ 0.3143822E-07 0.3227432E-07 0.1764973E-02 -4.2806 12 K+ 0.1397892E-03 0.1398517E-03 0.5354855E+01 -2.1550 13 Na+ 0.1967646E-01 0.1983673E-01 0.4465667E+03 -0.0079 14 Mn++ 0.2024950E-08 0.2229970E-08 0.1199646E-03 -5.4711 15 F- 0.3140253E-04 0.2693550E-02 0.5010880E+02 -2.8062 16 HPO4-- 0.4629829E-13 0.4128151E-07 0.3879832E-02 -10.1044 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7121624E+00 0.4703935E+00 0.1622749E+00 0.7949401E-01 2 H2O 0.5541356E+02 0.5564124E+02 -.1520892E+00 -.7558592E-01 3 Cl- 0.4025783E-01 0.4025782E-01 0.0000000E+00 0.2600274E-09 4 SO4-- 0.3245497E-01 0.1106059E-07 0.3245498E-01 -.2131445E-07 5 HCO3- 0.4916523E+00 0.4138686E+00 0.0000000E+00 0.7778373E-01 6 HS- 0.1328103E+00 0.3373505E-01 0.9736493E-01 0.1710311E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1018391E-02 0.1113463E-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 0.3259227E-07 0.0000000E+00 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- 0.2720096E-02 0.2720085E-02 0.0000000E+00 0.1067899E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1552E-16 Mass of aqueous solution: 0.103128E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 6.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2198E-02 -2.658 0.3958E-01 -1.403 1.124 0.8728 CO2,gas 0.7778E-01 -1.109 3.423 0.534 97.22 41.89 CH4,gas 0.1839E-07 -7.735 0.2950E-06 -6.530 0.8379E-05 0.1187E-04 H2,gas 0.1155E-07 -7.937 0.2333E-07 -7.632 0.6626E-06 0.7357E-05 H2S,gas 0.1710E-02 -2.767 0.5829E-01 -1.234 1.655 0.8707 S2,gas 0.8770E-12 -12.057 0.5623E-10 -10.250 0.1597E-08 0.5442E-09 CO,gas 0.1321E-09 -9.879 0.3699E-08 -8.432 0.1051E-06 0.8195E-07 SO3,gas 0.1390E-30 -30.857 0.1113E-28 -28.954 0.3161E-27 0.8625E-28 SO2,gas 0.3957E-13 -13.403 0.2535E-11 -11.596 0.7199E-10 0.2455E-10 HF,gas 0.1068E-07 -7.971 0.2136E-06 -6.670 0.6066E-05 0.6626E-05 HCl,gas 0.2600E-09 -9.585 0.9481E-08 -8.023 0.2692E-06 0.1613E-06 quartz 0.1113E-01 -1.953 0.6690 -0.175 13.85 0.2526 sulfur 0.1298 -0.887 4.162 0.619 86.15 2.014 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9522E+00 0.4761E+02 0.8707 1.618 CH4,gas 0.2252E-06 0.1126E-04 1.0374 -4.933 H2,gas 0.1414E-06 0.7069E-05 1.0270 -5.139 H2S,gas 0.2094E-01 0.1047E+01 0.8293 -0.061 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1617E-08 0.8084E-07 1.0000 -7.092 SO3,gas 0.1701E-29 0.8507E-28 1.0000 -28.070 SO2,gas 0.4844E-12 0.2422E-10 1.0000 -10.616 HF,gas 0.1307E-06 0.6536E-05 1.0000 -5.185 HCl,gas 0.3183E-08 0.1592E-06 1.0000 -6.798 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.338690 % Solid products produced: Mass = 4.830995 g Volume = 2.266191 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: 6.7999900 moles log = 0.8325 Original solution: 1000.0103000 g Original solution / Rock added: 147.06 (Water/Rock Ratio), log = 2.1675 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 1 H2O,gas 1.70 1.70 0.00 0.000 0.00000E+00 2 CO2,gas -6.66 -6.66 0.00 0.000 -0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 -0.15165E-11 5 H2S,gas -6.23 -6.23 0.00 0.000 0.00000E+00 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 -0.34122E-11 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 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 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 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 -0.77 -3.64 -0.607 0.62217E+04 69 diamond -3.10 -4.41 -1.31 -0.374 0.22348E+04 86 gibbsite 4.08 -0.77 -4.85 -0.693 0.82861E+04 89 graphite -3.55 -4.41 -0.87 -0.247 0.14771E+04 92 halite 1.57 -3.32 -4.89 -2.445 0.83501E+04 145 pyrite -21.25 -21.42 -0.18 -0.042 0.30163E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.34 -0.80 -0.089 0.13606E+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: 0.2000000 MOLES Current total amount of reactant added: 6.7999900 MOLES New total amount of reactant added: 6.9999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 6.9999900 Water: Moles liquid = 0.5624E+02 kg liquid = 0.1013E+01 Moles total = 0.5558E+02 kg total = 0.1001E+01 Activity = 0.9921 Stoichiometric ionic strength = .2555561E+00 Osmotic coef. = 0.9150 True ionic strength = .4070018E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4144E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20923E-01 -1.6794 0.16613E-01 -1.7796 0.79402E+00 -0.1002 2 H2O 0.99207E+00 -0.0035 0.99207E+00 -0.0035 3 Cl- 0.40641E-01 -1.3910 0.31941E-01 -1.4957 0.78593E+00 -0.1046 4 SO4-- 0.18307E-08 -8.7374 0.76727E-09 -9.1151 0.41912E+00 -0.3777 5 HCO3- 0.13737E-04 -4.8621 0.10823E-04 -4.9656 0.78789E+00 -0.1035 6 HS- 0.79625E-06 -6.0989 0.62596E-06 -6.2035 0.78613E+00 -0.1045 7 Al+++ 0.46481E-05 -5.3327 0.66319E-06 -6.1784 0.14268E+00 -0.8456 8 H4SiO4 0.10084E-02 -2.9964 0.10084E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19987E-06 -6.6993 0.82709E-07 -7.0824 0.41382E+00 -0.3832 10 Mg++ 0.80567E-10 -10.0938 0.33081E-10 -10.4804 0.41060E+00 -0.3866 11 Fe++ 0.31324E-07 -7.5041 0.12886E-07 -7.8899 0.41137E+00 -0.3858 12 K+ 0.13934E-03 -3.8559 0.10982E-03 -3.9593 0.78818E+00 -0.1034 13 Na+ 0.19609E-01 -1.7075 0.15406E-01 -1.8123 0.78564E+00 -0.1048 14 Mn++ 0.20152E-08 -8.6957 0.83018E-09 -9.0808 0.41195E+00 -0.3852 15 F- 0.30682E-04 -4.5131 0.24031E-04 -4.6192 0.78324E+00 -0.1061 16 HPO4-- 0.42316E-13 -13.3735 0.17740E-13 -13.7511 0.41922E+00 -0.3776 17 SiF6-2 0.11616E-12 -12.9349 0.48511E-13 -13.3142 0.41761E+00 -0.3792 18 HSiO3- 0.72695E-10 -10.1385 0.57133E-10 -10.2431 0.78593E+00 -0.1046 19 Ca(HSiO3)+ 0.13649E-15 -15.8649 0.10762E-15 -15.9681 0.78847E+00 -0.1032 20 Mg(HSiO3)+ 0.67939E-19 -19.1679 0.53568E-19 -19.2711 0.78847E+00 -0.1032 21 NaHSiO3,aq 0.14236E-10 -10.8466 0.14236E-10 -10.8466 0.10000E+01 0.0000 22 AlO+ 0.41132E-09 -9.3858 0.32431E-09 -9.4890 0.78847E+00 -0.1032 23 AlOH+2 0.65017E-07 -7.1870 0.26828E-07 -7.5714 0.41263E+00 -0.3844 24 HAlO2,aq 0.38569E-11 -11.4138 0.38569E-11 -11.4138 0.10000E+01 0.0000 25 AlO2- 0.65587E-15 -15.1832 0.51391E-15 -15.2891 0.78356E+00 -0.1059 26 CH4,aq 0.90020E-08 -8.0457 0.85092E-08 -8.0701 0.94525E+00 -0.0245 27 C2H6,aq 0.23270E-17 -17.6332 0.21996E-17 -17.6577 0.94525E+00 -0.0245 31 CO,aq 0.55185E-10 -10.2582 0.55185E-10 -10.2582 0.10000E+01 0.0000 32 CO2,aq 0.40970E+00 -0.3875 0.38727E+00 -0.4120 0.94525E+00 -0.0245 33 CO3-2 0.13627E-12 -12.8656 0.56906E-13 -13.2448 0.41761E+00 -0.3792 34 CaCO3,aq 0.59016E-16 -16.2290 0.59016E-16 -16.2290 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.28981E-10 -10.5379 0.22850E-10 -10.6411 0.78847E+00 -0.1032 36 CaCl+ 0.54222E-08 -8.2658 0.42753E-08 -8.3690 0.78847E+00 -0.1032 37 CaCl2,aq 0.32443E-10 -10.4889 0.32443E-10 -10.4889 0.10000E+01 0.0000 38 CaF+ 0.36804E-10 -10.4341 0.29019E-10 -10.5373 0.78847E+00 -0.1032 39 CaOH+ 0.44644E-15 -15.3502 0.35201E-15 -15.4534 0.78847E+00 -0.1032 40 CaSO4,aq 0.20152E-13 -13.6957 0.20152E-13 -13.6957 0.10000E+01 0.0000 41 HCl,aq 0.97236E-04 -4.0122 0.97236E-04 -4.0122 0.10000E+01 0.0000 45 HF,aq 0.27330E-02 -2.5634 0.27330E-02 -2.5634 0.10000E+01 0.0000 46 HF2- 0.28214E-07 -7.5495 0.22174E-07 -7.6542 0.78593E+00 -0.1046 47 Fe+3 0.16155E-17 -17.7917 0.23173E-18 -18.6350 0.14344E+00 -0.8433 48 FeCl+ 0.82623E-09 -9.0829 0.65145E-09 -9.1861 0.78847E+00 -0.1032 49 FeCl2,aq 0.65879E-15 -15.1813 0.65879E-15 -15.1813 0.10000E+01 0.0000 50 FeCl+2 0.12816E-17 -17.8922 0.52884E-18 -18.2767 0.41263E+00 -0.3844 51 FeF+ 0.20069E-10 -10.6975 0.15824E-10 -10.8007 0.78847E+00 -0.1032 52 FeF+2 0.12028E-15 -15.9198 0.49631E-16 -16.3042 0.41263E+00 -0.3844 54 FeOH+ 0.31767E-13 -13.4980 0.25047E-13 -13.6012 0.78847E+00 -0.1032 56 FeO+ 0.10101E-17 -17.9957 0.79640E-18 -18.0989 0.78847E+00 -0.1032 57 FeOH+2 0.61233E-17 -17.2130 0.25266E-17 -17.5975 0.41263E+00 -0.3844 60 H2,aq 0.59534E-08 -8.2252 0.56275E-08 -8.2497 0.94525E+00 -0.0245 61 KCl,aq 0.63576E-07 -7.1967 0.63576E-07 -7.1967 0.10000E+01 0.0000 62 KHSO4,aq 0.39579E-14 -14.4025 0.39579E-14 -14.4025 0.10000E+01 0.0000 63 KOH,aq 0.28007E-14 -14.5527 0.28007E-14 -14.5527 0.10000E+01 0.0000 64 KSO4- 0.16637E-11 -11.7789 0.13076E-11 -11.8835 0.78593E+00 -0.1046 66 Mg(HCO3)+ 0.11844E-13 -13.9265 0.93388E-14 -14.0297 0.78847E+00 -0.1032 67 MgCl+ 0.19656E-11 -11.7065 0.15498E-11 -11.8097 0.78847E+00 -0.1032 68 MgF+ 0.54529E-13 -13.2634 0.42995E-13 -13.3666 0.78847E+00 -0.1032 69 MgOH+ 0.98808E-18 -18.0052 0.77907E-18 -18.1084 0.78847E+00 -0.1032 71 MnF+ 0.42618E-12 -12.3704 0.33603E-12 -12.4736 0.78847E+00 -0.1032 73 MnOH+ 0.19013E-15 -15.7210 0.14991E-15 -15.8242 0.78847E+00 -0.1032 78 MnCl+ 0.20709E-09 -9.6838 0.16329E-09 -9.7870 0.78847E+00 -0.1032 79 MnSO4,aq 0.18389E-15 -15.7354 0.18389E-15 -15.7354 0.10000E+01 0.0000 80 NaCl,aq 0.16308E-03 -3.7876 0.16308E-03 -3.7876 0.10000E+01 0.0000 81 NaF,aq 0.86676E-07 -7.0621 0.86676E-07 -7.0621 0.10000E+01 0.0000 82 NaOH,aq 0.39528E-12 -12.4031 0.39528E-12 -12.4031 0.10000E+01 0.0000 84 OH- 0.44033E-10 -10.3562 0.34503E-10 -10.4621 0.78356E+00 -0.1059 90 H3PO3,aq 0.19205E-19 -19.7166 0.19205E-19 -19.7166 0.10000E+01 0.0000 91 H2PO3- 0.13292E-19 -19.8764 0.10447E-19 -19.9810 0.78593E+00 -0.1046 92 H3PO4,aq 0.34242E-07 -7.4654 0.34242E-07 -7.4654 0.10000E+01 0.0000 93 H2PO4- 0.69062E-08 -8.1608 0.54365E-08 -8.2647 0.78720E+00 -0.1039 95 H4P2O7,aq 0.15582E-16 -16.8074 0.15582E-16 -16.8074 0.10000E+01 0.0000 96 H3P2O7- 0.15237E-16 -16.8171 0.11975E-16 -16.9217 0.78593E+00 -0.1046 97 H2P2O7-2 0.55938E-17 -17.2523 0.23360E-17 -17.6315 0.41761E+00 -0.3792 100 H2S,aq 0.34001E-01 -1.4685 0.32139E-01 -1.4930 0.94525E+00 -0.0245 101 S2-2 0.36944E-14 -14.4325 0.15428E-14 -14.8117 0.41761E+00 -0.3792 102 S3-2 0.28426E-13 -13.5463 0.11871E-13 -13.9255 0.41761E+00 -0.3792 103 S3- 0.22422E-08 -8.6493 0.17622E-08 -8.7539 0.78593E+00 -0.1046 104 S4-2 0.14448E-12 -12.8402 0.60337E-13 -13.2194 0.41761E+00 -0.3792 105 S5-2 0.48967E-12 -12.3101 0.20449E-12 -12.6893 0.41761E+00 -0.3792 106 SO2,aq 0.54074E-11 -11.2670 0.54074E-11 -11.2670 0.10000E+01 0.0000 107 SO3-2 0.13217E-17 -17.8789 0.56558E-18 -18.2475 0.42790E+00 -0.3687 108 HSO3- 0.74854E-12 -12.1258 0.58830E-12 -12.2304 0.78593E+00 -0.1046 109 HSO4- 0.15553E-07 -7.8082 0.12284E-07 -7.9107 0.78981E+00 -0.1025 111 S2O3-2 0.69919E-12 -12.1554 0.29199E-12 -12.5346 0.41761E+00 -0.3792 112 HS2O3- 0.11036E-11 -11.9572 0.86733E-12 -12.0618 0.78593E+00 -0.1046 113 H2S2O3,aq 0.23099E-12 -12.6364 0.23099E-12 -12.6364 0.10000E+01 0.0000 Charge balance for all species = -.5436E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2092255E-01 0.4674575E+00 0.4613552E+03 0.0000 2 H2O 0.1000000E+01 0.5509855E+02 0.9719417E+06 0.0000 3 Cl- 0.4064066E-01 0.4090105E-01 0.1419862E+04 0.2839 4 SO4-- 0.1830674E-08 0.8290001E-08 0.7797637E-03 -5.5559 5 HCO3- 0.1373697E-04 0.4097176E+00 0.2447910E+05 -3.1861 6 HS- 0.7962537E-06 0.3400156E-01 0.1101078E+04 -4.4239 7 Al+++ 0.4648061E-05 0.4713493E-05 0.1245282E+00 -0.8397 8 H4SiO4 0.1008439E-02 0.1008439E-02 0.9490765E+02 -2.9964 9 Ca++ 0.1998676E-06 0.2053880E-06 0.8060087E-02 -3.5233 10 Mg++ 0.8056729E-10 0.8259926E-10 0.1966326E-05 -6.9213 11 Fe++ 0.3132375E-07 0.3217008E-07 0.1759181E-02 -4.3308 12 K+ 0.1393364E-03 0.1393999E-03 0.5337282E+01 -2.1798 13 Na+ 0.1960949E-01 0.1977266E-01 0.4451013E+03 -0.0328 14 Mn++ 0.2015248E-08 0.2222768E-08 0.1195709E-03 -5.5217 15 F- 0.3068176E-04 0.2763811E-02 0.5141323E+02 -2.8397 16 HPO4-- 0.4231570E-13 0.4114817E-07 0.3867099E-02 -10.1919 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7336974E+00 0.4735923E+00 0.1670499E+00 0.9305516E-01 2 H2O 0.5557730E+02 0.5582165E+02 -.1559026E+00 -.8844493E-01 3 Cl- 0.4143783E-01 0.4143782E-01 0.0000000E+00 0.3281473E-09 4 SO4-- 0.3340997E-01 0.8398798E-08 0.3340999E-01 -.2656924E-07 5 HCO3- 0.5061123E+00 0.4150947E+00 0.0000000E+00 0.9101765E-01 6 HS- 0.1367153E+00 0.3444779E-01 0.1002300E+00 0.2037545E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1021674E-02 0.1113135E-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 0.3259227E-07 0.0000000E+00 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- 0.2800096E-02 0.2800083E-02 0.0000000E+00 0.1283409E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1718E-16 Mass of aqueous solution: 0.103467E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 6.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2573E-02 -2.590 0.4633E-01 -1.334 1.124 1.022 CO2,gas 0.9102E-01 -1.041 4.006 0.603 97.19 49.02 CH4,gas 0.2309E-07 -7.637 0.3704E-06 -6.431 0.8987E-05 0.1491E-04 H2,gas 0.1376E-07 -7.861 0.2779E-07 -7.556 0.6743E-06 0.8765E-05 H2S,gas 0.2038E-02 -2.691 0.6944E-01 -1.158 1.685 1.037 S2,gas 0.1027E-11 -11.989 0.6582E-10 -10.182 0.1597E-08 0.6370E-09 CO,gas 0.1573E-09 -9.803 0.4405E-08 -8.356 0.1069E-06 0.9759E-07 SO3,gas 0.1544E-30 -30.811 0.1236E-28 -28.908 0.2999E-27 0.9578E-28 SO2,gas 0.4472E-13 -13.349 0.2865E-11 -11.543 0.6951E-10 0.2775E-10 HF,gas 0.1283E-07 -7.892 0.2567E-06 -6.591 0.6228E-05 0.7964E-05 HCl,gas 0.3281E-09 -9.484 0.1196E-07 -7.922 0.2903E-06 0.2036E-06 quartz 0.1113E-01 -1.953 0.6688 -0.175 13.50 0.2526 sulfur 0.1336 -0.874 4.284 0.632 86.50 2.073 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9518E+00 0.4759E+02 0.8707 1.617 CH4,gas 0.2415E-06 0.1207E-04 1.0374 -4.902 H2,gas 0.1439E-06 0.7194E-05 1.0270 -5.131 H2S,gas 0.2131E-01 0.1065E+01 0.8293 -0.054 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1645E-08 0.8224E-07 1.0000 -7.085 SO3,gas 0.1614E-29 0.8071E-28 1.0000 -28.093 SO2,gas 0.4677E-12 0.2338E-10 1.0000 -10.631 HF,gas 0.1342E-06 0.6710E-05 1.0000 -5.173 HCl,gas 0.3432E-08 0.1716E-06 1.0000 -6.766 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.394870 % Solid products produced: Mass = 4.953268 g Volume = 2.325366 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: 6.9999900 moles log = 0.8451 Original solution: 1000.0103000 g Original solution / Rock added: 142.86 (Water/Rock Ratio), log = 2.1549 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 -0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.00000E+00 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 -0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 0.26539E-11 10 HF,gas 0.47 0.47 0.00 0.000 -0.11374E-11 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-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 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 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 -0.85 -3.72 -0.620 0.63523E+04 69 diamond -3.10 -4.40 -1.29 -0.370 0.22091E+04 86 gibbsite 4.08 -0.85 -4.93 -0.704 0.84168E+04 89 graphite -3.55 -4.40 -0.85 -0.243 0.14513E+04 92 halite 1.57 -3.31 -4.88 -2.441 0.83368E+04 145 pyrite -21.25 -21.47 -0.22 -0.052 0.37429E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.47 -0.93 -0.103 0.15829E+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: 0.2000000 MOLES Current total amount of reactant added: 6.9999900 MOLES New total amount of reactant added: 7.1999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 7.1999900 Water: Moles liquid = 0.5642E+02 kg liquid = 0.1016E+01 Moles total = 0.5574E+02 kg total = 0.1004E+01 Activity = 0.9921 Stoichiometric ionic strength = .2563145E+00 Osmotic coef. = 0.9150 True ionic strength = .4171808E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4262E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.22007E-01 -1.6574 0.17442E-01 -1.7584 0.79254E+00 -0.1010 2 H2O 0.99206E+00 -0.0035 0.99206E+00 -0.0035 3 Cl- 0.41660E-01 -1.3803 0.32675E-01 -1.4858 0.78433E+00 -0.1055 4 SO4-- 0.15914E-08 -8.7982 0.66170E-09 -9.1793 0.41579E+00 -0.3811 5 HCO3- 0.13105E-04 -4.8826 0.10305E-04 -4.9870 0.78632E+00 -0.1044 6 HS- 0.77289E-06 -6.1119 0.60635E-06 -6.2173 0.78453E+00 -0.1054 7 Al+++ 0.46368E-05 -5.3338 0.64957E-06 -6.1874 0.14009E+00 -0.8536 8 H4SiO4 0.10084E-02 -2.9964 0.10084E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19914E-06 -6.7008 0.81734E-07 -7.0876 0.41044E+00 -0.3868 10 Mg++ 0.80279E-10 -10.0954 0.32689E-10 -10.4856 0.40719E+00 -0.3902 11 Fe++ 0.31210E-07 -7.5057 0.12733E-07 -7.8951 0.40796E+00 -0.3894 12 K+ 0.13889E-03 -3.8573 0.10925E-03 -3.9616 0.78661E+00 -0.1042 13 Na+ 0.19543E-01 -1.7090 0.15322E-01 -1.8147 0.78403E+00 -0.1057 14 Mn++ 0.20057E-08 -8.6977 0.81942E-09 -9.0865 0.40855E+00 -0.3888 15 F- 0.30040E-04 -4.5223 0.23479E-04 -4.6293 0.78159E+00 -0.1070 16 HPO4-- 0.38869E-13 -13.4104 0.16165E-13 -13.7914 0.41589E+00 -0.3810 17 SiF6-2 0.12376E-12 -12.9074 0.51271E-13 -13.2901 0.41427E+00 -0.3827 18 HSiO3- 0.69381E-10 -10.1588 0.54417E-10 -10.2643 0.78433E+00 -0.1055 19 Ca(HSiO3)+ 0.12872E-15 -15.8903 0.10129E-15 -15.9944 0.78690E+00 -0.1041 20 Mg(HSiO3)+ 0.64069E-19 -19.1934 0.50416E-19 -19.2974 0.78690E+00 -0.1041 21 NaHSiO3,aq 0.13486E-10 -10.8701 0.13486E-10 -10.8701 0.10000E+01 0.0000 22 AlO+ 0.36621E-09 -9.4363 0.28817E-09 -9.5403 0.78690E+00 -0.1041 23 AlOH+2 0.61157E-07 -7.2136 0.25028E-07 -7.6016 0.40924E+00 -0.3880 24 HAlO2,aq 0.32642E-11 -11.4862 0.32642E-11 -11.4862 0.10000E+01 0.0000 25 AlO2- 0.52981E-15 -15.2759 0.41427E-15 -15.3827 0.78192E+00 -0.1068 26 CH4,aq 0.96280E-08 -8.0165 0.90999E-08 -8.0410 0.94515E+00 -0.0245 27 C2H6,aq 0.26171E-17 -17.5822 0.24735E-17 -17.6067 0.94515E+00 -0.0245 31 CO,aq 0.56103E-10 -10.2510 0.56103E-10 -10.2510 0.10000E+01 0.0000 32 CO2,aq 0.40959E+00 -0.3876 0.38713E+00 -0.4121 0.94515E+00 -0.0245 33 CO3-2 0.12457E-12 -12.9046 0.51605E-13 -13.2873 0.41427E+00 -0.3827 34 CaCO3,aq 0.52888E-16 -16.2766 0.52888E-16 -16.2766 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.27322E-10 -10.5635 0.21500E-10 -10.6676 0.78690E+00 -0.1041 36 CaCl+ 0.54924E-08 -8.2602 0.43220E-08 -8.3643 0.78690E+00 -0.1041 37 CaCl2,aq 0.33551E-10 -10.4743 0.33551E-10 -10.4743 0.10000E+01 0.0000 38 CaF+ 0.35606E-10 -10.4485 0.28018E-10 -10.5526 0.78690E+00 -0.1041 39 CaOH+ 0.42105E-15 -15.3757 0.33132E-15 -15.4797 0.78690E+00 -0.1041 40 CaSO4,aq 0.17174E-13 -13.7651 0.17174E-13 -13.7651 0.10000E+01 0.0000 41 HCl,aq 0.10443E-03 -3.9812 0.10443E-03 -3.9812 0.10000E+01 0.0000 45 HF,aq 0.28034E-02 -2.5523 0.28034E-02 -2.5523 0.10000E+01 0.0000 46 HF2- 0.28334E-07 -7.5477 0.22223E-07 -7.6532 0.78433E+00 -0.1055 47 Fe+3 0.16925E-17 -17.7715 0.23838E-18 -18.6227 0.14085E+00 -0.8513 48 FeCl+ 0.83685E-09 -9.0774 0.65852E-09 -9.1814 0.78690E+00 -0.1041 49 FeCl2,aq 0.68124E-15 -15.1667 0.68124E-15 -15.1667 0.10000E+01 0.0000 50 FeCl+2 0.13599E-17 -17.8665 0.55654E-18 -18.2545 0.40924E+00 -0.3880 51 FeF+ 0.19414E-10 -10.7119 0.15277E-10 -10.8160 0.78690E+00 -0.1041 52 FeF+2 0.12189E-15 -15.9140 0.49884E-16 -16.3020 0.40924E+00 -0.3880 54 FeOH+ 0.29958E-13 -13.5235 0.23574E-13 -13.6276 0.78690E+00 -0.1041 56 FeO+ 0.94452E-18 -18.0248 0.74325E-18 -18.1289 0.78690E+00 -0.1041 57 FeOH+2 0.60494E-17 -17.2183 0.24757E-17 -17.6063 0.40924E+00 -0.3880 60 H2,aq 0.60554E-08 -8.2179 0.57232E-08 -8.2424 0.94515E+00 -0.0245 61 KCl,aq 0.64699E-07 -7.1891 0.64699E-07 -7.1891 0.10000E+01 0.0000 62 KHSO4,aq 0.35650E-14 -14.4479 0.35650E-14 -14.4479 0.10000E+01 0.0000 63 KOH,aq 0.26537E-14 -14.5761 0.26537E-14 -14.5761 0.10000E+01 0.0000 64 KSO4- 0.14302E-11 -11.8446 0.11218E-11 -11.9501 0.78433E+00 -0.1055 66 Mg(HCO3)+ 0.11165E-13 -13.9521 0.87861E-14 -14.0562 0.78690E+00 -0.1041 67 MgCl+ 0.19909E-11 -11.7010 0.15666E-11 -11.8050 0.78690E+00 -0.1041 68 MgF+ 0.52750E-13 -13.2778 0.41509E-13 -13.3819 0.78690E+00 -0.1041 69 MgOH+ 0.93181E-18 -18.0307 0.73324E-18 -18.1348 0.78690E+00 -0.1041 71 MnF+ 0.41181E-12 -12.3853 0.32406E-12 -12.4894 0.78690E+00 -0.1041 73 MnOH+ 0.17910E-15 -15.7469 0.14093E-15 -15.8510 0.78690E+00 -0.1041 78 MnCl+ 0.20952E-09 -9.6788 0.16488E-09 -9.7828 0.78690E+00 -0.1041 79 MnSO4,aq 0.15653E-15 -15.8054 0.15653E-15 -15.8054 0.10000E+01 0.0000 80 NaCl,aq 0.16592E-03 -3.7801 0.16592E-03 -3.7801 0.10000E+01 0.0000 81 NaF,aq 0.84225E-07 -7.0746 0.84225E-07 -7.0746 0.10000E+01 0.0000 82 NaOH,aq 0.37444E-12 -12.4266 0.37444E-12 -12.4266 0.10000E+01 0.0000 84 OH- 0.42028E-10 -10.3765 0.32863E-10 -10.4833 0.78192E+00 -0.1068 90 H3PO3,aq 0.19619E-19 -19.7073 0.19619E-19 -19.7073 0.10000E+01 0.0000 91 H2PO3- 0.12960E-19 -19.8874 0.10165E-19 -19.9929 0.78433E+00 -0.1055 92 H3PO4,aq 0.34395E-07 -7.4635 0.34395E-07 -7.4635 0.10000E+01 0.0000 93 H2PO4- 0.66207E-08 -8.1791 0.52013E-08 -8.2839 0.78562E+00 -0.1048 95 H4P2O7,aq 0.15722E-16 -16.8035 0.15722E-16 -16.8035 0.10000E+01 0.0000 96 H3P2O7- 0.14673E-16 -16.8335 0.11508E-16 -16.9390 0.78433E+00 -0.1055 97 H2P2O7-2 0.51615E-17 -17.2872 0.21383E-17 -17.6699 0.41427E+00 -0.3827 100 H2S,aq 0.34583E-01 -1.4611 0.32686E-01 -1.4856 0.94515E+00 -0.0245 101 S2-2 0.34361E-14 -14.4639 0.14235E-14 -14.8467 0.41427E+00 -0.3827 102 S3-2 0.26439E-13 -13.5778 0.10953E-13 -13.9605 0.41427E+00 -0.3827 103 S3- 0.21581E-08 -8.6659 0.16927E-08 -8.7714 0.78433E+00 -0.1055 104 S4-2 0.13438E-12 -12.8717 0.55669E-13 -13.2544 0.41427E+00 -0.3827 105 S5-2 0.45544E-12 -12.3416 0.18867E-12 -12.7243 0.41427E+00 -0.3827 106 SO2,aq 0.52279E-11 -11.2817 0.52279E-11 -11.2817 0.10000E+01 0.0000 107 SO3-2 0.11681E-17 -17.9325 0.49606E-18 -18.3045 0.42466E+00 -0.3720 108 HSO3- 0.69070E-12 -12.1607 0.54174E-12 -12.2662 0.78433E+00 -0.1055 109 HSO4- 0.14110E-07 -7.8505 0.11123E-07 -7.9538 0.78827E+00 -0.1033 111 S2O3-2 0.61820E-12 -12.2089 0.25610E-12 -12.5916 0.41427E+00 -0.3827 112 HS2O3- 0.10183E-11 -11.9921 0.79868E-12 -12.0976 0.78433E+00 -0.1055 113 H2S2O3,aq 0.22332E-12 -12.6511 0.22332E-12 -12.6511 0.10000E+01 0.0000 Charge balance for all species = -.5419E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2200749E-01 0.4690926E+00 0.4629451E+03 0.0000 2 H2O 0.1000000E+01 0.5509866E+02 0.9718937E+06 0.0000 3 Cl- 0.4165991E-01 0.4193033E-01 0.1455518E+04 0.2726 4 SO4-- 0.1591423E-08 0.5902690E-08 0.5551829E-03 -5.6625 5 HCO3- 0.1310523E-04 0.4096071E+00 0.2447124E+05 -3.2285 6 HS- 0.7728906E-06 0.3458391E-01 0.1119878E+04 -4.4589 7 Al+++ 0.4636792E-05 0.4698318E-05 0.1241209E+00 -0.9122 8 H4SiO4 0.1008422E-02 0.1008422E-02 0.9490117E+02 -2.9964 9 Ca++ 0.1991379E-06 0.2047268E-06 0.8033725E-02 -3.5708 10 Mg++ 0.8027853E-10 0.8233334E-10 0.1959894E-05 -6.9688 11 Fe++ 0.3121021E-07 0.3206651E-07 0.1753427E-02 -4.3783 12 K+ 0.1388864E-03 0.1389511E-03 0.5319825E+01 -2.2032 13 Na+ 0.1954300E-01 0.1970900E-01 0.4436455E+03 -0.0563 14 Mn++ 0.2005675E-08 0.2215612E-08 0.1191798E-03 -5.5697 15 F- 0.3004001E-04 0.2833621E-02 0.5270913E+02 -2.8709 16 HPO4-- 0.3886922E-13 0.4101569E-07 0.3854451E-02 -10.2746 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7552324E+00 0.4767838E+00 0.1718250E+00 0.1066236E+00 2 H2O 0.5574104E+02 0.5600206E+02 -.1597161E+00 -.1013014E+00 3 Cl- 0.4261783E-01 0.4261782E-01 0.0000000E+00 0.4038289E-09 4 SO4-- 0.3436497E-01 0.5999471E-08 0.3436499E-01 -.3234780E-07 5 HCO3- 0.5205723E+00 0.4163231E+00 0.0000000E+00 0.1042493E+00 6 HS- 0.1406203E+00 0.3515095E-01 0.1030950E+00 0.2374363E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1024956E-02 0.1112806E-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 0.3259227E-07 0.0000000E+00 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- 0.2880096E-02 0.2880081E-02 0.0000000E+00 0.1508452E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.3534E-16 Mass of aqueous solution: 0.103807E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 7.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2948E-02 -2.531 0.5309E-01 -1.275 1.124 1.171 CO2,gas 0.1042 -0.982 4.588 0.662 97.16 56.15 CH4,gas 0.2829E-07 -7.548 0.4538E-06 -6.343 0.9611E-05 0.1826E-04 H2,gas 0.1603E-07 -7.795 0.3239E-07 -7.490 0.6859E-06 0.1021E-04 H2S,gas 0.2374E-02 -2.624 0.8092E-01 -1.092 1.714 1.209 S2,gas 0.1176E-11 -11.929 0.7542E-10 -10.123 0.1597E-08 0.7299E-09 CO,gas 0.1832E-09 -9.737 0.5132E-08 -8.290 0.1087E-06 0.1137E-06 SO3,gas 0.1681E-30 -30.774 0.1346E-28 -28.871 0.2851E-27 0.1043E-27 SO2,gas 0.4954E-13 -13.305 0.3174E-11 -11.498 0.6721E-10 0.3074E-10 HF,gas 0.1508E-07 -7.821 0.3017E-06 -6.520 0.6389E-05 0.9360E-05 HCl,gas 0.4038E-09 -9.394 0.1472E-07 -7.832 0.3118E-06 0.2506E-06 quartz 0.1113E-01 -1.954 0.6686 -0.175 13.17 0.2525 sulfur 0.1375 -0.862 4.407 0.644 86.83 2.132 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9514E+00 0.4757E+02 0.8707 1.617 CH4,gas 0.2582E-06 0.1291E-04 1.0374 -4.873 H2,gas 0.1463E-06 0.7316E-05 1.0270 -5.124 H2S,gas 0.2167E-01 0.1083E+01 0.8293 -0.046 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1672E-08 0.8360E-07 1.0000 -7.078 SO3,gas 0.1534E-29 0.7672E-28 1.0000 -28.115 SO2,gas 0.4521E-12 0.2261E-10 1.0000 -10.646 HF,gas 0.1377E-06 0.6883E-05 1.0000 -5.162 HCl,gas 0.3686E-08 0.1843E-06 1.0000 -6.735 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.450631 % Solid products produced: Mass = 5.075541 g Volume = 2.384542 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: 7.1999900 moles log = 0.8573 Original solution: 1000.0103000 g Original solution / Rock added: 138.89 (Water/Rock Ratio), log = 2.1427 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 1 H2O,gas 1.70 1.70 0.00 0.000 0.00000E+00 2 CO2,gas -6.66 -6.66 0.00 0.000 0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 -0.15165E-11 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 -0.60662E-11 7 CO,gas 3.21 3.21 0.00 0.000 -0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-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 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 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 -0.92 -3.79 -0.632 0.64761E+04 69 diamond -3.10 -4.38 -1.28 -0.366 0.21843E+04 89 graphite -3.55 -4.38 -0.84 -0.239 0.14266E+04 92 halite 1.57 -3.30 -4.88 -2.438 0.83240E+04 145 pyrite -21.25 -21.51 -0.26 -0.061 0.44284E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.60 -1.05 -0.117 0.17926E+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: 0.2000000 MOLES Current total amount of reactant added: 7.1999900 MOLES New total amount of reactant added: 7.3999900 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 = 23 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 7.3999900 Water: Moles liquid = 0.5660E+02 kg liquid = 0.1020E+01 Moles total = 0.5590E+02 kg total = 0.1007E+01 Activity = 0.9921 Stoichiometric ionic strength = .2570646E+00 Osmotic coef. = 0.9150 True ionic strength = .4272942E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4380E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.23085E-01 -1.6367 0.18263E-01 -1.7384 0.79110E+00 -0.1018 2 H2O 0.99205E+00 -0.0035 0.99205E+00 -0.0035 3 Cl- 0.42672E-01 -1.3699 0.33403E-01 -1.4762 0.78277E+00 -0.1064 4 SO4-- 0.13933E-08 -8.8559 0.57485E-09 -9.2404 0.41257E+00 -0.3845 5 HCO3- 0.12536E-04 -4.9019 0.98379E-05 -5.0071 0.78479E+00 -0.1052 6 HS- 0.75171E-06 -6.1239 0.58857E-06 -6.2302 0.78297E+00 -0.1063 7 Al+++ 0.46252E-05 -5.3349 0.63646E-06 -6.1962 0.13761E+00 -0.8614 8 H4SiO4 0.10084E-02 -2.9964 0.10084E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19841E-06 -6.7024 0.80788E-07 -7.0927 0.40717E+00 -0.3902 10 Mg++ 0.79992E-10 -10.0970 0.32308E-10 -10.4907 0.40389E+00 -0.3937 11 Fe++ 0.31098E-07 -7.5073 0.12584E-07 -7.9002 0.40467E+00 -0.3929 12 K+ 0.13844E-03 -3.8587 0.10869E-03 -3.9638 0.78508E+00 -0.1051 13 Na+ 0.19477E-01 -1.7105 0.15240E-01 -1.8170 0.78246E+00 -0.1065 14 Mn++ 0.19962E-08 -8.6998 0.80899E-09 -9.0921 0.40526E+00 -0.3923 15 F- 0.29466E-04 -4.5307 0.22983E-04 -4.6386 0.77999E+00 -0.1079 16 HPO4-- 0.35864E-13 -13.4453 0.14800E-13 -13.8297 0.41267E+00 -0.3844 17 SiF6-2 0.13190E-12 -12.8797 0.54217E-13 -13.2659 0.41103E+00 -0.3861 18 HSiO3- 0.66393E-10 -10.1779 0.51971E-10 -10.2842 0.78277E+00 -0.1064 19 Ca(HSiO3)+ 0.12175E-15 -15.9145 0.95617E-16 -16.0195 0.78538E+00 -0.1049 20 Mg(HSiO3)+ 0.60593E-19 -19.2176 0.47588E-19 -19.3225 0.78538E+00 -0.1049 21 NaHSiO3,aq 0.12810E-10 -10.8924 0.12810E-10 -10.8924 0.10000E+01 0.0000 22 AlO+ 0.32792E-09 -9.4842 0.25754E-09 -9.5892 0.78538E+00 -0.1049 23 AlOH+2 0.57691E-07 -7.2389 0.23420E-07 -7.6304 0.40596E+00 -0.3915 24 HAlO2,aq 0.27860E-11 -11.5550 0.27860E-11 -11.5550 0.10000E+01 0.0000 25 AlO2- 0.43275E-15 -15.3638 0.33768E-15 -15.4715 0.78033E+00 -0.1077 26 CH4,aq 0.10271E-07 -7.9884 0.97065E-08 -8.0129 0.94504E+00 -0.0245 27 C2H6,aq 0.29301E-17 -17.5331 0.27690E-17 -17.5577 0.94504E+00 -0.0245 31 CO,aq 0.57000E-10 -10.2441 0.57000E-10 -10.2441 0.10000E+01 0.0000 32 CO2,aq 0.40949E+00 -0.3878 0.38698E+00 -0.4123 0.94504E+00 -0.0245 33 CO3-2 0.11447E-12 -12.9413 0.47052E-13 -13.3274 0.41103E+00 -0.3861 34 CaCO3,aq 0.47663E-16 -16.3218 0.47663E-16 -16.3218 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.25831E-10 -10.5879 0.20288E-10 -10.6928 0.78538E+00 -0.1049 36 CaCl+ 0.55604E-08 -8.2549 0.43670E-08 -8.3598 0.78538E+00 -0.1049 37 CaCl2,aq 0.34656E-10 -10.4602 0.34656E-10 -10.4602 0.10000E+01 0.0000 38 CaF+ 0.34516E-10 -10.4620 0.27109E-10 -10.5669 0.78538E+00 -0.1049 39 CaOH+ 0.39823E-15 -15.3999 0.31276E-15 -15.5048 0.78538E+00 -0.1049 40 CaSO4,aq 0.14747E-13 -13.8313 0.14747E-13 -13.8313 0.10000E+01 0.0000 41 HCl,aq 0.11178E-03 -3.9516 0.11178E-03 -3.9516 0.10000E+01 0.0000 45 HF,aq 0.28734E-02 -2.5416 0.28734E-02 -2.5416 0.10000E+01 0.0000 46 HF2- 0.28484E-07 -7.5454 0.22296E-07 -7.6518 0.78277E+00 -0.1064 47 Fe+3 0.17686E-17 -17.7524 0.24470E-18 -18.6114 0.13836E+00 -0.8590 48 FeCl+ 0.84715E-09 -9.0720 0.66534E-09 -9.1770 0.78538E+00 -0.1049 49 FeCl2,aq 0.70362E-15 -15.1527 0.70362E-15 -15.1527 0.10000E+01 0.0000 50 FeCl+2 0.14386E-17 -17.8421 0.58401E-18 -18.2336 0.40596E+00 -0.3915 51 FeF+ 0.18819E-10 -10.7254 0.14780E-10 -10.8303 0.78538E+00 -0.1049 52 FeF+2 0.12347E-15 -15.9084 0.50124E-16 -16.3000 0.40596E+00 -0.3915 54 FeOH+ 0.28332E-13 -13.5477 0.22251E-13 -13.6526 0.78538E+00 -0.1049 56 FeO+ 0.88605E-18 -18.0525 0.69589E-18 -18.1575 0.78538E+00 -0.1049 57 FeOH+2 0.59785E-17 -17.2234 0.24270E-17 -17.6149 0.40596E+00 -0.3915 60 H2,aq 0.61551E-08 -8.2108 0.58168E-08 -8.2353 0.94504E+00 -0.0245 61 KCl,aq 0.65798E-07 -7.1818 0.65798E-07 -7.1818 0.10000E+01 0.0000 62 KHSO4,aq 0.32261E-14 -14.4913 0.32261E-14 -14.4913 0.10000E+01 0.0000 63 KOH,aq 0.25213E-14 -14.5984 0.25213E-14 -14.5984 0.10000E+01 0.0000 64 KSO4- 0.12386E-11 -11.9071 0.96951E-12 -12.0134 0.78277E+00 -0.1064 66 Mg(HCO3)+ 0.10556E-13 -13.9765 0.82902E-14 -14.0814 0.78538E+00 -0.1049 67 MgCl+ 0.20154E-11 -11.6956 0.15829E-11 -11.8006 0.78538E+00 -0.1049 68 MgF+ 0.51133E-13 -13.2913 0.40158E-13 -13.3962 0.78538E+00 -0.1049 69 MgOH+ 0.88125E-18 -18.0549 0.69212E-18 -18.1598 0.78538E+00 -0.1049 71 MnF+ 0.39875E-12 -12.3993 0.31317E-12 -12.5042 0.78538E+00 -0.1049 73 MnOH+ 0.16920E-15 -15.7716 0.13288E-15 -15.8765 0.78538E+00 -0.1049 78 MnCl+ 0.21187E-09 -9.6739 0.16640E-09 -9.7788 0.78538E+00 -0.1049 79 MnSO4,aq 0.13426E-15 -15.8721 0.13426E-15 -15.8721 0.10000E+01 0.0000 80 NaCl,aq 0.16870E-03 -3.7729 0.16870E-03 -3.7729 0.10000E+01 0.0000 81 NaF,aq 0.82002E-07 -7.0862 0.82002E-07 -7.0862 0.10000E+01 0.0000 82 NaOH,aq 0.35568E-12 -12.4489 0.35568E-12 -12.4489 0.10000E+01 0.0000 84 OH- 0.40221E-10 -10.3956 0.31385E-10 -10.5033 0.78033E+00 -0.1077 90 H3PO3,aq 0.20015E-19 -19.6986 0.20015E-19 -19.6986 0.10000E+01 0.0000 91 H2PO3- 0.12653E-19 -19.8978 0.99040E-20 -20.0042 0.78277E+00 -0.1064 92 H3PO4,aq 0.34525E-07 -7.4619 0.34525E-07 -7.4619 0.10000E+01 0.0000 93 H2PO4- 0.63594E-08 -8.1966 0.49862E-08 -8.3022 0.78407E+00 -0.1056 95 H4P2O7,aq 0.15841E-16 -16.8002 0.15841E-16 -16.8002 0.10000E+01 0.0000 96 H3P2O7- 0.14147E-16 -16.8493 0.11074E-16 -16.9557 0.78277E+00 -0.1064 97 H2P2O7-2 0.47808E-17 -17.3205 0.19651E-17 -17.7066 0.41103E+00 -0.3861 100 H2S,aq 0.35153E-01 -1.4540 0.33221E-01 -1.4786 0.94504E+00 -0.0245 101 S2-2 0.32104E-14 -14.4934 0.13196E-14 -14.8796 0.41103E+00 -0.3861 102 S3-2 0.24702E-13 -13.6073 0.10153E-13 -13.9934 0.41103E+00 -0.3861 103 S3- 0.20820E-08 -8.6815 0.16297E-08 -8.7879 0.78277E+00 -0.1064 104 S4-2 0.12555E-12 -12.9012 0.51607E-13 -13.2873 0.41103E+00 -0.3861 105 S5-2 0.42553E-12 -12.3711 0.17491E-12 -12.7572 0.41103E+00 -0.3861 106 SO2,aq 0.50609E-11 -11.2958 0.50609E-11 -11.2958 0.10000E+01 0.0000 107 SO3-2 0.10391E-17 -17.9833 0.43801E-18 -18.3585 0.42152E+00 -0.3752 108 HSO3- 0.63985E-12 -12.1939 0.50085E-12 -12.3003 0.78277E+00 -0.1064 109 HSO4- 0.12860E-07 -7.8908 0.10118E-07 -7.9949 0.78677E+00 -0.1042 111 S2O3-2 0.55014E-12 -12.2595 0.22613E-12 -12.6456 0.41103E+00 -0.3861 112 HS2O3- 0.94332E-12 -12.0253 0.73840E-12 -12.1317 0.78277E+00 -0.1064 113 H2S2O3,aq 0.21619E-12 -12.6652 0.21619E-12 -12.6652 0.10000E+01 0.0000 Charge balance for all species = -.5401E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2308538E-01 0.4707103E+00 0.4645180E+03 0.0000 2 H2O 0.1000000E+01 0.5509876E+02 0.9718462E+06 0.0000 3 Cl- 0.4267245E-01 0.4295301E-01 0.1490942E+04 0.2622 4 SO4-- 0.1393342E-08 0.3737929E-08 0.3515564E-03 -5.7636 5 HCO3- 0.1253572E-04 0.4094995E+00 0.2446357E+05 -3.2687 6 HS- 0.7517104E-06 0.3515343E-01 0.1138262E+04 -4.4918 7 Al+++ 0.4625219E-05 0.4683240E-05 0.1237162E+00 -0.9809 8 H4SiO4 0.1008405E-02 0.1008405E-02 0.9489477E+02 -2.9964 9 Ca++ 0.1984143E-06 0.2040698E-06 0.8007536E-02 -3.6158 10 Mg++ 0.7999201E-10 0.8206912E-10 0.1953505E-05 -7.0138 11 Fe++ 0.3109760E-07 0.3196360E-07 0.1747711E-02 -4.4233 12 K+ 0.1384394E-03 0.1385052E-03 0.5302483E+01 -2.2254 13 Na+ 0.1947697E-01 0.1964575E-01 0.4421992E+03 -0.0786 14 Mn++ 0.1996228E-08 0.2208501E-08 0.1187913E-03 -5.6152 15 F- 0.2946553E-04 0.2902982E-02 0.5399659E+02 -2.9002 16 HPO4-- 0.3586430E-13 0.4088407E-07 0.3841886E-02 -10.3529 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7767674E+00 0.4799684E+00 0.1766000E+00 0.1201990E+00 2 H2O 0.5590478E+02 0.5618247E+02 -.1635296E+00 -.1141555E+00 3 Cl- 0.4379783E-01 0.4379782E-01 0.0000000E+00 0.4872879E-09 4 SO4-- 0.3531997E-01 0.3811448E-08 0.3532000E-01 -.3866745E-07 5 HCO3- 0.5350323E+00 0.4175537E+00 0.0000000E+00 0.1174786E+00 6 HS- 0.1445253E+00 0.3584484E-01 0.1059600E+00 0.2720450E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1028239E-02 0.1112478E-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 0.3259227E-07 0.0000000E+00 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- 0.2960096E-02 0.2960079E-02 0.0000000E+00 0.1742933E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2268E-16 Mass of aqueous solution: 0.104147E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 7.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.3323E-02 -2.478 0.5985E-01 -1.223 1.124 1.320 CO2,gas 0.1175 -0.930 5.170 0.714 97.13 63.27 CH4,gas 0.3402E-07 -7.468 0.5457E-06 -6.263 0.1025E-04 0.2196E-04 H2,gas 0.1837E-07 -7.736 0.3711E-07 -7.431 0.6972E-06 0.1170E-04 H2S,gas 0.2720E-02 -2.565 0.9271E-01 -1.033 1.742 1.385 S2,gas 0.1326E-11 -11.877 0.8502E-10 -10.070 0.1597E-08 0.8228E-09 CO,gas 0.2098E-09 -9.678 0.5878E-08 -8.231 0.1104E-06 0.1302E-06 SO3,gas 0.1805E-30 -30.743 0.1445E-28 -28.840 0.2715E-27 0.1120E-27 SO2,gas 0.5407E-13 -13.267 0.3463E-11 -11.460 0.6507E-10 0.3355E-10 HF,gas 0.1743E-07 -7.759 0.3486E-06 -6.458 0.6549E-05 0.1081E-04 HCl,gas 0.4873E-09 -9.312 0.1777E-07 -7.750 0.3338E-06 0.3024E-06 quartz 0.1112E-01 -1.954 0.6684 -0.175 12.86 0.2524 sulfur 0.1413 -0.850 4.529 0.656 87.14 2.191 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9511E+00 0.4755E+02 0.8707 1.617 CH4,gas 0.2754E-06 0.1377E-04 1.0374 -4.845 H2,gas 0.1487E-06 0.7436E-05 1.0270 -5.117 H2S,gas 0.2202E-01 0.1101E+01 0.8293 -0.039 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1699E-08 0.8494E-07 1.0000 -7.071 SO3,gas 0.1462E-29 0.7308E-28 1.0000 -28.136 SO2,gas 0.4377E-12 0.2189E-10 1.0000 -10.660 HF,gas 0.1411E-06 0.7055E-05 1.0000 -5.151 HCl,gas 0.3945E-08 0.1972E-06 1.0000 -6.705 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.505976 % Solid products produced: Mass = 5.197814 g Volume = 2.443718 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: 7.3999900 moles log = 0.8692 Original solution: 1000.0103000 g Original solution / Rock added: 135.14 (Water/Rock Ratio), log = 2.1308 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 1 H2O,gas 1.70 1.70 0.00 0.000 0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 0.00000E+00 3 CH4,gas 4.54 4.54 0.00 0.000 0.00000E+00 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.00000E+00 6 S2,gas -7.34 -7.34 0.00 0.000 0.60662E-11 7 CO,gas 3.21 3.21 0.00 0.000 -0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-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 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 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 -0.99 -3.86 -0.644 0.65935E+04 69 diamond -3.10 -4.37 -1.27 -0.362 0.21605E+04 89 graphite -3.55 -4.37 -0.82 -0.235 0.14028E+04 92 halite 1.57 -3.29 -4.87 -2.434 0.83116E+04 145 pyrite -21.25 -21.54 -0.30 -0.070 0.50773E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.71 -1.17 -0.130 0.19910E+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: 0.2000000 MOLES Current total amount of reactant added: 7.3999900 MOLES New total amount of reactant added: 7.5999900 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 = 20 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 7.5999900 Water: Moles liquid = 0.5678E+02 kg liquid = 0.1023E+01 Moles total = 0.5607E+02 kg total = 0.1010E+01 Activity = 0.9920 Stoichiometric ionic strength = .2578066E+00 Osmotic coef. = 0.9150 True ionic strength = .4373424E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4498E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.24156E-01 -1.6170 0.19076E-01 -1.7195 0.78970E+00 -0.1025 2 H2O 0.99205E+00 -0.0035 0.99205E+00 -0.0035 3 Cl- 0.43678E-01 -1.3597 0.34124E-01 -1.4669 0.78125E+00 -0.1072 4 SO4-- 0.12279E-08 -8.9108 0.50275E-09 -9.2986 0.40945E+00 -0.3878 5 HCO3- 0.12020E-04 -4.9201 0.94149E-05 -5.0262 0.78329E+00 -0.1061 6 HS- 0.73241E-06 -6.1352 0.57234E-06 -6.2423 0.78145E+00 -0.1071 7 Al+++ 0.46134E-05 -5.3360 0.62384E-06 -6.2049 0.13522E+00 -0.8689 8 H4SiO4 0.10084E-02 -2.9964 0.10084E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19770E-06 -6.7040 0.79868E-07 -7.0976 0.40399E+00 -0.3936 10 Mg++ 0.79708E-10 -10.0985 0.31938E-10 -10.4957 0.40069E+00 -0.3972 11 Fe++ 0.30986E-07 -7.5088 0.12440E-07 -7.9052 0.40148E+00 -0.3963 12 K+ 0.13800E-03 -3.8601 0.10813E-03 -3.9660 0.78359E+00 -0.1059 13 Na+ 0.19411E-01 -1.7119 0.15159E-01 -1.8193 0.78094E+00 -0.1074 14 Mn++ 0.19869E-08 -8.7018 0.79888E-09 -9.0975 0.40207E+00 -0.3957 15 F- 0.28949E-04 -4.5384 0.22535E-04 -4.6471 0.77844E+00 -0.1088 16 HPO4-- 0.33227E-13 -13.4785 0.13608E-13 -13.8662 0.40955E+00 -0.3877 17 SiF6-2 0.14059E-12 -12.8520 0.57348E-13 -13.2415 0.40790E+00 -0.3894 18 HSiO3- 0.63686E-10 -10.1960 0.49754E-10 -10.3032 0.78125E+00 -0.1072 19 Ca(HSiO3)+ 0.11545E-15 -15.9376 0.90498E-16 -16.0434 0.78389E+00 -0.1057 20 Mg(HSiO3)+ 0.57454E-19 -19.2407 0.45038E-19 -19.3464 0.78389E+00 -0.1057 21 NaHSiO3,aq 0.12199E-10 -10.9137 0.12199E-10 -10.9137 0.10000E+01 0.0000 22 AlO+ 0.29515E-09 -9.5300 0.23136E-09 -9.6357 0.78389E+00 -0.1057 23 AlOH+2 0.54563E-07 -7.2631 0.21977E-07 -7.6580 0.40277E+00 -0.3949 24 HAlO2,aq 0.23961E-11 -11.6205 0.23961E-11 -11.6205 0.10000E+01 0.0000 25 AlO2- 0.35703E-15 -15.4473 0.27804E-15 -15.5559 0.77877E+00 -0.1086 26 CH4,aq 0.10930E-07 -7.9614 0.10329E-07 -7.9860 0.94494E+00 -0.0246 27 C2H6,aq 0.32666E-17 -17.4859 0.30867E-17 -17.5105 0.94494E+00 -0.0246 31 CO,aq 0.57877E-10 -10.2375 0.57877E-10 -10.2375 0.10000E+01 0.0000 32 CO2,aq 0.40938E+00 -0.3879 0.38684E+00 -0.4125 0.94494E+00 -0.0246 33 CO3-2 0.10569E-12 -12.9760 0.43109E-13 -13.3654 0.40790E+00 -0.3894 34 CaCO3,aq 0.43172E-16 -16.3648 0.43172E-16 -16.3648 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.24486E-10 -10.6111 0.19194E-10 -10.7168 0.78389E+00 -0.1057 36 CaCl+ 0.56264E-08 -8.2498 0.44105E-08 -8.3555 0.78389E+00 -0.1057 37 CaCl2,aq 0.35756E-10 -10.4466 0.35756E-10 -10.4466 0.10000E+01 0.0000 38 CaF+ 0.33522E-10 -10.4747 0.26277E-10 -10.5804 0.78389E+00 -0.1057 39 CaOH+ 0.37762E-15 -15.4229 0.29602E-15 -15.5287 0.78389E+00 -0.1057 40 CaSO4,aq 0.12751E-13 -13.8945 0.12751E-13 -13.8945 0.10000E+01 0.0000 41 HCl,aq 0.11928E-03 -3.9234 0.11928E-03 -3.9234 0.10000E+01 0.0000 45 HF,aq 0.29428E-02 -2.5312 0.29428E-02 -2.5312 0.10000E+01 0.0000 46 HF2- 0.28659E-07 -7.5427 0.22390E-07 -7.6500 0.78125E+00 -0.1072 47 Fe+3 0.18438E-17 -17.7343 0.25071E-18 -18.6008 0.13598E+00 -0.8665 48 FeCl+ 0.85715E-09 -9.0669 0.67191E-09 -9.1727 0.78389E+00 -0.1057 49 FeCl2,aq 0.72591E-15 -15.1391 0.72591E-15 -15.1391 0.10000E+01 0.0000 50 FeCl+2 0.15176E-17 -17.8188 0.61126E-18 -18.2138 0.40277E+00 -0.3949 51 FeF+ 0.18275E-10 -10.7381 0.14326E-10 -10.8439 0.78389E+00 -0.1057 52 FeF+2 0.12501E-15 -15.9030 0.50353E-16 -16.2980 0.40277E+00 -0.3949 54 FeOH+ 0.26864E-13 -13.5708 0.21058E-13 -13.6766 0.78389E+00 -0.1057 56 FeO+ 0.83361E-18 -18.0790 0.65346E-18 -18.1848 0.78389E+00 -0.1057 57 FeOH+2 0.59104E-17 -17.2284 0.23806E-17 -17.6233 0.40277E+00 -0.3949 60 H2,aq 0.62526E-08 -8.2039 0.59084E-08 -8.2285 0.94494E+00 -0.0246 61 KCl,aq 0.66875E-07 -7.1747 0.66875E-07 -7.1747 0.10000E+01 0.0000 62 KHSO4,aq 0.29321E-14 -14.5328 0.29321E-14 -14.5328 0.10000E+01 0.0000 63 KOH,aq 0.24015E-14 -14.6195 0.24015E-14 -14.6195 0.10000E+01 0.0000 64 KSO4- 0.10798E-11 -11.9667 0.84358E-12 -12.0739 0.78125E+00 -0.1072 66 Mg(HCO3)+ 0.10005E-13 -13.9998 0.78430E-14 -14.1055 0.78389E+00 -0.1057 67 MgCl+ 0.20392E-11 -11.6905 0.15985E-11 -11.7963 0.78389E+00 -0.1057 68 MgF+ 0.49655E-13 -13.3040 0.38925E-13 -13.4098 0.78389E+00 -0.1057 69 MgOH+ 0.83559E-18 -18.0780 0.65502E-18 -18.1837 0.78389E+00 -0.1057 71 MnF+ 0.38682E-12 -12.4125 0.30323E-12 -12.5182 0.78389E+00 -0.1057 73 MnOH+ 0.16026E-15 -15.7952 0.12563E-15 -15.9009 0.78389E+00 -0.1057 78 MnCl+ 0.21415E-09 -9.6693 0.16787E-09 -9.7750 0.78389E+00 -0.1057 79 MnSO4,aq 0.11595E-15 -15.9357 0.11595E-15 -15.9357 0.10000E+01 0.0000 80 NaCl,aq 0.17143E-03 -3.7659 0.17143E-03 -3.7659 0.10000E+01 0.0000 81 NaF,aq 0.79976E-07 -7.0970 0.79976E-07 -7.0970 0.10000E+01 0.0000 82 NaOH,aq 0.33871E-12 -12.4702 0.33871E-12 -12.4702 0.10000E+01 0.0000 84 OH- 0.38582E-10 -10.4136 0.30047E-10 -10.5222 0.77877E+00 -0.1086 90 H3PO3,aq 0.20395E-19 -19.6905 0.20395E-19 -19.6905 0.10000E+01 0.0000 91 H2PO3- 0.12367E-19 -19.9077 0.96616E-20 -20.0150 0.78125E+00 -0.1072 92 H3PO4,aq 0.34634E-07 -7.4605 0.34634E-07 -7.4605 0.10000E+01 0.0000 93 H2PO4- 0.61192E-08 -8.2133 0.47887E-08 -8.3198 0.78257E+00 -0.1065 95 H4P2O7,aq 0.15941E-16 -16.7975 0.15941E-16 -16.7975 0.10000E+01 0.0000 96 H3P2O7- 0.13657E-16 -16.8647 0.10669E-16 -16.9719 0.78125E+00 -0.1072 97 H2P2O7-2 0.44435E-17 -17.3523 0.18125E-17 -17.7417 0.40790E+00 -0.3894 100 H2S,aq 0.35710E-01 -1.4472 0.33744E-01 -1.4718 0.94494E+00 -0.0246 101 S2-2 0.30118E-14 -14.5212 0.12285E-14 -14.9106 0.40790E+00 -0.3894 102 S3-2 0.23174E-13 -13.6350 0.94525E-14 -14.0245 0.40790E+00 -0.3894 103 S3- 0.20128E-08 -8.6962 0.15725E-08 -8.8034 0.78125E+00 -0.1072 104 S4-2 0.11779E-12 -12.9289 0.48044E-13 -13.3184 0.40790E+00 -0.3894 105 S5-2 0.39920E-12 -12.3988 0.16283E-12 -12.7883 0.40790E+00 -0.3894 106 SO2,aq 0.49052E-11 -11.3093 0.49052E-11 -11.3093 0.10000E+01 0.0000 107 SO3-2 0.92980E-18 -18.0316 0.38910E-18 -18.4099 0.41848E+00 -0.3783 108 HSO3- 0.59487E-12 -12.2256 0.46474E-12 -12.3328 0.78125E+00 -0.1072 109 HSO4- 0.11769E-07 -7.9292 0.92426E-08 -8.0342 0.78531E+00 -0.1050 111 S2O3-2 0.49247E-12 -12.3076 0.20088E-12 -12.6971 0.40790E+00 -0.3894 112 HS2O3- 0.87702E-12 -12.0570 0.68517E-12 -12.1642 0.78125E+00 -0.1072 113 H2S2O3,aq 0.20953E-12 -12.6787 0.20953E-12 -12.6787 0.10000E+01 0.0000 Charge balance for all species = -.5384E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2415629E-01 0.4723109E+00 0.4660741E+03 0.0000 2 H2O 0.1000000E+01 0.5509887E+02 0.9717991E+06 0.0000 3 Cl- 0.4367836E-01 0.4396914E-01 0.1526136E+04 0.2526 4 SO4-- 0.1227867E-08 0.1754531E-08 0.1650073E-03 -5.8596 5 HCO3- 0.1201962E-04 0.4093947E+00 0.2445608E+05 -3.3067 6 HS- 0.7324060E-06 0.3571053E-01 0.1156243E+04 -4.5228 7 Al+++ 0.4613398E-05 0.4668259E-05 0.1233143E+00 -1.0464 8 H4SiO4 0.1008389E-02 0.1008389E-02 0.9488846E+02 -2.9964 9 Ca++ 0.1976968E-06 0.2034170E-06 0.7981520E-02 -3.6586 10 Mg++ 0.7970772E-10 0.8180658E-10 0.1947158E-05 -7.0567 11 Fe++ 0.3098590E-07 0.3186135E-07 0.1742033E-02 -4.4662 12 K+ 0.1379953E-03 0.1380622E-03 0.5285255E+01 -2.2465 13 Na+ 0.1941140E-01 0.1958291E-01 0.4407625E+03 -0.0998 14 Mn++ 0.1986903E-08 0.2201437E-08 0.1184054E-03 -5.6585 15 F- 0.2894872E-04 0.2971899E-02 0.5527570E+02 -2.9276 16 HPO4-- 0.3322659E-13 0.4075328E-07 0.3829404E-02 -10.4272 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.7983024E+00 0.4831460E+00 0.1813751E+00 0.1337813E+00 2 H2O 0.5606852E+02 0.5636287E+02 -.1673430E+00 -.1270072E+00 3 Cl- 0.4497783E-01 0.4497782E-01 0.0000000E+00 0.5787314E-09 4 SO4-- 0.3627497E-01 0.1794781E-08 0.3627501E-01 -.4554463E-07 5 HCO3- 0.5494923E+00 0.4187865E+00 0.0000000E+00 0.1307058E+00 6 HS- 0.1484303E+00 0.3652975E-01 0.1088250E+00 0.3075507E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1031522E-02 0.1112150E-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 0.3259227E-07 0.0000000E+00 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- 0.3040096E-02 0.3040076E-02 0.0000000E+00 0.1986758E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.2532E-16 Mass of aqueous solution: 0.104486E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 7.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.3699E-02 -2.432 0.6661E-01 -1.176 1.124 1.469 CO2,gas 0.1307 -0.884 5.752 0.760 97.11 70.40 CH4,gas 0.4029E-07 -7.395 0.6463E-06 -6.190 0.1091E-04 0.2601E-04 H2,gas 0.2077E-07 -7.683 0.4195E-07 -7.377 0.7082E-06 0.1323E-04 H2S,gas 0.3075E-02 -2.512 0.1048 -0.980 1.769 1.566 S2,gas 0.1476E-11 -11.831 0.9463E-10 -10.024 0.1597E-08 0.9158E-09 CO,gas 0.2371E-09 -9.625 0.6642E-08 -8.178 0.1121E-06 0.1471E-06 SO3,gas 0.1917E-30 -30.717 0.1535E-28 -28.814 0.2591E-27 0.1190E-27 SO2,gas 0.5832E-13 -13.234 0.3736E-11 -11.428 0.6307E-10 0.3619E-10 HF,gas 0.1987E-07 -7.702 0.3974E-06 -6.401 0.6708E-05 0.1233E-04 HCl,gas 0.5787E-09 -9.238 0.2110E-07 -7.676 0.3562E-06 0.3591E-06 quartz 0.1112E-01 -1.954 0.6682 -0.175 12.56 0.2523 sulfur 0.1451 -0.838 4.652 0.668 87.44 2.251 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9507E+00 0.4754E+02 0.8707 1.617 CH4,gas 0.2931E-06 0.1465E-04 1.0374 -4.818 H2,gas 0.1511E-06 0.7553E-05 1.0270 -5.110 H2S,gas 0.2237E-01 0.1119E+01 0.8293 -0.033 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1725E-08 0.8625E-07 1.0000 -7.064 SO3,gas 0.1395E-29 0.6973E-28 1.0000 -28.157 SO2,gas 0.4242E-12 0.2121E-10 1.0000 -10.673 HF,gas 0.1445E-06 0.7226E-05 1.0000 -5.141 HCl,gas 0.4210E-08 0.2105E-06 1.0000 -6.677 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.560909 % Solid products produced: Mass = 5.320087 g Volume = 2.502894 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: 7.5999900 moles log = 0.8808 Original solution: 1000.0103000 g Original solution / Rock added: 131.58 (Water/Rock Ratio), log = 2.1192 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.30331E-11 4 H2,gas 8.00 8.00 0.00 0.000 0.00000E+00 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 -0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 0.26539E-11 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 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 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 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 -1.05 -3.93 -0.655 0.67053E+04 69 diamond -3.10 -4.35 -1.25 -0.358 0.21376E+04 89 graphite -3.55 -4.35 -0.81 -0.231 0.13799E+04 92 halite 1.57 -3.29 -4.86 -2.430 0.82998E+04 145 pyrite -21.25 -21.58 -0.33 -0.078 0.56931E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.82 -1.28 -0.142 0.21791E+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: 0.2000000 MOLES Current total amount of reactant added: 7.5999900 MOLES New total amount of reactant added: 7.7999900 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 = 20 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 7.7999900 Water: Moles liquid = 0.5696E+02 kg liquid = 0.1026E+01 Moles total = 0.5623E+02 kg total = 0.1013E+01 Activity = 0.9920 Stoichiometric ionic strength = .2585405E+00 Osmotic coef. = 0.9150 True ionic strength = .4473258E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4616E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.25220E-01 -1.5983 0.19882E-01 -1.7015 0.78833E+00 -0.1033 2 H2O 0.99204E+00 -0.0035 0.99204E+00 -0.0035 3 Cl- 0.44678E-01 -1.3499 0.34838E-01 -1.4579 0.77976E+00 -0.1080 4 SO4-- 0.10885E-08 -8.9632 0.44239E-09 -9.3542 0.40642E+00 -0.3910 5 HCO3- 0.11550E-04 -4.9374 0.90300E-05 -5.0443 0.78184E+00 -0.1069 6 HS- 0.71473E-06 -6.1459 0.55746E-06 -6.2538 0.77997E+00 -0.1079 7 Al+++ 0.46014E-05 -5.3371 0.61168E-06 -6.2135 0.13293E+00 -0.8764 8 H4SiO4 0.10084E-02 -2.9964 0.10084E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19699E-06 -6.7056 0.78975E-07 -7.1025 0.40092E+00 -0.3969 10 Mg++ 0.79426E-10 -10.1000 0.31579E-10 -10.5006 0.39759E+00 -0.4006 11 Fe++ 0.30875E-07 -7.5104 0.12300E-07 -7.9101 0.39838E+00 -0.3997 12 K+ 0.13755E-03 -3.8615 0.10759E-03 -3.9682 0.78214E+00 -0.1067 13 Na+ 0.19346E-01 -1.7134 0.15079E-01 -1.8216 0.77945E+00 -0.1082 14 Mn++ 0.19777E-08 -8.7038 0.78906E-09 -9.1029 0.39898E+00 -0.3990 15 F- 0.28482E-04 -4.5454 0.22128E-04 -4.6551 0.77692E+00 -0.1096 16 HPO4-- 0.30897E-13 -13.5101 0.12560E-13 -13.9010 0.40653E+00 -0.3909 17 SiF6-2 0.14984E-12 -12.8244 0.60664E-13 -13.2171 0.40486E+00 -0.3927 18 HSiO3- 0.61220E-10 -10.2131 0.47737E-10 -10.3211 0.77976E+00 -0.1080 19 Ca(HSiO3)+ 0.10973E-15 -15.9597 0.85859E-16 -16.0662 0.78245E+00 -0.1065 20 Mg(HSiO3)+ 0.54605E-19 -19.2628 0.42726E-19 -19.3693 0.78245E+00 -0.1065 21 NaHSiO3,aq 0.11643E-10 -10.9339 0.11643E-10 -10.9339 0.10000E+01 0.0000 22 AlO+ 0.26690E-09 -9.5736 0.20884E-09 -9.6802 0.78245E+00 -0.1065 23 AlOH+2 0.51728E-07 -7.2863 0.20675E-07 -7.6846 0.39969E+00 -0.3983 24 HAlO2,aq 0.20752E-11 -11.6829 0.20752E-11 -11.6829 0.10000E+01 0.0000 25 AlO2- 0.29725E-15 -15.5269 0.23104E-15 -15.6363 0.77726E+00 -0.1094 26 CH4,aq 0.11606E-07 -7.9353 0.10965E-07 -7.9600 0.94484E+00 -0.0246 27 C2H6,aq 0.36272E-17 -17.4404 0.34271E-17 -17.4651 0.94484E+00 -0.0246 31 CO,aq 0.58733E-10 -10.2311 0.58733E-10 -10.2311 0.10000E+01 0.0000 32 CO2,aq 0.40928E+00 -0.3880 0.38670E+00 -0.4126 0.94484E+00 -0.0246 33 CO3-2 0.97987E-13 -13.0088 0.39671E-13 -13.4015 0.40486E+00 -0.3927 34 CaCO3,aq 0.39285E-16 -16.4058 0.39285E-16 -16.4058 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.23265E-10 -10.6333 0.18204E-10 -10.7398 0.78245E+00 -0.1065 36 CaCl+ 0.56905E-08 -8.2448 0.44525E-08 -8.3514 0.78245E+00 -0.1065 37 CaCl2,aq 0.36853E-10 -10.4335 0.36853E-10 -10.4335 0.10000E+01 0.0000 38 CaF+ 0.32609E-10 -10.4867 0.25515E-10 -10.5932 0.78245E+00 -0.1065 39 CaOH+ 0.35893E-15 -15.4450 0.28084E-15 -15.5515 0.78245E+00 -0.1065 40 CaSO4,aq 0.11094E-13 -13.9549 0.11094E-13 -13.9549 0.10000E+01 0.0000 41 HCl,aq 0.12693E-03 -3.8965 0.12693E-03 -3.8965 0.10000E+01 0.0000 45 HF,aq 0.30118E-02 -2.5212 0.30118E-02 -2.5212 0.10000E+01 0.0000 46 HF2- 0.28856E-07 -7.5398 0.22501E-07 -7.6478 0.77976E+00 -0.1080 47 Fe+3 0.19181E-17 -17.7171 0.25642E-18 -18.5910 0.13369E+00 -0.8739 48 FeCl+ 0.86684E-09 -9.0621 0.67826E-09 -9.1686 0.78245E+00 -0.1065 49 FeCl2,aq 0.74811E-15 -15.1260 0.74811E-15 -15.1260 0.10000E+01 0.0000 50 FeCl+2 0.15969E-17 -17.7967 0.63828E-18 -18.1950 0.39969E+00 -0.3983 51 FeF+ 0.17776E-10 -10.7502 0.13909E-10 -10.8567 0.78245E+00 -0.1065 52 FeF+2 0.12652E-15 -15.8978 0.50570E-16 -16.2961 0.39969E+00 -0.3983 54 FeOH+ 0.25532E-13 -13.5929 0.19977E-13 -13.6995 0.78245E+00 -0.1065 56 FeO+ 0.78634E-18 -18.1044 0.61527E-18 -18.2109 0.78245E+00 -0.1065 57 FeOH+2 0.58448E-17 -17.2332 0.23361E-17 -17.6315 0.39969E+00 -0.3983 60 H2,aq 0.63481E-08 -8.1974 0.59979E-08 -8.2220 0.94484E+00 -0.0246 61 KCl,aq 0.67931E-07 -7.1679 0.67931E-07 -7.1679 0.10000E+01 0.0000 62 KHSO4,aq 0.26755E-14 -14.5726 0.26755E-14 -14.5726 0.10000E+01 0.0000 63 KOH,aq 0.22925E-14 -14.6397 0.22925E-14 -14.6397 0.10000E+01 0.0000 64 KSO4- 0.94716E-12 -12.0236 0.73856E-12 -12.1316 0.77976E+00 -0.1080 66 Mg(HCO3)+ 0.95057E-14 -14.0220 0.74377E-14 -14.1286 0.78245E+00 -0.1065 67 MgCl+ 0.20623E-11 -11.6857 0.16136E-11 -11.7922 0.78245E+00 -0.1065 68 MgF+ 0.48300E-13 -13.3161 0.37792E-13 -13.4226 0.78245E+00 -0.1065 69 MgOH+ 0.79417E-18 -18.1001 0.62139E-18 -18.2066 0.78245E+00 -0.1065 71 MnF+ 0.37587E-12 -12.4250 0.29410E-12 -12.5315 0.78245E+00 -0.1065 73 MnOH+ 0.15216E-15 -15.8177 0.11905E-15 -15.9243 0.78245E+00 -0.1065 78 MnCl+ 0.21634E-09 -9.6649 0.16928E-09 -9.7714 0.78245E+00 -0.1065 79 MnSO4,aq 0.10077E-15 -15.9966 0.10077E-15 -15.9966 0.10000E+01 0.0000 80 NaCl,aq 0.17410E-03 -3.7592 0.17410E-03 -3.7592 0.10000E+01 0.0000 81 NaF,aq 0.78120E-07 -7.1072 0.78120E-07 -7.1072 0.10000E+01 0.0000 82 NaOH,aq 0.32327E-12 -12.4904 0.32327E-12 -12.4904 0.10000E+01 0.0000 84 OH- 0.37090E-10 -10.4307 0.28829E-10 -10.5402 0.77726E+00 -0.1094 90 H3PO3,aq 0.20759E-19 -19.6828 0.20759E-19 -19.6828 0.10000E+01 0.0000 91 H2PO3- 0.12100E-19 -19.9172 0.94354E-20 -20.0252 0.77976E+00 -0.1080 92 H3PO4,aq 0.34726E-07 -7.4594 0.34726E-07 -7.4594 0.10000E+01 0.0000 93 H2PO4- 0.58978E-08 -8.2293 0.46068E-08 -8.3366 0.78111E+00 -0.1073 95 H4P2O7,aq 0.16026E-16 -16.7952 0.16026E-16 -16.7952 0.10000E+01 0.0000 96 H3P2O7- 0.13198E-16 -16.8795 0.10291E-16 -16.9875 0.77976E+00 -0.1080 97 H2P2O7-2 0.41432E-17 -17.3827 0.16774E-17 -17.7754 0.40486E+00 -0.3927 100 H2S,aq 0.36255E-01 -1.4406 0.34255E-01 -1.4653 0.94484E+00 -0.0246 101 S2-2 0.28357E-14 -14.5473 0.11481E-14 -14.9400 0.40486E+00 -0.3927 102 S3-2 0.21819E-13 -13.6612 0.88337E-14 -14.0539 0.40486E+00 -0.3927 103 S3- 0.19495E-08 -8.7101 0.15201E-08 -8.8181 0.77976E+00 -0.1080 104 S4-2 0.11090E-12 -12.9551 0.44899E-13 -13.3478 0.40486E+00 -0.3927 105 S5-2 0.37586E-12 -12.4250 0.15217E-12 -12.8177 0.40486E+00 -0.3927 106 SO2,aq 0.47597E-11 -11.3224 0.47597E-11 -11.3224 0.10000E+01 0.0000 107 SO3-2 0.83647E-18 -18.0776 0.34758E-18 -18.4590 0.41553E+00 -0.3814 108 HSO3- 0.55489E-12 -12.2558 0.43268E-12 -12.3638 0.77976E+00 -0.1080 109 HSO4- 0.10813E-07 -7.9660 0.84764E-08 -8.0718 0.78388E+00 -0.1058 111 S2O3-2 0.44322E-12 -12.3534 0.17944E-12 -12.7461 0.40486E+00 -0.3927 112 HS2O3- 0.81807E-12 -12.0872 0.63790E-12 -12.1952 0.77976E+00 -0.1080 113 H2S2O3,aq 0.20332E-12 -12.6918 0.20332E-12 -12.6918 0.10000E+01 0.0000 Charge balance for all species = -.5367E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2522028E-01 0.4738950E+00 0.4676140E+03 0.0000 2 H2O 0.1000000E+01 0.5509897E+02 0.9717525E+06 0.0000 3 Cl- 0.4467770E-01 0.4497880E-01 0.1561103E+04 0.2436 4 SO4-- 0.1088493E-08 -.7996376E-10 -.7519929E-05 -5.9511 5 HCO3- 0.1154972E-04 0.4092926E+00 0.2444876E+05 -3.3428 6 HS- 0.7147255E-06 0.3625562E-01 0.1173833E+04 -4.5522 7 Al+++ 0.4601377E-05 0.4653374E-05 0.1229149E+00 -1.1089 8 H4SiO4 0.1008373E-02 0.1008373E-02 0.9488223E+02 -2.9964 9 Ca++ 0.1969851E-06 0.2027684E-06 0.7955673E-02 -3.6994 10 Mg++ 0.7942564E-10 0.8154573E-10 0.1940853E-05 -7.0975 11 Fe++ 0.3087511E-07 0.3175975E-07 0.1736392E-02 -4.5070 12 K+ 0.1375540E-03 0.1376219E-03 0.5268140E+01 -2.2667 13 Na+ 0.1934629E-01 0.1952046E-01 0.4393352E+03 -0.1201 14 Mn++ 0.1977696E-08 0.2194417E-08 0.1180219E-03 -5.6998 15 F- 0.2848176E-04 0.3040376E-02 0.5654653E+02 -2.9535 16 HPO4-- 0.3089694E-13 0.4062333E-07 0.3817003E-02 -10.4979 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.8198374E+00 0.4863171E+00 0.1861501E+00 0.1473701E+00 2 H2O 0.5623226E+02 0.5654327E+02 -.1711565E+00 -.1398567E+00 3 Cl- 0.4615783E-01 0.4615782E-01 0.0000000E+00 0.6783579E-09 4 SO4-- 0.3722997E-01 -.8205984E-10 0.3723002E-01 -.5299487E-07 5 HCO3- 0.5639523E+00 0.4200214E+00 0.0000000E+00 0.1439310E+00 6 HS- 0.1523353E+00 0.3720599E-01 0.1116901E+00 0.3439248E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1034805E-02 0.1111821E-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 0.3259227E-07 0.0000000E+00 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- 0.3120096E-02 0.3120074E-02 0.0000000E+00 0.2239838E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4246E-17 Mass of aqueous solution: 0.104825E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 7.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.4074E-02 -2.390 0.7338E-01 -1.134 1.125 1.618 CO2,gas 0.1439 -0.842 6.334 0.802 97.08 77.52 CH4,gas 0.4712E-07 -7.327 0.7559E-06 -6.122 0.1158E-04 0.3042E-04 H2,gas 0.2322E-07 -7.634 0.4691E-07 -7.329 0.7190E-06 0.1479E-04 H2S,gas 0.3439E-02 -2.464 0.1172 -0.931 1.796 1.751 S2,gas 0.1626E-11 -11.789 0.1042E-09 -9.982 0.1598E-08 0.1009E-08 CO,gas 0.2651E-09 -9.577 0.7425E-08 -8.129 0.1138E-06 0.1645E-06 SO3,gas 0.2019E-30 -30.695 0.1616E-28 -28.791 0.2477E-27 0.1253E-27 SO2,gas 0.6234E-13 -13.205 0.3994E-11 -11.399 0.6121E-10 0.3868E-10 HF,gas 0.2240E-07 -7.650 0.4480E-06 -6.349 0.6865E-05 0.1390E-04 HCl,gas 0.6784E-09 -9.169 0.2473E-07 -7.607 0.3790E-06 0.4209E-06 quartz 0.1112E-01 -1.954 0.6680 -0.175 12.27 0.2523 sulfur 0.1489 -0.827 4.774 0.679 87.73 2.310 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9504E+00 0.4752E+02 0.8707 1.617 CH4,gas 0.3112E-06 0.1556E-04 1.0374 -4.792 H2,gas 0.1534E-06 0.7668E-05 1.0270 -5.104 H2S,gas 0.2271E-01 0.1135E+01 0.8293 -0.026 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1750E-08 0.8752E-07 1.0000 -7.058 SO3,gas 0.1333E-29 0.6665E-28 1.0000 -28.176 SO2,gas 0.4117E-12 0.2058E-10 1.0000 -10.686 HF,gas 0.1479E-06 0.7395E-05 1.0000 -5.131 HCl,gas 0.4479E-08 0.2240E-06 1.0000 -6.650 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.615436 % Solid products produced: Mass = 5.442360 g Volume = 2.562069 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: 7.7999900 moles log = 0.8921 Original solution: 1000.0103000 g Original solution / Rock added: 128.21 (Water/Rock Ratio), log = 2.1079 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.75827E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 0.15165E-11 4 H2,gas 8.00 8.00 0.00 0.000 -0.15165E-11 5 H2S,gas -6.23 -6.23 0.00 0.000 0.00000E+00 6 S2,gas -7.34 -7.34 0.00 0.000 0.00000E+00 7 CO,gas 3.21 3.21 0.00 0.000 0.75827E-12 8 SO3,gas 17.12 17.12 0.00 0.000 0.00000E+00 9 SO2,gas 0.83 0.83 0.00 0.000 0.26539E-11 10 HF,gas 0.47 0.47 0.00 0.000 0.37914E-12 11 HCl,gas 5.19 5.19 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 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 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 -3.99 -0.665 0.68120E+04 69 diamond -3.10 -4.34 -1.24 -0.354 0.21156E+04 89 graphite -3.55 -4.34 -0.80 -0.227 0.13578E+04 92 halite 1.57 -3.28 -4.85 -2.427 0.82883E+04 145 pyrite -21.25 -21.61 -0.37 -0.087 0.62791E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -17.93 -1.38 -0.153 0.23581E+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: 0.2000000 MOLES Current total amount of reactant added: 7.7999900 MOLES New total amount of reactant added: 7.9999900 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 = 20 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 7.9999900 Water: Moles liquid = 0.5714E+02 kg liquid = 0.1029E+01 Moles total = 0.5640E+02 kg total = 0.1016E+01 Activity = 0.9920 Stoichiometric ionic strength = .2592667E+00 Osmotic coef. = 0.9149 True ionic strength = .4572451E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4734E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.26277E-01 -1.5804 0.20680E-01 -1.6844 0.78700E+00 -0.1040 2 H2O 0.99203E+00 -0.0035 0.99203E+00 -0.0035 3 Cl- 0.45671E-01 -1.3404 0.35546E-01 -1.4492 0.77832E+00 -0.1088 4 SO4-- 0.97022E-09 -9.0131 0.39147E-09 -9.4073 0.40349E+00 -0.3942 5 HCO3- 0.11120E-04 -4.9539 0.86783E-05 -5.0616 0.78042E+00 -0.1077 6 HS- 0.69846E-06 -6.1559 0.54377E-06 -6.2646 0.77853E+00 -0.1087 7 Al+++ 0.45892E-05 -5.3383 0.59997E-06 -6.2219 0.13074E+00 -0.8836 8 H4SiO4 0.10084E-02 -2.9964 0.10084E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19628E-06 -6.7071 0.78107E-07 -7.1073 0.39794E+00 -0.4002 10 Mg++ 0.79146E-10 -10.1016 0.31229E-10 -10.5054 0.39458E+00 -0.4039 11 Fe++ 0.30765E-07 -7.5119 0.12164E-07 -7.9149 0.39538E+00 -0.4030 12 K+ 0.13712E-03 -3.8629 0.10705E-03 -3.9704 0.78072E+00 -0.1075 13 Na+ 0.19282E-01 -1.7149 0.15001E-01 -1.8239 0.77800E+00 -0.1090 14 Mn++ 0.19686E-08 -8.7058 0.77954E-09 -9.1082 0.39598E+00 -0.4023 15 F- 0.28058E-04 -4.5519 0.21757E-04 -4.6624 0.77544E+00 -0.1105 16 HPO4-- 0.28828E-13 -13.5402 0.11635E-13 -13.9342 0.40359E+00 -0.3941 17 SiF6-2 0.15966E-12 -12.7968 0.64168E-13 -13.1927 0.40191E+00 -0.3959 18 HSiO3- 0.58966E-10 -10.2294 0.45894E-10 -10.3382 0.77832E+00 -0.1088 19 Ca(HSiO3)+ 0.10452E-15 -15.9808 0.81636E-16 -16.0881 0.78104E+00 -0.1073 20 Mg(HSiO3)+ 0.52010E-19 -19.2839 0.40621E-19 -19.3912 0.78104E+00 -0.1073 21 NaHSiO3,aq 0.11135E-10 -10.9533 0.11135E-10 -10.9533 0.10000E+01 0.0000 22 AlO+ 0.24241E-09 -9.6155 0.18933E-09 -9.7228 0.78104E+00 -0.1073 23 AlOH+2 0.49146E-07 -7.3085 0.19496E-07 -7.7101 0.39670E+00 -0.4015 24 HAlO2,aq 0.18087E-11 -11.7426 0.18087E-11 -11.7426 0.10000E+01 0.0000 25 AlO2- 0.24955E-15 -15.6028 0.19359E-15 -15.7131 0.77578E+00 -0.1103 26 CH4,aq 0.12296E-07 -7.9102 0.11616E-07 -7.9349 0.94474E+00 -0.0247 27 C2H6,aq 0.40124E-17 -17.3966 0.37907E-17 -17.4213 0.94474E+00 -0.0247 31 CO,aq 0.59571E-10 -10.2250 0.59571E-10 -10.2250 0.10000E+01 0.0000 32 CO2,aq 0.40918E+00 -0.3881 0.38657E+00 -0.4128 0.94474E+00 -0.0247 33 CO3-2 0.91199E-13 -13.0400 0.36654E-13 -13.4359 0.40191E+00 -0.3959 34 CaCO3,aq 0.35898E-16 -16.4449 0.35898E-16 -16.4449 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.22153E-10 -10.6546 0.17302E-10 -10.7619 0.78104E+00 -0.1073 36 CaCl+ 0.57527E-08 -8.2401 0.44931E-08 -8.3475 0.78104E+00 -0.1073 37 CaCl2,aq 0.37944E-10 -10.4209 0.37944E-10 -10.4209 0.10000E+01 0.0000 38 CaF+ 0.31767E-10 -10.4980 0.24811E-10 -10.6053 0.78104E+00 -0.1073 39 CaOH+ 0.34189E-15 -15.4661 0.26703E-15 -15.5734 0.78104E+00 -0.1073 40 CaSO4,aq 0.97095E-14 -14.0128 0.97095E-14 -14.0128 0.10000E+01 0.0000 41 HCl,aq 0.13471E-03 -3.8706 0.13471E-03 -3.8706 0.10000E+01 0.0000 45 HF,aq 0.30802E-02 -2.5114 0.30802E-02 -2.5114 0.10000E+01 0.0000 46 HF2- 0.29071E-07 -7.5365 0.22627E-07 -7.6454 0.77832E+00 -0.1088 47 Fe+3 0.19915E-17 -17.7008 0.26186E-18 -18.5819 0.13149E+00 -0.8811 48 FeCl+ 0.87625E-09 -9.0574 0.68439E-09 -9.1647 0.78104E+00 -0.1073 49 FeCl2,aq 0.77021E-15 -15.1134 0.77021E-15 -15.1134 0.10000E+01 0.0000 50 FeCl+2 0.16765E-17 -17.7756 0.66507E-18 -18.1771 0.39670E+00 -0.4015 51 FeF+ 0.17316E-10 -10.7616 0.13524E-10 -10.8689 0.78104E+00 -0.1073 52 FeF+2 0.12800E-15 -15.8928 0.50778E-16 -16.2943 0.39670E+00 -0.4015 54 FeOH+ 0.24318E-13 -13.6141 0.18993E-13 -13.7214 0.78104E+00 -0.1073 56 FeO+ 0.74355E-18 -18.1287 0.58074E-18 -18.2360 0.78104E+00 -0.1073 57 FeOH+2 0.57816E-17 -17.2380 0.22935E-17 -17.6395 0.39670E+00 -0.4015 60 H2,aq 0.64415E-08 -8.1910 0.60855E-08 -8.2157 0.94474E+00 -0.0247 61 KCl,aq 0.68966E-07 -7.1614 0.68966E-07 -7.1614 0.10000E+01 0.0000 62 KHSO4,aq 0.24503E-14 -14.6108 0.24503E-14 -14.6108 0.10000E+01 0.0000 63 KOH,aq 0.21930E-14 -14.6590 0.21930E-14 -14.6590 0.10000E+01 0.0000 64 KSO4- 0.83551E-12 -12.0780 0.65029E-12 -12.1869 0.77832E+00 -0.1088 66 Mg(HCO3)+ 0.90507E-14 -14.0433 0.70690E-14 -14.1506 0.78104E+00 -0.1073 67 MgCl+ 0.20847E-11 -11.6810 0.16282E-11 -11.7883 0.78104E+00 -0.1073 68 MgF+ 0.47050E-13 -13.3274 0.36748E-13 -13.4348 0.78104E+00 -0.1073 69 MgOH+ 0.75642E-18 -18.1212 0.59079E-18 -18.2286 0.78104E+00 -0.1073 71 MnF+ 0.36577E-12 -12.4368 0.28568E-12 -12.5441 0.78104E+00 -0.1073 73 MnOH+ 0.14478E-15 -15.8393 0.11308E-15 -15.9466 0.78104E+00 -0.1073 78 MnCl+ 0.21847E-09 -9.6606 0.17063E-09 -9.7679 0.78104E+00 -0.1073 79 MnSO4,aq 0.88099E-16 -16.0550 0.88099E-16 -16.0550 0.10000E+01 0.0000 80 NaCl,aq 0.17671E-03 -3.7527 0.17671E-03 -3.7527 0.10000E+01 0.0000 81 NaF,aq 0.76412E-07 -7.1168 0.76412E-07 -7.1168 0.10000E+01 0.0000 82 NaOH,aq 0.30917E-12 -12.5098 0.30917E-12 -12.5098 0.10000E+01 0.0000 84 OH- 0.35726E-10 -10.4470 0.27716E-10 -10.5573 0.77578E+00 -0.1103 90 H3PO3,aq 0.21108E-19 -19.6755 0.21108E-19 -19.6755 0.10000E+01 0.0000 91 H2PO3- 0.11851E-19 -19.9262 0.92238E-20 -20.0351 0.77832E+00 -0.1088 92 H3PO4,aq 0.34801E-07 -7.4584 0.34801E-07 -7.4584 0.10000E+01 0.0000 93 H2PO4- 0.56929E-08 -8.2447 0.44386E-08 -8.3528 0.77968E+00 -0.1081 95 H4P2O7,aq 0.16096E-16 -16.7933 0.16096E-16 -16.7933 0.10000E+01 0.0000 96 H3P2O7- 0.12767E-16 -16.8939 0.99370E-17 -17.0027 0.77832E+00 -0.1088 97 H2P2O7-2 0.38745E-17 -17.4118 0.15572E-17 -17.8077 0.40191E+00 -0.3959 100 H2S,aq 0.36788E-01 -1.4343 0.34755E-01 -1.4590 0.94474E+00 -0.0247 101 S2-2 0.26788E-14 -14.5721 0.10766E-14 -14.9679 0.40191E+00 -0.3959 102 S3-2 0.20612E-13 -13.6859 0.82840E-14 -14.0818 0.40191E+00 -0.3959 103 S3- 0.18914E-08 -8.7232 0.14721E-08 -8.8321 0.77832E+00 -0.1088 104 S4-2 0.10476E-12 -12.9798 0.42105E-13 -13.3757 0.40191E+00 -0.3959 105 S5-2 0.35506E-12 -12.4497 0.14270E-12 -12.8456 0.40191E+00 -0.3959 106 SO2,aq 0.46236E-11 -11.3350 0.46236E-11 -11.3350 0.10000E+01 0.0000 107 SO3-2 0.75622E-18 -18.1214 0.31207E-18 -18.5058 0.41267E+00 -0.3844 108 HSO3- 0.51917E-12 -12.2847 0.40408E-12 -12.3935 0.77832E+00 -0.1088 109 HSO4- 0.99708E-08 -8.0013 0.78020E-08 -8.1078 0.78249E+00 -0.1065 111 S2O3-2 0.40085E-12 -12.3970 0.16111E-12 -12.7929 0.40191E+00 -0.3959 112 HS2O3- 0.76540E-12 -12.1161 0.59573E-12 -12.2250 0.77832E+00 -0.1088 113 H2S2O3,aq 0.19750E-12 -12.7044 0.19750E-12 -12.7044 0.10000E+01 0.0000 Charge balance for all species = -.5350E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2627739E-01 0.4754627E+00 0.4691378E+03 0.0000 2 H2O 0.1000000E+01 0.5509907E+02 0.9717064E+06 0.0000 3 Cl- 0.4567054E-01 0.4598204E-01 0.1595844E+04 0.2352 4 SO4-- 0.9702212E-09 -.1791394E-08 -.1684574E-03 -6.0384 5 HCO3- 0.1112003E-04 0.4091931E+00 0.2444161E+05 -3.3771 6 HS- 0.6984608E-06 0.3678907E-01 0.1191046E+04 -4.5801 7 Al+++ 0.4589192E-05 0.4638583E-05 0.1225182E+00 -1.1685 8 H4SiO4 0.1008357E-02 0.1008357E-02 0.9487608E+02 -2.9964 9 Ca++ 0.1962792E-06 0.2021238E-06 0.7929994E-02 -3.7384 10 Mg++ 0.7914574E-10 0.8128653E-10 0.1934588E-05 -7.1366 11 Fe++ 0.3076521E-07 0.3165880E-07 0.1730787E-02 -4.5460 12 K+ 0.1371155E-03 0.1371845E-03 0.5251136E+01 -2.2860 13 Na+ 0.1928163E-01 0.1945842E-01 0.4379171E+03 -0.1394 14 Mn++ 0.1968605E-08 0.2187442E-08 0.1176410E-03 -5.7393 15 F- 0.2805813E-04 0.3108419E-02 0.5780916E+02 -2.9780 16 HPO4-- 0.2882780E-13 0.4049421E-07 0.3804683E-02 -10.5654 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.8413724E+00 0.4894818E+00 0.1909252E+00 0.1609654E+00 2 H2O 0.5639600E+02 0.5672367E+02 -.1749700E+00 -.1527040E+00 3 Cl- 0.4733783E-01 0.4733782E-01 0.0000000E+00 0.7863577E-09 4 SO4-- 0.3818497E-01 -.1844213E-08 0.3818503E-01 -.6103280E-07 5 HCO3- 0.5784123E+00 0.4212582E+00 0.0000000E+00 0.1571541E+00 6 HS- 0.1562403E+00 0.3787381E-01 0.1145551E+00 0.3811397E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1038089E-02 0.1111493E-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 0.3259227E-07 0.0000000E+00 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- 0.3200096E-02 0.3200071E-02 0.0000000E+00 0.2502085E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4822E-18 Mass of aqueous solution: 0.105165E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 7.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.4450E-02 -2.352 0.8014E-01 -1.096 1.125 1.767 CO2,gas 0.1572 -0.804 6.916 0.840 97.05 84.64 CH4,gas 0.5453E-07 -7.263 0.8746E-06 -6.058 0.1227E-04 0.3520E-04 H2,gas 0.2574E-07 -7.589 0.5199E-07 -7.284 0.7295E-06 0.1639E-04 H2S,gas 0.3811E-02 -2.419 0.1299 -0.886 1.823 1.940 S2,gas 0.1776E-11 -11.751 0.1139E-09 -9.944 0.1598E-08 0.1102E-08 CO,gas 0.2937E-09 -9.532 0.8226E-08 -8.085 0.1154E-06 0.1822E-06 SO3,gas 0.2111E-30 -30.675 0.1690E-28 -28.772 0.2372E-27 0.1310E-27 SO2,gas 0.6615E-13 -13.179 0.4237E-11 -11.373 0.5946E-10 0.4104E-10 HF,gas 0.2502E-07 -7.602 0.5004E-06 -6.301 0.7022E-05 0.1553E-04 HCl,gas 0.7864E-09 -9.104 0.2867E-07 -7.543 0.4023E-06 0.4879E-06 quartz 0.1111E-01 -1.954 0.6678 -0.175 12.00 0.2522 sulfur 0.1527 -0.816 4.897 0.690 88.00 2.369 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2690E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9501E+00 0.4750E+02 0.8707 1.617 CH4,gas 0.3296E-06 0.1648E-04 1.0374 -4.767 H2,gas 0.1556E-06 0.7780E-05 1.0270 -5.097 H2S,gas 0.2304E-01 0.1152E+01 0.8293 -0.020 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1775E-08 0.8877E-07 1.0000 -7.052 SO3,gas 0.1276E-29 0.6381E-28 1.0000 -28.195 SO2,gas 0.3999E-12 0.1999E-10 1.0000 -10.699 HF,gas 0.1513E-06 0.7563E-05 1.0000 -5.121 HCl,gas 0.4754E-08 0.2377E-06 1.0000 -6.624 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 sulfur 0.1000E+01 0.1000E+01 1.0000 0.000 Current weight percent of gas: 0.669559 % Solid products produced: Mass = 5.564633 g Volume = 2.621245 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: 7.9999900 moles log = 0.9031 Original solution: 1000.0103000 g Original solution / Rock added: 125.00 (Water/Rock Ratio), log = 2.0969 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 1 H2O,gas 1.70 1.70 0.00 0.000 -0.37914E-12 2 CO2,gas -6.66 -6.66 0.00 0.000 -0.15165E-11 3 CH4,gas 4.54 4.54 0.00 0.000 -0.15165E-11 4 H2,gas 8.00 8.00 0.00 0.000 -0.15165E-11 5 H2S,gas -6.23 -6.23 0.00 0.000 0.15165E-11 6 S2,gas -7.34 -7.34 0.00 0.000 -0.60662E-11 7 CO,gas 3.21 3.21 0.00 0.000 0.22748E-11 8 SO3,gas 17.12 17.12 0.00 0.000 0.60662E-11 9 SO2,gas 0.83 0.83 0.00 0.000 -0.37914E-12 10 HF,gas 0.47 0.47 0.00 0.000 -0.11374E-11 11 HCl,gas 5.19 5.19 0.00 0.000 0.15165E-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 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 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 -1.18 -4.05 -0.675 0.69139E+04 69 diamond -3.10 -4.33 -1.23 -0.350 0.20943E+04 89 graphite -3.55 -4.33 -0.78 -0.224 0.13366E+04 92 halite 1.57 -3.27 -4.85 -2.424 0.82772E+04 145 pyrite -21.25 -21.65 -0.40 -0.094 0.68380E+03 181 tridymite -2.63 -2.99 -0.36 -0.121 0.61998E+03 202 chalcedony -2.80 -2.99 -0.19 -0.062 0.31930E+03 214 topaz -16.55 -18.03 -1.48 -0.165 0.25286E+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: 0.2000000 MOLES Current total amount of reactant added: 7.9999900 MOLES New total amount of reactant added: 8.1999900 MOLES Mixing fraction reached given limit of 0.8000E+01 TOTMIX = 0.8200E+01 Execution stopped.