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. 0.84137E+00 0.26277E-01 0.7870 0.00000000E+00 H2O 2 0. 0.56396E+02 0.10000E+01 0.9920 0.00000000E+00 Cl- 3 -1. 0.47338E-01 0.45671E-01 0.7783 0.00000000E+00 SO4-- 4 -2. 0.38185E-01 0.97022E-09 0.4035 0.00000000E+00 HCO3- 5 -1. 0.57841E+00 0.11120E-04 0.7804 0.00000000E+00 HS- 6 -1. 0.15624E+00 0.69846E-06 0.7785 0.00000000E+00 Al+++ 7 3. 0.47754E-05 0.45892E-05 0.1307 0.00000000E+00 H4SiO4 8 0. 0.12153E-01 0.10084E-02 1.0000 0.00000000E+00 Ca++ 9 2. 0.20808E-06 0.19628E-06 0.3979 0.00000000E+00 Mg++ 10 2. 0.83683E-10 0.79146E-10 0.3946 0.00000000E+00 Fe++ 11 2. 0.32592E-07 0.30765E-07 0.3954 0.00000000E+00 K+ 12 1. 0.14123E-03 0.13712E-03 0.7807 0.00000000E+00 Na+ 13 1. 0.20032E-01 0.19282E-01 0.7780 0.00000000E+00 Mn++ 14 2. 0.22519E-08 0.19686E-08 0.3960 0.00000000E+00 F- 15 -1. 0.32001E-02 0.28058E-04 0.7754 0.00000000E+00 HPO4-- 16 -2. 0.41688E-07 0.28828E-13 0.4036 0.00000000E+00 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4734E-05 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 50.0000 SLIM = 0.200000E+02 TEMP = 100.0000 SINC = 0.4000E+00 TEMPC = 0.0000 TOTMIX = 0.799999E+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 0.4450E-02 osumilite(1) 126 21.717 0.0000E+00 CO2,gas 2 -6.660 0.1572E+00 osumilite(2) 127 20.667 0.0000E+00 CH4,gas 3 4.544 0.5453E-07 osumilite-Fe 128 14.390 0.0000E+00 H2,gas 4 8.000 0.2574E-07 pargasite 129 65.092 0.0000E+00 H2S,gas 5 -6.230 0.3811E-02 periclase 130 16.138 0.0000E+00 S2,gas 6 -7.335 0.1776E-11 periclase-Fe 131 11.627 0.0000E+00 CO,gas 7 3.215 0.2937E-09 perovskite-Al 132 12.344 0.0000E+00 SO3,gas 8 17.121 0.2111E-30 perovskite-Ca 133 23.807 0.0000E+00 SO2,gas 9 0.832 0.6615E-13 perovskite-Fe 134 21.143 0.0000E+00 HF,gas 10 0.473 0.2502E-07 perovskite-Mg 135 23.119 0.0000E+00 HCl,gas 11 5.189 0.7864E-09 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 0.0000E+00 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 0.1111E-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 0.1527E+00 chondrodite 48 56.475 0.0000E+00 sylvite 173 1.338 0.0000E+00 clinochlore 49 39.070 0.0000E+00 talc 174 16.491 0.0000E+00 daphnite 50 28.965 0.0000E+00 talc-Fe 175 13.448 0.0000E+00 chlorite-Mn 51 46.869 0.0000E+00 talc-tschermaks 176 19.091 0.0000E+00 chlorite-Al-free 52 47.173 0.0000E+00 tephroite 177 18.086 0.0000E+00 chloritoid-Mg 53 13.198 0.0000E+00 tilleyite 178 41.377 0.0000E+00 chloritoid-Fe 54 9.174 0.0000E+00 titanite-CaSi 179 15.479 0.0000E+00 chloritoid-Mn 55 11.401 0.0000E+00 topaz-H 180 4.618 0.0000E+00 clinohumite 56 97.128 0.0000E+00 tridymite 181 -2.626 0.0000E+00 coesite 57 -2.376 0.0000E+00 tremolite 182 47.869 0.0000E+00 cordierite-H 58 23.715 0.0000E+00 ferroactinolite 183 38.452 0.0000E+00 cordierite 59 24.049 0.0000E+00 troilite-low 184 -4.411 0.0000E+00 cordierite-Fe 60 20.450 0.0000E+00 tschermakite 185 48.210 0.0000E+00 cordierite-Mn 61 25.066 0.0000E+00 vesuvianite 186 223.471 0.0000E+00 corundum 62 8.383 0.0000E+00 wadeite-Si 187 20.216 0.0000E+00 corundum-MgSi 63 18.891 0.0000E+00 wadsleyite-Fe 188 15.680 0.0000E+00 cristobalite 64 -2.560 0.0000E+00 wadsleyite-Mg 189 25.850 0.0000E+00 cummingtonite 65 52.099 0.0000E+00 wairakite 190 3.950 0.0000E+00 cymrite-K 66 1.685 0.0000E+00 walstromite 191 11.509 0.0000E+00 deerite 67 95.671 0.0000E+00 wollastonite 192 10.461 0.0000E+00 diaspore 68 2.874 0.0000E+00 pseudo-wollastonite 193 11.000 0.0000E+00 diamond 69 -3.102 0.0000E+00 zoisite 194 22.849 0.0000E+00 diopside 70 16.181 0.0000E+00 akaganeite 195 7.755 0.0000E+00 hedenbergite 71 14.208 0.0000E+00 beidellite-Ca 196 -1.646 0.0000E+00 dolomite,ordered 72 0.546 0.0000E+00 beidellite-H 197 -2.326 0.0000E+00 eastonite 73 28.489 0.0000E+00 beidellite-K 198 -1.520 0.0000E+00 enstatite 74 17.265 0.0000E+00 beidellite-Mg 199 -1.790 0.0000E+00 clinoenstatite-HiP 75 18.354 0.0000E+00 beidellite-Na 200 -1.342 0.0000E+00 clinoenstatite 76 17.166 0.0000E+00 calcium 201 84.026 0.0000E+00 protoenstatite 77 17.824 0.0000E+00 chalcedony 202 -2.802 0.0000E+00 epidote 78 24.670 0.0000E+00 dawsonite 203 1.682 0.0000E+00 clinozoisite 79 22.806 0.0000E+00 montmorillonite-Ca 204 -2.291 0.0000E+00 epidote-Fe 80 29.841 0.0000E+00 montmorillonite-K 205 -2.237 0.0000E+00 fayalite 81 14.046 0.0000E+00 montmorillonite-Mg 206 -2.480 0.0000E+00 ferrosilite 82 11.149 0.0000E+00 montmorillonite-Na 207 -2.038 0.0000E+00 forsterite 83 21.016 0.0000E+00 nontronite-Ca 208 3.215 0.0000E+00 gedrite 84 50.522 0.0000E+00 nontronite-H 209 2.533 0.0000E+00 gehlenite 85 36.628 0.0000E+00 nontronite-K 210 3.341 0.0000E+00 gibbsite 86 4.079 0.0000E+00 nontronite-Mg 211 3.075 0.0000E+00 glaucophane 87 22.975 0.0000E+00 nontronite-Na 212 3.520 0.0000E+00 glaucophane-Fe 88 17.276 0.0000E+00 sepiolite 213 24.118 0.0000E+00 graphite 89 -3.546 0.0000E+00 topaz 214 -16.546 0.0000E+00 greenalite 90 16.140 0.0000E+00 alite 215 57.999 0.0000E+00 grunerite 91 31.215 0.0000E+00 belite 216 30.433 0.0000E+00 halite 92 1.575 0.0000E+00 ettringite 217 43.232 0.0000E+00 hematite 93 12.566 0.0000E+00 gypsum 218 -4.955 0.0000E+00 heulandite 94 -5.827 0.0000E+00 hemicarboaluminate 219 70.954 0.0000E+00 hercynite 95 17.279 0.0000E+00 hydrogarnet 220 60.662 0.0000E+00 hollandite 96 25.673 0.0000E+00 hydrogarnet-Si 221 50.586 0.0000E+00 iron 97 19.086 0.0000E+00 jennite 222 24.367 0.0000E+00 jadeite 98 4.215 0.0000E+00 monosulfoaluminate 223 53.400 0.0000E+00 julgoldite 99 70.427 0.0000E+00 monocarboaluminate 224 61.898 0.0000E+00 kalsilite 100 7.584 0.0000E+00 portlandite 225 18.272 0.0000E+00 kaolinite 101 -1.333 0.0000E+00 stratlingite 226 36.502 0.0000E+00 kyanite 102 4.876 0.0000E+00 tricarboaluminate 227 70.370 0.0000E+00 larnite-bredigite 103 30.686 0.0000E+00 tobermorite 228 9.823 0.0000E+00 laumontite 104 2.883 0.0000E+00 C4AH13 229 81.816 0.0000E+00 lawsonite 105 9.616 0.0000E+00 C2AH8 230 45.203 0.0000E+00 leucite 106 4.119 0.0000E+00 C3A 231 86.953 0.0000E+00 lime 107 25.998 0.0000E+00 C4AF 232 117.416 0.0000E+00 lizardite 108 23.244 0.0000E+00 CAH10 233 28.335 0.0000E+00 magnesite 109 0.691 0.0000E+00 alabandite 234 -0.978 0.0000E+00 magnetite 110 20.087 0.0000E+00 alunite 235 -10.435 0.0000E+00 minnesotaite 111 10.388 0.0000E+00 artinite 236 15.121 0.0000E+00 minnesotaite-Mg 112 20.602 0.0000E+00 boehmite 237 4.406 0.0000E+00 magnesioferrite 113 26.212 0.0000E+00 dolomite,disordered 238 1.247 0.0000E+00 majorite 114 53.251 0.0000E+00 ferrous-oxide 239 9.812 0.0000E+00 manganosite 115 14.058 0.0000E+00 fluorite 240 -9.931 0.0000E+00 margarite 116 17.324 0.0000E+00 huntite 241 3.770 0.0000E+00 meionite 117 44.874 0.0000E+00 hydromagnesite 242 19.995 0.0000E+00 merwinite 118 55.930 0.0000E+00 nesquehonite 243 4.723 0.0000E+00 microcline 119 -2.486 0.0000E+00 potassium-oxide 244 69.038 0.0000E+00 monticellite 120 24.339 0.0000E+00 silica-amorphous 245 -2.091 0.0000E+00 mullite-Al 121 363.148 0.0000E+00 sodium-oxide 246 55.169 0.0000E+00 mullite-Si 122 7.264 0.0000E+00 an20ab80 247 2.018 0.0000E+00 muscovite 123 2.582 0.0000E+00 an25ab75 248 2.646 0.0000E+00 paragonite 124 4.239 0.0000E+00 an30ab70 249 3.279 0.0000E+00 nepheline 125 8.339 0.0000E+00 tr.625ac.25prg.125 250 45.165 0.0000E+00 Initial composition of reactant (mole%): H2O 88.87 HCl 0.5900 CO2 7.070 CO 0.1600 H2 1.540 S2 0.8000E-01 SO2 1.150 HF 0.4000E-01 H2S 1.120 0.000 Sum of wt% of reactants: 100.6200 Reactant consumed: 7.9999900 moles log = 0.9031 Original solution: 1000.0103000 g Original solution / Rock added: 125.00 (Water/Rock Ratio), log = 2.0969 The following minerals and/or gases with identical index are in solid solution: H2O,gas 6 CO2,gas 6 CH4,gas 6 H2,gas 6 H2S,gas 6 S2,gas 6 CO,gas 6 SO3,gas 6 SO2,gas 6 HF,gas 6 HCl,gas 6 almandine 16 pyrope 16 spessartine 16 andradite 8 grossular 8 annite 15 phlogopite 15 biotite-Mn 15 clinochlore 1 daphnite 1 chlorite-Mn 1 diopside 5 hedenbergite 5 epidote 3 clinozoisite 3 iron 9 magnetite 14 talc 7 talc-Fe 7 tremolite 2 ferroactinolite 2 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 23 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: -.2782E-16 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 0.00000E+00 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 0.00000E+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 -0.22748E-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 0.26539E-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 -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: 0.4000000 MOLES Current total amount of reactant added: 7.9999900 MOLES New total amount of reactant added: 8.3999900 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 = 8.3999900 Water: Moles liquid = 0.5751E+02 kg liquid = 0.1036E+01 Moles total = 0.5672E+02 kg total = 0.1022E+01 Activity = 0.9920 Stoichiometric ionic strength = .2606964E+00 Osmotic coef. = 0.9149 True ionic strength = .4768933E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.4970E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.28371E-01 -1.5471 0.22256E-01 -1.6526 0.78444E+00 -0.1054 2 H2O 0.99201E+00 -0.0035 0.99201E+00 -0.0035 3 Cl- 0.47637E-01 -1.3221 0.36944E-01 -1.4325 0.77553E+00 -0.1104 4 SO4-- 0.78226E-09 -9.1066 0.31124E-09 -9.5069 0.39787E+00 -0.4003 5 HCO3- 0.10362E-04 -4.9846 0.80585E-05 -5.0937 0.77769E+00 -0.1092 6 HS- 0.66951E-06 -6.1742 0.51937E-06 -6.2845 0.77575E+00 -0.1103 7 Al+++ 0.45645E-05 -5.3406 0.57779E-06 -6.2382 0.12658E+00 -0.8976 8 H4SiO4 0.10083E-02 -2.9964 0.10083E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19488E-06 -6.7102 0.76440E-07 -7.1167 0.39223E+00 -0.4065 10 Mg++ 0.78592E-10 -10.1046 0.30559E-10 -10.5149 0.38883E+00 -0.4102 11 Fe++ 0.30548E-07 -7.5150 0.11903E-07 -7.9244 0.38963E+00 -0.4093 12 K+ 0.13625E-03 -3.8657 0.10600E-03 -3.9747 0.77800E+00 -0.1090 13 Na+ 0.19154E-01 -1.7177 0.14848E-01 -1.8283 0.77520E+00 -0.1106 14 Mn++ 0.19508E-08 -8.7098 0.76128E-09 -9.1185 0.39025E+00 -0.4087 15 F- 0.27320E-04 -4.5635 0.21107E-04 -4.6756 0.77258E+00 -0.1121 16 HPO4-- 0.25324E-13 -13.5965 0.10078E-13 -13.9966 0.39798E+00 -0.4001 17 SiF6-2 0.18104E-12 -12.7422 0.71743E-13 -13.1442 0.39627E+00 -0.4020 18 HSiO3- 0.54988E-10 -10.2597 0.42645E-10 -10.3701 0.77553E+00 -0.1104 19 Ca(HSiO3)+ 0.95382E-16 -16.0205 0.74238E-16 -16.1294 0.77832E+00 -0.1088 20 Mg(HSiO3)+ 0.47455E-19 -19.3237 0.36935E-19 -19.4326 0.77832E+00 -0.1088 21 NaHSiO3,aq 0.10241E-10 -10.9897 0.10241E-10 -10.9897 0.10000E+01 0.0000 22 AlO+ 0.20227E-09 -9.6941 0.15743E-09 -9.8029 0.77832E+00 -0.1088 23 AlOH+2 0.44623E-07 -7.3504 0.17446E-07 -7.7583 0.39097E+00 -0.4079 24 HAlO2,aq 0.13975E-11 -11.8547 0.13975E-11 -11.8547 0.10000E+01 0.0000 25 AlO2- 0.17983E-15 -15.7451 0.13900E-15 -15.8570 0.77293E+00 -0.1119 26 CH4,aq 0.13719E-07 -7.8627 0.12958E-07 -7.8874 0.94454E+00 -0.0248 27 C2H6,aq 0.48588E-17 -17.3135 0.45893E-17 -17.3383 0.94454E+00 -0.0248 31 CO,aq 0.61191E-10 -10.2133 0.61191E-10 -10.2133 0.10000E+01 0.0000 32 CO2,aq 0.40899E+00 -0.3883 0.38631E+00 -0.4131 0.94454E+00 -0.0248 33 CO3-2 0.79812E-13 -13.0979 0.31627E-13 -13.4999 0.39627E+00 -0.4020 34 CaCO3,aq 0.30314E-16 -16.5184 0.30314E-16 -16.5184 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.20202E-10 -10.6946 0.15724E-10 -10.8034 0.77832E+00 -0.1088 36 CaCl+ 0.58718E-08 -8.2312 0.45701E-08 -8.3401 0.77832E+00 -0.1088 37 CaCl2,aq 0.40112E-10 -10.3967 0.40112E-10 -10.3967 0.10000E+01 0.0000 38 CaF+ 0.30265E-10 -10.5191 0.23556E-10 -10.6279 0.77832E+00 -0.1088 39 CaOH+ 0.31199E-15 -15.5059 0.24283E-15 -15.6147 0.77832E+00 -0.1088 40 CaSO4,aq 0.75547E-14 -14.1218 0.75547E-14 -14.1218 0.10000E+01 0.0000 41 HCl,aq 0.15067E-03 -3.8220 0.15067E-03 -3.8220 0.10000E+01 0.0000 45 HF,aq 0.32158E-02 -2.4927 0.32158E-02 -2.4927 0.10000E+01 0.0000 46 HF2- 0.29549E-07 -7.5295 0.22916E-07 -7.6399 0.77553E+00 -0.1104 47 Fe+3 0.21360E-17 -17.6704 0.27199E-18 -18.5655 0.12734E+00 -0.8951 48 FeCl+ 0.89426E-09 -9.0485 0.69602E-09 -9.1574 0.77832E+00 -0.1088 49 FeCl2,aq 0.81410E-15 -15.0893 0.81410E-15 -15.0893 0.10000E+01 0.0000 50 FeCl+2 0.18363E-17 -17.7361 0.71795E-18 -18.1439 0.39097E+00 -0.4079 51 FeF+ 0.16495E-10 -10.7827 0.12838E-10 -10.8915 0.77832E+00 -0.1088 52 FeF+2 0.13087E-15 -15.8832 0.51165E-16 -16.2910 0.39097E+00 -0.4079 54 FeOH+ 0.22188E-13 -13.6539 0.17270E-13 -13.7627 0.77832E+00 -0.1088 56 FeO+ 0.66917E-18 -18.1745 0.52082E-18 -18.2833 0.77832E+00 -0.1088 57 FeOH+2 0.56617E-17 -17.2471 0.22136E-17 -17.6549 0.39097E+00 -0.4079 60 H2,aq 0.66224E-08 -8.1790 0.62552E-08 -8.2038 0.94454E+00 -0.0248 61 KCl,aq 0.70975E-07 -7.1489 0.70975E-07 -7.1489 0.10000E+01 0.0000 62 KHSO4,aq 0.20760E-14 -14.6828 0.20760E-14 -14.6828 0.10000E+01 0.0000 63 KOH,aq 0.20178E-14 -14.6951 0.20178E-14 -14.6951 0.10000E+01 0.0000 64 KSO4- 0.66012E-12 -12.1804 0.51194E-12 -12.2908 0.77553E+00 -0.1104 66 Mg(HCO3)+ 0.82526E-14 -14.0834 0.64231E-14 -14.1923 0.77832E+00 -0.1088 67 MgCl+ 0.21275E-11 -11.6721 0.16559E-11 -11.7810 0.77832E+00 -0.1088 68 MgF+ 0.44820E-13 -13.3485 0.34884E-13 -13.4574 0.77832E+00 -0.1088 69 MgOH+ 0.69018E-18 -18.1610 0.53718E-18 -18.2699 0.77832E+00 -0.1088 71 MnF+ 0.34774E-12 -12.4588 0.27065E-12 -12.5676 0.77832E+00 -0.1088 73 MnOH+ 0.13184E-15 -15.8800 0.10261E-15 -15.9888 0.77832E+00 -0.1088 78 MnCl+ 0.22252E-09 -9.6526 0.17319E-09 -9.7615 0.77832E+00 -0.1088 79 MnSO4,aq 0.68402E-16 -16.1649 0.68402E-16 -16.1649 0.10000E+01 0.0000 80 NaCl,aq 0.18179E-03 -3.7404 0.18179E-03 -3.7404 0.10000E+01 0.0000 81 NaF,aq 0.73371E-07 -7.1345 0.73371E-07 -7.1345 0.10000E+01 0.0000 82 NaOH,aq 0.28435E-12 -12.5461 0.28435E-12 -12.5461 0.10000E+01 0.0000 84 OH- 0.33319E-10 -10.4773 0.25754E-10 -10.5892 0.77293E+00 -0.1119 90 H3PO3,aq 0.21766E-19 -19.6622 0.21766E-19 -19.6622 0.10000E+01 0.0000 91 H2PO3- 0.11396E-19 -19.9432 0.88383E-20 -20.0536 0.77553E+00 -0.1104 92 H3PO4,aq 0.34913E-07 -7.4570 0.34913E-07 -7.4570 0.10000E+01 0.0000 93 H2PO4- 0.53257E-08 -8.2736 0.41377E-08 -8.3832 0.77693E+00 -0.1096 95 H4P2O7,aq 0.16199E-16 -16.7905 0.16199E-16 -16.7905 0.10000E+01 0.0000 96 H3P2O7- 0.11983E-16 -16.9214 0.92930E-17 -17.0318 0.77553E+00 -0.1104 97 H2P2O7-2 0.34149E-17 -17.4666 0.13532E-17 -17.8686 0.39627E+00 -0.4020 100 H2S,aq 0.37822E-01 -1.4223 0.35724E-01 -1.4470 0.94454E+00 -0.0248 101 S2-2 0.24113E-14 -14.6177 0.95554E-15 -15.0198 0.39627E+00 -0.4020 102 S3-2 0.18554E-13 -13.7316 0.73523E-14 -14.1336 0.39627E+00 -0.4020 103 S3- 0.17882E-08 -8.7476 0.13868E-08 -8.8580 0.77553E+00 -0.1104 104 S4-2 0.94304E-13 -13.0255 0.37370E-13 -13.4275 0.39627E+00 -0.4020 105 S5-2 0.31961E-12 -12.4954 0.12665E-12 -12.8974 0.39627E+00 -0.4020 106 SO2,aq 0.43761E-11 -11.3589 0.43761E-11 -11.3589 0.10000E+01 0.0000 107 SO3-2 0.62631E-18 -18.2032 0.25503E-18 -18.5934 0.40719E+00 -0.3902 108 HSO3- 0.45823E-12 -12.3389 0.35537E-12 -12.4493 0.77553E+00 -0.1104 109 HSO4- 0.85603E-08 -8.0675 0.66754E-08 -8.1755 0.77981E+00 -0.1080 111 S2O3-2 0.33225E-12 -12.4785 0.13166E-12 -12.8805 0.39627E+00 -0.4020 112 HS2O3- 0.67556E-12 -12.1703 0.52392E-12 -12.2807 0.77553E+00 -0.1104 113 H2S2O3,aq 0.18693E-12 -12.7283 0.18693E-12 -12.7283 0.10000E+01 0.0000 Charge balance for all species = -.5316E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2837123E-01 0.4785507E+00 0.4721389E+03 0.0000 2 H2O 0.1000000E+01 0.5509926E+02 0.9716154E+06 0.0000 3 Cl- 0.4763697E-01 0.4796950E-01 0.1664659E+04 0.2201 4 SO4-- 0.7822595E-09 -.4924084E-08 -.4630014E-03 -6.2018 5 HCO3- 0.1036213E-04 0.4090015E+00 0.2442780E+05 -3.4412 6 HS- 0.6695110E-06 0.3782253E-01 0.1224385E+04 -4.6320 7 Al+++ 0.4564454E-05 0.4609281E-05 0.1217325E+00 -1.2805 8 H4SiO4 0.1008327E-02 0.1008327E-02 0.9486401E+02 -2.9964 9 Ca++ 0.1948847E-06 0.2008470E-06 0.7879136E-02 -3.8116 10 Mg++ 0.7859244E-10 0.8077305E-10 0.1922181E-05 -7.2097 11 Fe++ 0.3054804E-07 0.3145882E-07 0.1719687E-02 -4.6192 12 K+ 0.1362469E-03 0.1363179E-03 0.5217458E+01 -2.3221 13 Na+ 0.1915364E-01 0.1933550E-01 0.4351086E+03 -0.1758 14 Mn++ 0.1950758E-08 0.2173624E-08 0.1168865E-03 -5.8133 15 F- 0.2732005E-04 0.3243213E-02 0.6031017E+02 -3.0230 16 HPO4-- 0.2532364E-13 0.4023841E-07 0.3780282E-02 -10.6915 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.8844424E+00 0.4957928E+00 0.2004753E+00 0.1881744E+00 2 H2O 0.5672348E+02 0.5708447E+02 -.1825969E+00 -.1783923E+00 3 Cl- 0.4969783E-01 0.4969782E-01 0.0000000E+00 0.1028201E-08 4 SO4-- 0.4009497E-01 -.5101497E-08 0.4009505E-01 -.7892602E-07 5 HCO3- 0.6073323E+00 0.4237377E+00 0.0000000E+00 0.1835946E+00 6 HS- 0.1640503E+00 0.3918526E-01 0.1202852E+00 0.4579876E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1044657E-02 0.1110836E-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- 0.3360096E-02 0.3360065E-02 0.0000000E+00 0.3053732E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4508E-16 Mass of aqueous solution: 0.105844E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 8.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.5202E-02 -2.284 0.9369E-01 -1.028 1.125 2.066 CO2,gas 0.1836 -0.736 8.080 0.907 97.00 98.88 CH4,gas 0.7111E-07 -7.148 0.1141E-05 -5.943 0.1369E-04 0.4590E-04 H2,gas 0.3093E-07 -7.510 0.6247E-07 -7.204 0.7500E-06 0.1970E-04 H2S,gas 0.4580E-02 -2.339 0.1561 -0.807 1.874 2.332 S2,gas 0.2076E-11 -11.683 0.1331E-09 -9.876 0.1598E-08 0.1288E-08 CO,gas 0.3527E-09 -9.453 0.9878E-08 -8.005 0.1186E-06 0.2188E-06 SO3,gas 0.2272E-30 -30.644 0.1819E-28 -28.740 0.2184E-27 0.1410E-27 SO2,gas 0.7319E-13 -13.136 0.4688E-11 -11.329 0.5629E-10 0.4541E-10 HF,gas 0.3054E-07 -7.515 0.6107E-06 -6.214 0.7332E-05 0.1895E-04 HCl,gas 0.1028E-08 -8.988 0.3749E-07 -7.426 0.4501E-06 0.6380E-06 quartz 0.1111E-01 -1.954 0.6674 -0.176 11.49 0.2520 sulfur 0.1604 -0.795 5.142 0.711 88.51 2.488 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 0.9494E+00 0.4747E+02 0.8707 1.616 CH4,gas 0.3677E-06 0.1839E-04 1.0374 -4.720 H2,gas 0.1599E-06 0.7996E-05 1.0270 -5.086 H2S,gas 0.2368E-01 0.1184E+01 0.8293 -0.008 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1824E-08 0.9119E-07 1.0000 -7.040 SO3,gas 0.1175E-29 0.5876E-28 1.0000 -28.231 SO2,gas 0.3785E-12 0.1892E-10 1.0000 -10.723 HF,gas 0.1579E-06 0.7896E-05 1.0000 -5.103 HCl,gas 0.5317E-08 0.2659E-06 1.0000 -6.575 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: 0.776613 % Solid products produced: Mass = 5.809180 g Volume = 2.739597 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: 8.3999900 moles log = 0.9243 Original solution: 1000.0103000 g Original solution / Rock added: 119.05 (Water/Rock Ratio), log = 2.0757 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 0.00000E+00 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 -0.15165E-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 -0.22748E-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 0.37914E-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 -1.29 -4.16 -0.694 0.71051E+04 69 diamond -3.10 -4.31 -1.20 -0.344 0.20540E+04 89 graphite -3.55 -4.31 -0.76 -0.217 0.12963E+04 92 halite 1.57 -3.26 -4.84 -2.418 0.82562E+04 145 pyrite -21.25 -21.71 -0.46 -0.109 0.78839E+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 -18.21 -1.67 -0.185 0.28472E+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: 0.4000000 MOLES Current total amount of reactant added: 8.3999900 MOLES New total amount of reactant added: 8.7999900 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 = 8.7999900 Water: Moles liquid = 0.5787E+02 kg liquid = 0.1043E+01 Moles total = 0.5705E+02 kg total = 0.1028E+01 Activity = 0.9920 Stoichiometric ionic strength = .2620969E+00 Osmotic coef. = 0.9149 True ionic strength = .4962912E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5206E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.30438E-01 -1.5166 0.23803E-01 -1.6234 0.78200E+00 -0.1068 2 H2O 0.99200E+00 -0.0035 0.99200E+00 -0.0035 3 Cl- 0.49578E-01 -1.3047 0.38318E-01 -1.4166 0.77288E+00 -0.1119 4 SO4-- 0.64171E-09 -9.1927 0.25191E-09 -9.5987 0.39256E+00 -0.4061 5 HCO3- 0.97147E-05 -5.0126 0.75297E-05 -5.1232 0.77509E+00 -0.1106 6 HS- 0.64447E-06 -6.1908 0.49824E-06 -6.3026 0.77310E+00 -0.1118 7 Al+++ 0.45394E-05 -5.3430 0.55713E-06 -6.2540 0.12273E+00 -0.9110 8 H4SiO4 0.10083E-02 -2.9964 0.10083E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19351E-06 -6.7133 0.74859E-07 -7.1258 0.38684E+00 -0.4125 10 Mg++ 0.78048E-10 -10.1076 0.29923E-10 -10.5240 0.38339E+00 -0.4164 11 Fe++ 0.30334E-07 -7.5181 0.11655E-07 -7.9335 0.38421E+00 -0.4154 12 K+ 0.13539E-03 -3.8684 0.10498E-03 -3.9789 0.77540E+00 -0.1105 13 Na+ 0.19027E-01 -1.7206 0.14699E-01 -1.8327 0.77253E+00 -0.1121 14 Mn++ 0.19333E-08 -8.7137 0.74401E-09 -9.1284 0.38483E+00 -0.4147 15 F- 0.26700E-04 -4.5735 0.20556E-04 -4.6871 0.76986E+00 -0.1136 16 HPO4-- 0.22481E-13 -13.6482 0.88276E-14 -14.0542 0.39267E+00 -0.4060 17 SiF6-2 0.20486E-12 -12.6885 0.80090E-13 -13.0964 0.39094E+00 -0.4079 18 HSiO3- 0.51590E-10 -10.2874 0.39873E-10 -10.3993 0.77288E+00 -0.1119 19 Ca(HSiO3)+ 0.87628E-16 -16.0574 0.67976E-16 -16.1676 0.77573E+00 -0.1103 20 Mg(HSiO3)+ 0.43592E-19 -19.3606 0.33815E-19 -19.4709 0.77573E+00 -0.1103 21 NaHSiO3,aq 0.94793E-11 -11.0232 0.94793E-11 -11.0232 0.10000E+01 0.0000 22 AlO+ 0.17107E-09 -9.7668 0.13271E-09 -9.8771 0.77573E+00 -0.1103 23 AlOH+2 0.40794E-07 -7.3894 0.15729E-07 -7.8033 0.38557E+00 -0.4139 24 HAlO2,aq 0.11014E-11 -11.9580 0.11014E-11 -11.9580 0.10000E+01 0.0000 25 AlO2- 0.13299E-15 -15.8762 0.10243E-15 -15.9896 0.77022E+00 -0.1134 26 CH4,aq 0.15196E-07 -7.8183 0.14350E-07 -7.8431 0.94435E+00 -0.0249 27 C2H6,aq 0.58089E-17 -17.2359 0.54856E-17 -17.2608 0.94435E+00 -0.0249 31 CO,aq 0.62742E-10 -10.2024 0.62742E-10 -10.2024 0.10000E+01 0.0000 32 CO2,aq 0.40881E+00 -0.3885 0.38606E+00 -0.4133 0.94435E+00 -0.0249 33 CO3-2 0.70678E-13 -13.1507 0.27631E-13 -13.5586 0.39094E+00 -0.4079 34 CaCO3,aq 0.25936E-16 -16.5861 0.25936E-16 -16.5861 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.18548E-10 -10.7317 0.14388E-10 -10.8420 0.77573E+00 -0.1103 36 CaCl+ 0.59841E-08 -8.2230 0.46420E-08 -8.3333 0.77573E+00 -0.1103 37 CaCl2,aq 0.42258E-10 -10.3741 0.42258E-10 -10.3741 0.10000E+01 0.0000 38 CaF+ 0.28961E-10 -10.5382 0.22466E-10 -10.6485 0.77573E+00 -0.1103 39 CaOH+ 0.28663E-15 -15.5427 0.22235E-15 -15.6530 0.77573E+00 -0.1103 40 CaSO4,aq 0.59883E-14 -14.2227 0.59883E-14 -14.2227 0.10000E+01 0.0000 41 HCl,aq 0.16713E-03 -3.7769 0.16713E-03 -3.7769 0.10000E+01 0.0000 45 HF,aq 0.33495E-02 -2.4750 0.33495E-02 -2.4750 0.10000E+01 0.0000 46 HF2- 0.30077E-07 -7.5218 0.23246E-07 -7.6337 0.77288E+00 -0.1119 47 Fe+3 0.22773E-17 -17.6426 0.28121E-18 -18.5510 0.12348E+00 -0.9084 48 FeCl+ 0.91123E-09 -9.0404 0.70687E-09 -9.1507 0.77573E+00 -0.1103 49 FeCl2,aq 0.85754E-15 -15.0667 0.85754E-15 -15.0667 0.10000E+01 0.0000 50 FeCl+2 0.19968E-17 -17.6997 0.76989E-18 -18.1136 0.38557E+00 -0.4139 51 FeF+ 0.15782E-10 -10.8018 0.12243E-10 -10.9121 0.77573E+00 -0.1103 52 FeF+2 0.13362E-15 -15.8741 0.51518E-16 -16.2880 0.38557E+00 -0.4139 54 FeOH+ 0.20382E-13 -13.6908 0.15811E-13 -13.8010 0.77573E+00 -0.1103 56 FeO+ 0.60684E-18 -18.2169 0.47075E-18 -18.3272 0.77573E+00 -0.1103 57 FeOH+2 0.55498E-17 -17.2557 0.21398E-17 -17.6696 0.38557E+00 -0.4139 60 H2,aq 0.67960E-08 -8.1677 0.64178E-08 -8.1926 0.94435E+00 -0.0249 61 KCl,aq 0.72907E-07 -7.1372 0.72907E-07 -7.1372 0.10000E+01 0.0000 62 KHSO4,aq 0.17798E-14 -14.7496 0.17798E-14 -14.7496 0.10000E+01 0.0000 63 KOH,aq 0.18684E-14 -14.7285 0.18684E-14 -14.7285 0.10000E+01 0.0000 64 KSO4- 0.53098E-12 -12.2749 0.41038E-12 -12.3868 0.77288E+00 -0.1119 66 Mg(HCO3)+ 0.75758E-14 -14.1206 0.58767E-14 -14.2309 0.77573E+00 -0.1103 67 MgCl+ 0.21679E-11 -11.6640 0.16817E-11 -11.7742 0.77573E+00 -0.1103 68 MgF+ 0.42883E-13 -13.3677 0.33266E-13 -13.4780 0.77573E+00 -0.1103 69 MgOH+ 0.63399E-18 -18.1979 0.49180E-18 -18.3082 0.77573E+00 -0.1103 71 MnF+ 0.33208E-12 -12.4788 0.25760E-12 -12.5891 0.77573E+00 -0.1103 73 MnOH+ 0.12087E-15 -15.9177 0.93762E-16 -16.0280 0.77573E+00 -0.1103 78 MnCl+ 0.22631E-09 -9.6453 0.17556E-09 -9.7556 0.77573E+00 -0.1103 79 MnSO4,aq 0.54109E-16 -16.2667 0.54109E-16 -16.2667 0.10000E+01 0.0000 80 NaCl,aq 0.18666E-03 -3.7289 0.18666E-03 -3.7289 0.10000E+01 0.0000 81 NaF,aq 0.70739E-07 -7.1503 0.70739E-07 -7.1503 0.10000E+01 0.0000 82 NaOH,aq 0.26320E-12 -12.5797 0.26320E-12 -12.5797 0.10000E+01 0.0000 84 OH- 0.31263E-10 -10.5050 0.24079E-10 -10.6184 0.77022E+00 -0.1134 90 H3PO3,aq 0.22376E-19 -19.6502 0.22376E-19 -19.6502 0.10000E+01 0.0000 91 H2PO3- 0.10991E-19 -19.9589 0.84950E-20 -20.0708 0.77288E+00 -0.1119 92 H3PO4,aq 0.34980E-07 -7.4562 0.34980E-07 -7.4562 0.10000E+01 0.0000 93 H2PO4- 0.50060E-08 -8.3005 0.38761E-08 -8.4116 0.77431E+00 -0.1111 95 H4P2O7,aq 0.16262E-16 -16.7888 0.16262E-16 -16.7888 0.10000E+01 0.0000 96 H3P2O7- 0.11286E-16 -16.9475 0.87226E-17 -17.0594 0.77288E+00 -0.1119 97 H2P2O7-2 0.30377E-17 -17.5175 0.11876E-17 -17.9253 0.39094E+00 -0.4079 100 H2S,aq 0.38813E-01 -1.4110 0.36653E-01 -1.4359 0.94435E+00 -0.0249 101 S2-2 0.21923E-14 -14.6591 0.85707E-15 -15.0670 0.39094E+00 -0.4079 102 S3-2 0.16869E-13 -13.7729 0.65947E-14 -14.1808 0.39094E+00 -0.4079 103 S3- 0.16994E-08 -8.7697 0.13134E-08 -8.8816 0.77288E+00 -0.1119 104 S4-2 0.85739E-13 -13.0668 0.33519E-13 -13.4747 0.39094E+00 -0.4079 105 S5-2 0.29058E-12 -12.5367 0.11360E-12 -12.9446 0.39094E+00 -0.4079 106 SO2,aq 0.41570E-11 -11.3812 0.41570E-11 -11.3812 0.10000E+01 0.0000 107 SO3-2 0.52681E-18 -18.2783 0.21179E-18 -18.6741 0.40202E+00 -0.3958 108 HSO3- 0.40839E-12 -12.3889 0.31564E-12 -12.5008 0.77288E+00 -0.1119 109 HSO4- 0.74347E-08 -8.1287 0.57787E-08 -8.2382 0.77726E+00 -0.1094 111 S2O3-2 0.27968E-12 -12.5533 0.10934E-12 -12.9612 0.39094E+00 -0.4079 112 HS2O3- 0.60208E-12 -12.2203 0.46534E-12 -12.3322 0.77288E+00 -0.1119 113 H2S2O3,aq 0.17757E-12 -12.7506 0.17757E-12 -12.7506 0.10000E+01 0.0000 Charge balance for all species = -.5283E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3043829E-01 0.4815776E+00 0.4750800E+03 0.0000 2 H2O 0.1000000E+01 0.5509944E+02 0.9715261E+06 0.0000 3 Cl- 0.4957813E-01 0.4993201E-01 0.1732598E+04 0.2068 4 SO4-- 0.6417135E-09 -.7766923E-08 -.7302382E-03 -6.3520 5 HCO3- 0.9714689E-05 0.4088193E+00 0.2441459E+05 -3.4998 6 HS- 0.6444673E-06 0.3881365E-01 0.1256350E+04 -4.6792 7 Al+++ 0.4539381E-05 0.4580347E-05 0.1209568E+00 -1.3839 8 H4SiO4 0.1008298E-02 0.1008298E-02 0.9485224E+02 -2.9964 9 Ca++ 0.1935124E-06 0.1995863E-06 0.7828931E-02 -3.8790 10 Mg++ 0.7804761E-10 0.8026602E-10 0.1909933E-05 -7.2773 11 Fe++ 0.3033431E-07 0.3126134E-07 0.1708729E-02 -4.6868 12 K+ 0.1353893E-03 0.1354622E-03 0.5184213E+01 -2.3555 13 Na+ 0.1902739E-01 0.1921412E-01 0.4323361E+03 -0.2093 14 Mn++ 0.1933336E-08 0.2159980E-08 0.1161417E-03 -5.8817 15 F- 0.2670044E-04 0.3376316E-02 0.6277933E+02 -3.0637 16 HPO4-- 0.2248068E-13 0.3998582E-07 0.3756194E-02 -10.8074 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.9275124E+00 0.5020804E+00 0.2100254E+00 0.2154066E+00 2 H2O 0.5705096E+02 0.5744526E+02 -.1902239E+00 -.2040727E+00 3 Cl- 0.5205783E-01 0.5205782E-01 0.0000000E+00 0.1305635E-08 4 SO4-- 0.4200497E-01 -.8097593E-08 0.4200507E-01 -.9932431E-07 5 HCO3- 0.6362523E+00 0.4262245E+00 0.0000000E+00 0.2100278E+00 6 HS- 0.1718603E+00 0.4046611E-01 0.1260152E+00 0.5378961E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1051225E-02 0.1110179E-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- 0.3520096E-02 0.3520060E-02 0.0000000E+00 0.3641024E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.5340E-16 Mass of aqueous solution: 0.106522E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 8.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.5955E-02 -2.225 0.1072 -0.970 1.125 2.365 CO2,gas 0.2100 -0.678 9.243 0.966 96.95 113.1 CH4,gas 0.9014E-07 -7.045 0.1446E-05 -5.840 0.1517E-04 0.5819E-04 H2,gas 0.3632E-07 -7.440 0.7337E-07 -7.134 0.7696E-06 0.2314E-04 H2S,gas 0.5379E-02 -2.269 0.1833 -0.737 1.923 2.738 S2,gas 0.2376E-11 -11.624 0.1524E-09 -9.817 0.1598E-08 0.1475E-08 CO,gas 0.4139E-09 -9.383 0.1159E-07 -7.936 0.1216E-06 0.2568E-06 SO3,gas 0.2408E-30 -30.618 0.1928E-28 -28.715 0.2023E-27 0.1494E-27 SO2,gas 0.7959E-13 -13.099 0.5098E-11 -11.293 0.5348E-10 0.4938E-10 HF,gas 0.3641E-07 -7.439 0.7282E-06 -6.138 0.7638E-05 0.2259E-04 HCl,gas 0.1306E-08 -8.884 0.4760E-07 -7.322 0.4993E-06 0.8101E-06 quartz 0.1110E-01 -1.955 0.6670 -0.176 11.02 0.2519 sulfur 0.1680 -0.775 5.387 0.731 88.98 2.606 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 0.9488E+00 0.4744E+02 0.8707 1.616 CH4,gas 0.4072E-06 0.2036E-04 1.0374 -4.675 H2,gas 0.1641E-06 0.8204E-05 1.0270 -5.074 H2S,gas 0.2430E-01 0.1215E+01 0.8293 0.003 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1870E-08 0.9350E-07 1.0000 -7.029 SO3,gas 0.1088E-29 0.5440E-28 1.0000 -28.264 SO2,gas 0.3595E-12 0.1798E-10 1.0000 -10.745 HF,gas 0.1645E-06 0.8224E-05 1.0000 -5.085 HCl,gas 0.5898E-08 0.2949E-06 1.0000 -6.530 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: 0.882103 % Solid products produced: Mass = 6.053727 g Volume = 2.857949 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: 8.7999900 moles log = 0.9445 Original solution: 1000.0103000 g Original solution / Rock added: 113.64 (Water/Rock Ratio), log = 2.0555 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 0.30331E-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 0.75827E-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 0.00000E+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 -1.39 -4.26 -0.711 0.72817E+04 69 diamond -3.10 -4.28 -1.18 -0.337 0.20164E+04 89 graphite -3.55 -4.28 -0.74 -0.211 0.12587E+04 92 halite 1.57 -3.25 -4.82 -2.412 0.82366E+04 145 pyrite -21.25 -21.77 -0.52 -0.122 0.88463E+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 -18.39 -1.84 -0.204 0.31398E+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: 0.4000000 MOLES Current total amount of reactant added: 8.7999900 MOLES New total amount of reactant added: 9.1999900 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 = 9.1999900 Water: Moles liquid = 0.5823E+02 kg liquid = 0.1049E+01 Moles total = 0.5738E+02 kg total = 0.1034E+01 Activity = 0.9920 Stoichiometric ionic strength = .2634694E+00 Osmotic coef. = 0.9149 True ionic strength = .5154433E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5442E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.32479E-01 -1.4884 0.25323E-01 -1.5965 0.77967E+00 -0.1081 2 H2O 0.99199E+00 -0.0035 0.99199E+00 -0.0035 3 Cl- 0.51495E-01 -1.2882 0.39668E-01 -1.4016 0.77034E+00 -0.1133 4 SO4-- 0.53437E-09 -9.2722 0.20709E-09 -9.6838 0.38754E+00 -0.4117 5 HCO3- 0.91550E-05 -5.0383 0.70732E-05 -5.1504 0.77260E+00 -0.1120 6 HS- 0.62254E-06 -6.2058 0.47971E-06 -6.3190 0.77057E+00 -0.1132 7 Al+++ 0.45141E-05 -5.3454 0.53785E-06 -6.2693 0.11915E+00 -0.9239 8 H4SiO4 0.10083E-02 -2.9964 0.10083E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19216E-06 -6.7163 0.73356E-07 -7.1346 0.38174E+00 -0.4182 10 Mg++ 0.77511E-10 -10.1106 0.29318E-10 -10.5329 0.37825E+00 -0.4222 11 Fe++ 0.30124E-07 -7.5211 0.11419E-07 -7.9424 0.37908E+00 -0.4213 12 K+ 0.13454E-03 -3.8711 0.10399E-03 -3.9830 0.77292E+00 -0.1119 13 Na+ 0.18903E-01 -1.7235 0.14555E-01 -1.8370 0.76998E+00 -0.1135 14 Mn++ 0.19163E-08 -8.7175 0.72764E-09 -9.1381 0.37971E+00 -0.4206 15 F- 0.26175E-04 -4.5821 0.20083E-04 -4.6972 0.76727E+00 -0.1151 16 HPO4-- 0.20138E-13 -13.6960 0.78065E-14 -14.1075 0.38765E+00 -0.4116 17 SiF6-2 0.23122E-12 -12.6360 0.89230E-13 -13.0495 0.38590E+00 -0.4135 18 HSiO3- 0.48652E-10 -10.3129 0.37479E-10 -10.4262 0.77034E+00 -0.1133 19 Ca(HSiO3)+ 0.80971E-16 -16.0917 0.62612E-16 -16.2033 0.77325E+00 -0.1117 20 Mg(HSiO3)+ 0.40275E-19 -19.3950 0.31143E-19 -19.5066 0.77325E+00 -0.1117 21 NaHSiO3,aq 0.88226E-11 -11.0544 0.88226E-11 -11.0544 0.10000E+01 0.0000 22 AlO+ 0.14638E-09 -9.8345 0.11319E-09 -9.9462 0.77325E+00 -0.1117 23 AlOH+2 0.37515E-07 -7.4258 0.14273E-07 -7.8455 0.38045E+00 -0.4197 24 HAlO2,aq 0.88305E-12 -12.0540 0.88305E-12 -12.0540 0.10000E+01 0.0000 25 AlO2- 0.10056E-15 -15.9976 0.77191E-16 -16.1124 0.76763E+00 -0.1148 26 CH4,aq 0.16722E-07 -7.7767 0.15788E-07 -7.8017 0.94416E+00 -0.0250 27 C2H6,aq 0.68656E-17 -17.1633 0.64822E-17 -17.1883 0.94416E+00 -0.0250 31 CO,aq 0.64228E-10 -10.1923 0.64228E-10 -10.1923 0.10000E+01 0.0000 32 CO2,aq 0.40864E+00 -0.3887 0.38582E+00 -0.4136 0.94416E+00 -0.0250 33 CO3-2 0.63222E-13 -13.1991 0.24397E-13 -13.6127 0.38590E+00 -0.4135 34 CaCO3,aq 0.22441E-16 -16.6490 0.22441E-16 -16.6490 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.17128E-10 -10.7663 0.13245E-10 -10.8780 0.77325E+00 -0.1117 36 CaCl+ 0.60901E-08 -8.2154 0.47092E-08 -8.3271 0.77325E+00 -0.1117 37 CaCl2,aq 0.44381E-10 -10.3528 0.44381E-10 -10.3528 0.10000E+01 0.0000 38 CaF+ 0.27816E-10 -10.5557 0.21509E-10 -10.6674 0.77325E+00 -0.1117 39 CaOH+ 0.26486E-15 -15.5770 0.20480E-15 -15.6887 0.77325E+00 -0.1117 40 CaSO4,aq 0.48240E-14 -14.3166 0.48240E-14 -14.3166 0.10000E+01 0.0000 41 HCl,aq 0.18407E-03 -3.7350 0.18407E-03 -3.7350 0.10000E+01 0.0000 45 HF,aq 0.34815E-02 -2.4582 0.34815E-02 -2.4582 0.10000E+01 0.0000 46 HF2- 0.30644E-07 -7.5137 0.23606E-07 -7.6270 0.77034E+00 -0.1133 47 Fe+3 0.24157E-17 -17.6170 0.28962E-18 -18.5382 0.11989E+00 -0.9212 48 FeCl+ 0.92725E-09 -9.0328 0.71700E-09 -9.1445 0.77325E+00 -0.1117 49 FeCl2,aq 0.90049E-15 -15.0455 0.90049E-15 -15.0455 0.10000E+01 0.0000 50 FeCl+2 0.21577E-17 -17.6660 0.82088E-18 -18.0857 0.38045E+00 -0.4197 51 FeF+ 0.15156E-10 -10.8194 0.11719E-10 -10.9311 0.77325E+00 -0.1117 52 FeF+2 0.13626E-15 -15.8656 0.51840E-16 -16.2853 0.38045E+00 -0.4197 54 FeOH+ 0.18831E-13 -13.7251 0.14561E-13 -13.8368 0.77325E+00 -0.1117 56 FeO+ 0.55398E-18 -18.2565 0.42836E-18 -18.3682 0.77325E+00 -0.1117 57 FeOH+2 0.54450E-17 -17.2640 0.20715E-17 -17.6837 0.38045E+00 -0.4197 60 H2,aq 0.69626E-08 -8.1572 0.65738E-08 -8.1822 0.94416E+00 -0.0250 61 KCl,aq 0.74765E-07 -7.1263 0.74765E-07 -7.1263 0.10000E+01 0.0000 62 KHSO4,aq 0.15419E-14 -14.8119 0.15419E-14 -14.8119 0.10000E+01 0.0000 63 KOH,aq 0.17397E-14 -14.7595 0.17397E-14 -14.7595 0.10000E+01 0.0000 64 KSO4- 0.43381E-12 -12.3627 0.33418E-12 -12.4760 0.77034E+00 -0.1133 66 Mg(HCO3)+ 0.69950E-14 -14.1552 0.54089E-14 -14.2669 0.77325E+00 -0.1117 67 MgCl+ 0.22061E-11 -11.6564 0.17059E-11 -11.7681 0.77325E+00 -0.1117 68 MgF+ 0.41182E-13 -13.3853 0.31844E-13 -13.4970 0.77325E+00 -0.1117 69 MgOH+ 0.58575E-18 -18.2323 0.45293E-18 -18.3440 0.77325E+00 -0.1117 71 MnF+ 0.31832E-12 -12.4971 0.24614E-12 -12.6088 0.77325E+00 -0.1117 73 MnOH+ 0.11147E-15 -15.9528 0.86193E-16 -16.0645 0.77325E+00 -0.1117 78 MnCl+ 0.22987E-09 -9.6385 0.17775E-09 -9.7502 0.77325E+00 -0.1117 79 MnSO4,aq 0.43503E-16 -16.3615 0.43503E-16 -16.3615 0.10000E+01 0.0000 80 NaCl,aq 0.19134E-03 -3.7182 0.19134E-03 -3.7182 0.10000E+01 0.0000 81 NaF,aq 0.68434E-07 -7.1647 0.68434E-07 -7.1647 0.10000E+01 0.0000 82 NaOH,aq 0.24497E-12 -12.6109 0.24497E-12 -12.6109 0.10000E+01 0.0000 84 OH- 0.29485E-10 -10.5304 0.22633E-10 -10.6453 0.76763E+00 -0.1148 90 H3PO3,aq 0.22940E-19 -19.6394 0.22940E-19 -19.6394 0.10000E+01 0.0000 91 H2PO3- 0.10627E-19 -19.9736 0.81866E-20 -20.0869 0.77034E+00 -0.1133 92 H3PO4,aq 0.35011E-07 -7.4558 0.35011E-07 -7.4558 0.10000E+01 0.0000 93 H2PO4- 0.47249E-08 -8.3256 0.36467E-08 -8.4381 0.77180E+00 -0.1125 95 H4P2O7,aq 0.16292E-16 -16.7880 0.16292E-16 -16.7880 0.10000E+01 0.0000 96 H3P2O7- 0.10663E-16 -16.9721 0.82138E-17 -17.0855 0.77034E+00 -0.1133 97 H2P2O7-2 0.27239E-17 -17.5648 0.10512E-17 -17.9783 0.38590E+00 -0.4135 100 H2S,aq 0.39764E-01 -1.4005 0.37544E-01 -1.4255 0.94416E+00 -0.0250 101 S2-2 0.20100E-14 -14.6968 0.77566E-15 -15.1103 0.38590E+00 -0.4135 102 S3-2 0.15466E-13 -13.8106 0.59683E-14 -14.2242 0.38590E+00 -0.4135 103 S3- 0.16220E-08 -8.7899 0.12495E-08 -8.9033 0.77034E+00 -0.1133 104 S4-2 0.78608E-13 -13.1045 0.30335E-13 -13.5181 0.38590E+00 -0.4135 105 S5-2 0.26642E-12 -12.5744 0.10281E-12 -12.9880 0.38590E+00 -0.4135 106 SO2,aq 0.39620E-11 -11.4021 0.39620E-11 -11.4021 0.10000E+01 0.0000 107 SO3-2 0.44908E-18 -18.3477 0.17834E-18 -18.7488 0.39712E+00 -0.4011 108 HSO3- 0.36706E-12 -12.4353 0.28276E-12 -12.5486 0.77034E+00 -0.1133 109 HSO4- 0.65226E-08 -8.1856 0.50539E-08 -8.2964 0.77483E+00 -0.1108 111 S2O3-2 0.23858E-12 -12.6224 0.92069E-13 -13.0359 0.38590E+00 -0.4135 112 HS2O3- 0.54115E-12 -12.2667 0.41687E-12 -12.3800 0.77034E+00 -0.1133 113 H2S2O3,aq 0.16923E-12 -12.7715 0.16923E-12 -12.7715 0.10000E+01 0.0000 Charge balance for all species = -.5250E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3247906E-01 0.4845457E+00 0.4779635E+03 0.0000 2 H2O 0.1000000E+01 0.5509961E+02 0.9714384E+06 0.0000 3 Cl- 0.5149454E-01 0.5187003E-01 0.1799678E+04 0.1949 4 SO4-- 0.5343690E-09 -.1040272E-07 -.9779616E-03 -6.4909 5 HCO3- 0.9155021E-05 0.4086459E+00 0.2440196E+05 -3.5539 6 HS- 0.6225390E-06 0.3976496E-01 0.1287023E+04 -4.7225 7 Al+++ 0.4514112E-05 0.4551775E-05 0.1201910E+00 -1.4799 8 H4SiO4 0.1008270E-02 0.1008270E-02 0.9484074E+02 -2.9964 9 Ca++ 0.1921618E-06 0.1983412E-06 0.7779367E-02 -3.9416 10 Mg++ 0.7751106E-10 0.7976531E-10 0.1897842E-05 -7.3399 11 Fe++ 0.3012391E-07 0.3106633E-07 0.1697911E-02 -4.7494 12 K+ 0.1345424E-03 0.1346172E-03 0.5151393E+01 -2.3865 13 Na+ 0.1890285E-01 0.1909426E-01 0.4295991E+03 -0.2405 14 Mn++ 0.1916321E-08 0.2146505E-08 0.1154064E-03 -5.9451 15 F- 0.2617461E-04 0.3507757E-02 0.6521727E+02 -3.1007 16 HPO4-- 0.2013780E-13 0.3973639E-07 0.3732414E-02 -10.9146 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.9705824E+00 0.5083460E+00 0.2195755E+00 0.2426609E+00 2 H2O 0.5737844E+02 0.5780604E+02 -.1978509E+00 -.2297457E+00 3 Cl- 0.5441783E-01 0.5441782E-01 0.0000000E+00 0.1619923E-08 4 SO4-- 0.4391497E-01 -.1091368E-07 0.4391510E-01 -.1223146E-06 5 HCO3- 0.6651723E+00 0.4287181E+00 0.0000000E+00 0.2364542E+00 6 HS- 0.1796703E+00 0.4171817E-01 0.1317453E+00 0.6206823E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1057795E-02 0.1109523E-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- 0.3680096E-02 0.3680053E-02 0.0000000E+00 0.4263307E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1286E-15 Mass of aqueous solution: 0.107201E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 9.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.6708E-02 -2.173 0.1208 -0.918 1.125 2.664 CO2,gas 0.2365 -0.626 10.41 1.017 96.91 127.4 CH4,gas 0.1117E-06 -6.952 0.1792E-05 -5.747 0.1669E-04 0.7212E-04 H2,gas 0.4191E-07 -7.378 0.8466E-07 -7.072 0.7884E-06 0.2670E-04 H2S,gas 0.6207E-02 -2.207 0.2115 -0.675 1.970 3.160 S2,gas 0.2677E-11 -11.572 0.1716E-09 -9.765 0.1598E-08 0.1661E-08 CO,gas 0.4774E-09 -9.321 0.1337E-07 -7.874 0.1245E-06 0.2962E-06 SO3,gas 0.2524E-30 -30.598 0.2021E-28 -28.694 0.1882E-27 0.1566E-27 SO2,gas 0.8545E-13 -13.068 0.5474E-11 -11.262 0.5097E-10 0.5302E-10 HF,gas 0.4263E-07 -7.370 0.8527E-06 -6.069 0.7940E-05 0.2645E-04 HCl,gas 0.1620E-08 -8.791 0.5906E-07 -7.229 0.5500E-06 0.1005E-05 quartz 0.1110E-01 -1.955 0.6666 -0.176 10.58 0.2517 sulfur 0.1757 -0.755 5.632 0.751 89.42 2.725 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 0.9482E+00 0.4741E+02 0.8707 1.616 CH4,gas 0.4480E-06 0.2240E-04 1.0374 -4.634 H2,gas 0.1681E-06 0.8404E-05 1.0270 -5.064 H2S,gas 0.2489E-01 0.1244E+01 0.8293 0.014 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1914E-08 0.9571E-07 1.0000 -7.019 SO3,gas 0.1012E-29 0.5062E-28 1.0000 -28.296 SO2,gas 0.3427E-12 0.1713E-10 1.0000 -10.766 HF,gas 0.1710E-06 0.8548E-05 1.0000 -5.068 HCl,gas 0.6496E-08 0.3248E-06 1.0000 -6.488 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: 0.986062 % Solid products produced: Mass = 6.298274 g Volume = 2.976301 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: 9.1999900 moles log = 0.9638 Original solution: 1000.0103000 g Original solution / Rock added: 108.70 (Water/Rock Ratio), log = 2.0362 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 0.00000E+00 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 0.00000E+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 0.60662E-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 0.37914E-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 -1.49 -4.36 -0.727 0.74455E+04 69 diamond -3.10 -4.26 -1.16 -0.332 0.19812E+04 89 graphite -3.55 -4.26 -0.72 -0.205 0.12235E+04 92 halite 1.57 -3.24 -4.81 -2.407 0.82183E+04 145 pyrite -21.25 -21.82 -0.57 -0.134 0.97378E+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 -18.54 -2.00 -0.222 0.34102E+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: 0.4000000 MOLES Current total amount of reactant added: 9.1999900 MOLES New total amount of reactant added: 9.5999900 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 = 9.5999900 Water: Moles liquid = 0.5860E+02 kg liquid = 0.1056E+01 Moles total = 0.5771E+02 kg total = 0.1040E+01 Activity = 0.9920 Stoichiometric ionic strength = .2648150E+00 Osmotic coef. = 0.9149 True ionic strength = .5343540E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5678E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.34494E-01 -1.4623 0.26817E-01 -1.5716 0.77745E+00 -0.1093 2 H2O 0.99197E+00 -0.0035 0.99197E+00 -0.0035 3 Cl- 0.53387E-01 -1.2726 0.40997E-01 -1.3873 0.76792E+00 -0.1147 4 SO4-- 0.45086E-09 -9.3460 0.17258E-09 -9.7630 0.38278E+00 -0.4170 5 HCO3- 0.86663E-05 -5.0622 0.66750E-05 -5.1755 0.77023E+00 -0.1134 6 HS- 0.60314E-06 -6.2196 0.46330E-06 -6.3341 0.76815E+00 -0.1146 7 Al+++ 0.44887E-05 -5.3479 0.51983E-06 -6.2841 0.11581E+00 -0.9363 8 H4SiO4 0.10082E-02 -2.9964 0.10082E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.19083E-06 -6.7193 0.71926E-07 -7.1431 0.37691E+00 -0.4238 10 Mg++ 0.76983E-10 -10.1136 0.28743E-10 -10.5415 0.37337E+00 -0.4279 11 Fe++ 0.29917E-07 -7.5241 0.11195E-07 -7.9510 0.37421E+00 -0.4269 12 K+ 0.13371E-03 -3.8738 0.10303E-03 -3.9870 0.77055E+00 -0.1132 13 Na+ 0.18780E-01 -1.7263 0.14415E-01 -1.8412 0.76755E+00 -0.1149 14 Mn++ 0.18997E-08 -8.7213 0.71210E-09 -9.1475 0.37485E+00 -0.4261 15 F- 0.25724E-04 -4.5897 0.19674E-04 -4.7061 0.76479E+00 -0.1165 16 HPO4-- 0.18181E-13 -13.7404 0.69613E-14 -14.1573 0.38290E+00 -0.4169 17 SiF6-2 0.26024E-12 -12.5846 0.99184E-13 -13.0036 0.38112E+00 -0.4189 18 HSiO3- 0.46085E-10 -10.3364 0.35390E-10 -10.4511 0.76792E+00 -0.1147 19 Ca(HSiO3)+ 0.75198E-16 -16.1238 0.57969E-16 -16.2368 0.77089E+00 -0.1130 20 Mg(HSiO3)+ 0.37399E-19 -19.4271 0.28830E-19 -19.5402 0.77089E+00 -0.1130 21 NaHSiO3,aq 0.82506E-11 -11.0835 0.82506E-11 -11.0835 0.10000E+01 0.0000 22 AlO+ 0.12654E-09 -9.8978 0.97546E-10 -10.0108 0.77089E+00 -0.1130 23 AlOH+2 0.34679E-07 -7.4599 0.13026E-07 -7.8852 0.37560E+00 -0.4253 24 HAlO2,aq 0.71857E-12 -12.1435 0.71857E-12 -12.1435 0.10000E+01 0.0000 25 AlO2- 0.77518E-16 -16.1106 0.59313E-16 -16.2268 0.76515E+00 -0.1163 26 CH4,aq 0.18292E-07 -7.7377 0.17267E-07 -7.7628 0.94397E+00 -0.0250 27 C2H6,aq 0.80306E-17 -17.0953 0.75807E-17 -17.1203 0.94397E+00 -0.0250 31 CO,aq 0.65653E-10 -10.1827 0.65653E-10 -10.1827 0.10000E+01 0.0000 32 CO2,aq 0.40847E+00 -0.3888 0.38559E+00 -0.4139 0.94397E+00 -0.0250 33 CO3-2 0.57045E-13 -13.2438 0.21741E-13 -13.6627 0.38112E+00 -0.4189 34 CaCO3,aq 0.19608E-16 -16.7076 0.19608E-16 -16.7076 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.15898E-10 -10.7987 0.12255E-10 -10.9117 0.77089E+00 -0.1130 36 CaCl+ 0.61902E-08 -8.2083 0.47720E-08 -8.3213 0.77089E+00 -0.1130 37 CaCl2,aq 0.46479E-10 -10.3327 0.46479E-10 -10.3327 0.10000E+01 0.0000 38 CaF+ 0.26800E-10 -10.5719 0.20660E-10 -10.6849 0.77089E+00 -0.1130 39 CaOH+ 0.24597E-15 -15.6091 0.18962E-15 -15.7221 0.77089E+00 -0.1130 40 CaSO4,aq 0.39417E-14 -14.4043 0.39417E-14 -14.4043 0.10000E+01 0.0000 41 HCl,aq 0.20146E-03 -3.6958 0.20146E-03 -3.6958 0.10000E+01 0.0000 45 HF,aq 0.36117E-02 -2.4423 0.36117E-02 -2.4423 0.10000E+01 0.0000 46 HF2- 0.31240E-07 -7.5053 0.23990E-07 -7.6200 0.76792E+00 -0.1147 47 Fe+3 0.25511E-17 -17.5933 0.29733E-18 -18.5268 0.11655E+00 -0.9335 48 FeCl+ 0.94237E-09 -9.0258 0.72647E-09 -9.1388 0.77089E+00 -0.1130 49 FeCl2,aq 0.94293E-15 -15.0255 0.94293E-15 -15.0255 0.10000E+01 0.0000 50 FeCl+2 0.23188E-17 -17.6347 0.87093E-18 -18.0600 0.37560E+00 -0.4253 51 FeF+ 0.14600E-10 -10.8356 0.11255E-10 -10.9487 0.77089E+00 -0.1130 52 FeF+2 0.13880E-15 -15.8576 0.52134E-16 -16.2829 0.37560E+00 -0.4253 54 FeOH+ 0.17486E-13 -13.7573 0.13480E-13 -13.8703 0.77089E+00 -0.1130 56 FeO+ 0.50865E-18 -18.2936 0.39211E-18 -18.4066 0.77089E+00 -0.1130 57 FeOH+2 0.53464E-17 -17.2719 0.20081E-17 -17.6972 0.37560E+00 -0.4253 60 H2,aq 0.71226E-08 -8.1474 0.67235E-08 -8.1724 0.94397E+00 -0.0250 61 KCl,aq 0.76552E-07 -7.1160 0.76552E-07 -7.1160 0.10000E+01 0.0000 62 KHSO4,aq 0.13482E-14 -14.8703 0.13482E-14 -14.8703 0.10000E+01 0.0000 63 KOH,aq 0.16275E-14 -14.7885 0.16275E-14 -14.7885 0.10000E+01 0.0000 64 KSO4- 0.35929E-12 -12.4445 0.27591E-12 -12.5592 0.76792E+00 -0.1147 66 Mg(HCO3)+ 0.64916E-14 -14.1876 0.50043E-14 -14.3007 0.77089E+00 -0.1130 67 MgCl+ 0.22421E-11 -11.6494 0.17284E-11 -11.7624 0.77089E+00 -0.1130 68 MgF+ 0.39672E-13 -13.4015 0.30583E-13 -13.5145 0.77089E+00 -0.1130 69 MgOH+ 0.54392E-18 -18.2645 0.41930E-18 -18.3775 0.77089E+00 -0.1130 71 MnF+ 0.30610E-12 -12.5141 0.23597E-12 -12.6271 0.77089E+00 -0.1130 73 MnOH+ 0.10332E-15 -15.9858 0.79651E-16 -16.0988 0.77089E+00 -0.1130 78 MnCl+ 0.23320E-09 -9.6323 0.17977E-09 -9.7453 0.77089E+00 -0.1130 79 MnSO4,aq 0.35479E-16 -16.4500 0.35479E-16 -16.4500 0.10000E+01 0.0000 80 NaCl,aq 0.19584E-03 -3.7081 0.19584E-03 -3.7081 0.10000E+01 0.0000 81 NaF,aq 0.66392E-07 -7.1779 0.66392E-07 -7.1779 0.10000E+01 0.0000 82 NaOH,aq 0.22909E-12 -12.6400 0.22909E-12 -12.6400 0.10000E+01 0.0000 84 OH- 0.27932E-10 -10.5539 0.21372E-10 -10.6702 0.76515E+00 -0.1163 90 H3PO3,aq 0.23465E-19 -19.6296 0.23465E-19 -19.6296 0.10000E+01 0.0000 91 H2PO3- 0.10297E-19 -19.9873 0.79073E-20 -20.1020 0.76792E+00 -0.1147 92 H3PO4,aq 0.35014E-07 -7.4558 0.35014E-07 -7.4558 0.10000E+01 0.0000 93 H2PO4- 0.44759E-08 -8.3491 0.34438E-08 -8.4630 0.76941E+00 -0.1138 95 H4P2O7,aq 0.16294E-16 -16.7880 0.16294E-16 -16.7880 0.10000E+01 0.0000 96 H3P2O7- 0.10102E-16 -16.9956 0.77575E-17 -17.1103 0.76792E+00 -0.1147 97 H2P2O7-2 0.24597E-17 -17.6091 0.93746E-18 -18.0280 0.38112E+00 -0.4189 100 H2S,aq 0.40678E-01 -1.3906 0.38399E-01 -1.4157 0.94397E+00 -0.0250 101 S2-2 0.18561E-14 -14.7314 0.70739E-15 -15.1503 0.38112E+00 -0.4189 102 S3-2 0.14281E-13 -13.8452 0.54429E-14 -14.2642 0.38112E+00 -0.4189 103 S3- 0.15539E-08 -8.8086 0.11932E-08 -8.9233 0.76792E+00 -0.1147 104 S4-2 0.72588E-13 -13.1391 0.27665E-13 -13.5581 0.38112E+00 -0.4189 105 S5-2 0.24601E-12 -12.6090 0.93762E-13 -13.0280 0.38112E+00 -0.4189 106 SO2,aq 0.37873E-11 -11.4217 0.37873E-11 -11.4217 0.10000E+01 0.0000 107 SO3-2 0.38730E-18 -18.4120 0.15201E-18 -18.8181 0.39248E+00 -0.4062 108 HSO3- 0.33237E-12 -12.4784 0.25523E-12 -12.5931 0.76792E+00 -0.1147 109 HSO4- 0.57737E-08 -8.2385 0.44602E-08 -8.3506 0.77250E+00 -0.1121 111 S2O3-2 0.20591E-12 -12.6863 0.78475E-13 -13.1053 0.38112E+00 -0.4189 112 HS2O3- 0.49001E-12 -12.3098 0.37629E-12 -12.4245 0.76792E+00 -0.1147 113 H2S2O3,aq 0.16177E-12 -12.7911 0.16177E-12 -12.7911 0.10000E+01 0.0000 Charge balance for all species = -.5217E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3449400E-01 0.4874575E+00 0.4807916E+03 0.0000 2 H2O 0.1000000E+01 0.5509978E+02 0.9713524E+06 0.0000 3 Cl- 0.5338664E-01 0.5378403E-01 0.1865915E+04 0.1843 4 SO4-- 0.4508551E-09 -.1288829E-07 -.1211520E-02 -6.6198 5 HCO3- 0.8666277E-05 0.4084807E+00 0.2438986E+05 -3.6040 6 HS- 0.6031381E-06 0.4067882E-01 0.1316480E+04 -4.7626 7 Al+++ 0.4488750E-05 0.4523556E-05 0.1194350E+00 -1.5694 8 H4SiO4 0.1008243E-02 0.1008243E-02 0.9482952E+02 -2.9964 9 Ca++ 0.1908323E-06 0.1971116E-06 0.7730431E-02 -3.9999 10 Mg++ 0.7698259E-10 0.7927081E-10 0.1885903E-05 -7.3983 11 Fe++ 0.2991675E-07 0.3087374E-07 0.1687231E-02 -4.8078 12 K+ 0.1337061E-03 0.1337826E-03 0.5118988E+01 -2.4155 13 Na+ 0.1877998E-01 0.1897589E-01 0.4268967E+03 -0.2696 14 Mn++ 0.1899691E-08 0.2133198E-08 0.1146805E-03 -6.0043 15 F- 0.2572419E-04 0.3637568E-02 0.6762456E+02 -3.1345 16 HPO4-- 0.1818077E-13 0.3949005E-07 0.3708936E-02 -11.0141 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1013652E+01 0.5145909E+00 0.2291256E+00 0.2699358E+00 2 H2O 0.5770592E+02 0.5816681E+02 -.2054778E+00 -.2554118E+00 3 Cl- 0.5677783E-01 0.5677782E-01 0.0000000E+00 0.1972226E-08 4 SO4-- 0.4582497E-01 -.1360570E-07 0.4582513E-01 -.1479714E-06 5 HCO3- 0.6940923E+00 0.4312181E+00 0.0000000E+00 0.2628743E+00 6 HS- 0.1874803E+00 0.4294313E-01 0.1374754E+00 0.7061777E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1064365E-02 0.1108866E-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- 0.3840096E-02 0.3840047E-02 0.0000000E+00 0.4919945E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.5639E-16 Mass of aqueous solution: 0.107880E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 9.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.7462E-02 -2.127 0.1344 -0.872 1.125 2.964 CO2,gas 0.2629 -0.580 11.57 1.063 96.86 141.6 CH4,gas 0.1359E-06 -6.867 0.2180E-05 -5.662 0.1825E-04 0.8774E-04 H2,gas 0.4769E-07 -7.322 0.9632E-07 -7.016 0.8065E-06 0.3038E-04 H2S,gas 0.7062E-02 -2.151 0.2407 -0.619 2.015 3.595 S2,gas 0.2978E-11 -11.526 0.1909E-09 -9.719 0.1599E-08 0.1848E-08 CO,gas 0.5428E-09 -9.265 0.1520E-07 -7.818 0.1273E-06 0.3368E-06 SO3,gas 0.2625E-30 -30.581 0.2101E-28 -28.677 0.1759E-27 0.1629E-27 SO2,gas 0.9086E-13 -13.042 0.5821E-11 -11.235 0.4873E-10 0.5638E-10 HF,gas 0.4920E-07 -7.308 0.9840E-06 -6.007 0.8238E-05 0.3053E-04 HCl,gas 0.1972E-08 -8.705 0.7191E-07 -7.143 0.6020E-06 0.1224E-05 quartz 0.1109E-01 -1.955 0.6662 -0.176 10.18 0.2516 sulfur 0.1833 -0.737 5.877 0.769 89.82 2.843 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 0.9476E+00 0.4738E+02 0.8707 1.615 CH4,gas 0.4900E-06 0.2450E-04 1.0374 -4.595 H2,gas 0.1719E-06 0.8595E-05 1.0270 -5.054 H2S,gas 0.2546E-01 0.1273E+01 0.8293 0.023 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1957E-08 0.9784E-07 1.0000 -7.010 SO3,gas 0.9461E-30 0.4731E-28 1.0000 -28.325 SO2,gas 0.3276E-12 0.1638E-10 1.0000 -10.786 HF,gas 0.1774E-06 0.8868E-05 1.0000 -5.052 HCl,gas 0.7110E-08 0.3555E-06 1.0000 -6.449 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: 1.088519 % Solid products produced: Mass = 6.542821 g Volume = 3.094653 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: 9.5999900 moles log = 0.9823 Original solution: 1000.0103000 g Original solution / Rock added: 104.17 (Water/Rock Ratio), log = 2.0177 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 0.30331E-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 -0.34122E-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 -0.30331E-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 -1.58 -4.45 -0.742 0.75984E+04 69 diamond -3.10 -4.24 -1.14 -0.326 0.19483E+04 89 graphite -3.55 -4.24 -0.70 -0.199 0.11905E+04 92 halite 1.57 -3.23 -4.80 -2.402 0.82010E+04 145 pyrite -21.25 -21.87 -0.62 -0.146 0.10568E+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 -18.69 -2.14 -0.238 0.36614E+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: 0.4000000 MOLES Current total amount of reactant added: 9.5999900 MOLES New total amount of reactant added: 9.9999900 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 = 9.9999900 Water: Moles liquid = 0.5896E+02 kg liquid = 0.1062E+01 Moles total = 0.5803E+02 kg total = 0.1045E+01 Activity = 0.9920 Stoichiometric ionic strength = .2661348E+00 Osmotic coef. = 0.9149 True ionic strength = .5530276E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.5914E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.36484E-01 -1.4379 0.28286E-01 -1.5484 0.77532E+00 -0.1105 2 H2O 0.99196E+00 -0.0035 0.99196E+00 -0.0035 3 Cl- 0.55255E-01 -1.2576 0.42303E-01 -1.3736 0.76560E+00 -0.1160 4 SO4-- 0.38482E-09 -9.4147 0.14556E-09 -9.8369 0.37826E+00 -0.4222 5 HCO3- 0.82357E-05 -5.0843 0.63246E-05 -5.1990 0.76795E+00 -0.1147 6 HS- 0.58582E-06 -6.2322 0.44864E-06 -6.3481 0.76583E+00 -0.1159 7 Al+++ 0.44634E-05 -5.3503 0.50293E-06 -6.2985 0.11268E+00 -0.9482 8 H4SiO4 0.10082E-02 -2.9964 0.10082E-02 -2.9964 0.10000E+01 0.0000 9 Ca++ 0.18952E-06 -6.7223 0.70562E-07 -7.1514 0.37232E+00 -0.4291 10 Mg++ 0.76462E-10 -10.1166 0.28195E-10 -10.5498 0.36874E+00 -0.4333 11 Fe++ 0.29713E-07 -7.5271 0.10982E-07 -7.9593 0.36959E+00 -0.4323 12 K+ 0.13288E-03 -3.8765 0.10209E-03 -3.9910 0.76828E+00 -0.1145 13 Na+ 0.18659E-01 -1.7291 0.14278E-01 -1.8453 0.76521E+00 -0.1162 14 Mn++ 0.18834E-08 -8.7251 0.69731E-09 -9.1566 0.37024E+00 -0.4315 15 F- 0.25335E-04 -4.5963 0.19316E-04 -4.7141 0.76241E+00 -0.1178 16 HPO4-- 0.16527E-13 -13.7818 0.62533E-14 -14.2039 0.37838E+00 -0.4221 17 SiF6-2 0.29203E-12 -12.5346 0.10998E-12 -12.9587 0.37658E+00 -0.4241 18 HSiO3- 0.43824E-10 -10.3583 0.33551E-10 -10.4743 0.76560E+00 -0.1160 19 Ca(HSiO3)+ 0.70146E-16 -16.1540 0.53916E-16 -16.2683 0.76863E+00 -0.1143 20 Mg(HSiO3)+ 0.34882E-19 -19.4574 0.26811E-19 -19.5717 0.76863E+00 -0.1143 21 NaHSiO3,aq 0.77479E-11 -11.1108 0.77479E-11 -11.1108 0.10000E+01 0.0000 22 AlO+ 0.11036E-09 -9.9572 0.84826E-10 -10.0715 0.76863E+00 -0.1143 23 AlOH+2 0.32204E-07 -7.4921 0.11948E-07 -7.9227 0.37100E+00 -0.4306 24 HAlO2,aq 0.59241E-12 -12.2274 0.59241E-12 -12.2274 0.10000E+01 0.0000 25 AlO2- 0.60777E-16 -16.2163 0.46360E-16 -16.3339 0.76278E+00 -0.1176 26 CH4,aq 0.19901E-07 -7.7011 0.18783E-07 -7.7262 0.94379E+00 -0.0251 27 C2H6,aq 0.93054E-17 -17.0313 0.87824E-17 -17.0564 0.94379E+00 -0.0251 31 CO,aq 0.67020E-10 -10.1738 0.67020E-10 -10.1738 0.10000E+01 0.0000 32 CO2,aq 0.40831E+00 -0.3890 0.38537E+00 -0.4141 0.94379E+00 -0.0251 33 CO3-2 0.51861E-13 -13.2852 0.19530E-13 -13.7093 0.37658E+00 -0.4241 34 CaCO3,aq 0.17280E-16 -16.7625 0.17280E-16 -16.7625 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.14821E-10 -10.8291 0.11392E-10 -10.9434 0.76863E+00 -0.1143 36 CaCl+ 0.62848E-08 -8.2017 0.48307E-08 -8.3160 0.76863E+00 -0.1143 37 CaCl2,aq 0.48550E-10 -10.3138 0.48550E-10 -10.3138 0.10000E+01 0.0000 38 CaF+ 0.25890E-10 -10.5869 0.19900E-10 -10.7012 0.76863E+00 -0.1143 39 CaOH+ 0.22945E-15 -15.6393 0.17636E-15 -15.7536 0.76863E+00 -0.1143 40 CaSO4,aq 0.32616E-14 -14.4866 0.32616E-14 -14.4866 0.10000E+01 0.0000 41 HCl,aq 0.21927E-03 -3.6590 0.21927E-03 -3.6590 0.10000E+01 0.0000 45 HF,aq 0.37403E-02 -2.4271 0.37403E-02 -2.4271 0.10000E+01 0.0000 46 HF2- 0.31861E-07 -7.4967 0.24393E-07 -7.6127 0.76560E+00 -0.1160 47 Fe+3 0.26838E-17 -17.5713 0.30439E-18 -18.5166 0.11342E+00 -0.9453 48 FeCl+ 0.95666E-09 -9.0192 0.73531E-09 -9.1335 0.76863E+00 -0.1143 49 FeCl2,aq 0.98482E-15 -15.0066 0.98482E-15 -15.0066 0.10000E+01 0.0000 50 FeCl+2 0.24799E-17 -17.6056 0.92003E-18 -18.0362 0.37100E+00 -0.4306 51 FeF+ 0.14103E-10 -10.8507 0.10840E-10 -10.9650 0.76863E+00 -0.1143 52 FeF+2 0.14125E-15 -15.8500 0.52402E-16 -16.2807 0.37100E+00 -0.4306 54 FeOH+ 0.16309E-13 -13.7876 0.12536E-13 -13.9019 0.76863E+00 -0.1143 56 FeO+ 0.46942E-18 -18.3284 0.36081E-18 -18.4427 0.76863E+00 -0.1143 57 FeOH+2 0.52535E-17 -17.2795 0.19490E-17 -17.7102 0.37100E+00 -0.4306 60 H2,aq 0.72764E-08 -8.1381 0.68674E-08 -8.1632 0.94379E+00 -0.0251 61 KCl,aq 0.78272E-07 -7.1064 0.78272E-07 -7.1064 0.10000E+01 0.0000 62 KHSO4,aq 0.11885E-14 -14.9250 0.11885E-14 -14.9250 0.10000E+01 0.0000 63 KOH,aq 0.15289E-14 -14.8156 0.15289E-14 -14.8156 0.10000E+01 0.0000 64 KSO4- 0.30120E-12 -12.5211 0.23060E-12 -12.6371 0.76560E+00 -0.1160 66 Mg(HCO3)+ 0.60513E-14 -14.2182 0.46512E-14 -14.3324 0.76863E+00 -0.1143 67 MgCl+ 0.22761E-11 -11.6428 0.17494E-11 -11.7571 0.76863E+00 -0.1143 68 MgF+ 0.38321E-13 -13.4166 0.29454E-13 -13.5309 0.76863E+00 -0.1143 69 MgOH+ 0.50731E-18 -18.2947 0.38994E-18 -18.4090 0.76863E+00 -0.1143 71 MnF+ 0.29516E-12 -12.5299 0.22687E-12 -12.6442 0.76863E+00 -0.1143 73 MnOH+ 0.96204E-16 -16.0168 0.73945E-16 -16.1311 0.76863E+00 -0.1143 78 MnCl+ 0.23633E-09 -9.6265 0.18165E-09 -9.7408 0.76863E+00 -0.1143 79 MnSO4,aq 0.29303E-16 -16.5331 0.29303E-16 -16.5331 0.10000E+01 0.0000 80 NaCl,aq 0.20017E-03 -3.6986 0.20017E-03 -3.6986 0.10000E+01 0.0000 81 NaF,aq 0.64568E-07 -7.1900 0.64568E-07 -7.1900 0.10000E+01 0.0000 82 NaOH,aq 0.21513E-12 -12.6673 0.21513E-12 -12.6673 0.10000E+01 0.0000 84 OH- 0.26563E-10 -10.5757 0.20262E-10 -10.6933 0.76278E+00 -0.1176 90 H3PO3,aq 0.23953E-19 -19.6206 0.23953E-19 -19.6206 0.10000E+01 0.0000 92 H3PO4,aq 0.34993E-07 -7.4560 0.34993E-07 -7.4560 0.10000E+01 0.0000 93 H2PO4- 0.42536E-08 -8.3712 0.32630E-08 -8.4864 0.76712E+00 -0.1151 95 H4P2O7,aq 0.16275E-16 -16.7885 0.16275E-16 -16.7885 0.10000E+01 0.0000 96 H3P2O7- 0.95949E-17 -17.0180 0.73459E-17 -17.1340 0.76560E+00 -0.1160 97 H2P2O7-2 0.22349E-17 -17.6508 0.84161E-18 -18.0749 0.37658E+00 -0.4241 100 H2S,aq 0.41557E-01 -1.3814 0.39221E-01 -1.4065 0.94379E+00 -0.0251 101 S2-2 0.17245E-14 -14.7633 0.64943E-15 -15.1875 0.37658E+00 -0.4241 102 S3-2 0.13269E-13 -13.8772 0.49970E-14 -14.3013 0.37658E+00 -0.4241 103 S3- 0.14934E-08 -8.8258 0.11433E-08 -8.9418 0.76560E+00 -0.1160 104 S4-2 0.67444E-13 -13.1711 0.25398E-13 -13.5952 0.37658E+00 -0.4241 105 S5-2 0.22858E-12 -12.6410 0.86079E-13 -13.0651 0.37658E+00 -0.4241 106 SO2,aq 0.36302E-11 -11.4401 0.36302E-11 -11.4401 0.10000E+01 0.0000 107 SO3-2 0.33746E-18 -18.4718 0.13096E-18 -18.8829 0.38807E+00 -0.4111 108 HSO3- 0.30294E-12 -12.5186 0.23193E-12 -12.6346 0.76560E+00 -0.1160 109 HSO4- 0.51515E-08 -8.2881 0.39681E-08 -8.4014 0.77027E+00 -0.1134 111 S2O3-2 0.17953E-12 -12.7459 0.67608E-13 -13.1700 0.37658E+00 -0.4241 112 HS2O3- 0.44663E-12 -12.3501 0.34194E-12 -12.4661 0.76560E+00 -0.1160 113 H2S2O3,aq 0.15506E-12 -12.8095 0.15506E-12 -12.8095 0.10000E+01 0.0000 Charge balance for all species = -.5185E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3648358E-01 0.4903150E+00 0.4835665E+03 0.0000 2 H2O 0.1000000E+01 0.5509994E+02 0.9712678E+06 0.0000 3 Cl- 0.5525492E-01 0.5567444E-01 0.1931325E+04 0.1748 4 SO4-- 0.3848194E-09 -.1526335E-07 -.1434651E-02 -6.7401 5 HCO3- 0.8235668E-05 0.4083232E+00 0.2437826E+05 -3.6505 6 HS- 0.5858180E-06 0.4155736E-01 0.1344791E+04 -4.7997 7 Al+++ 0.4463370E-05 0.4495686E-05 0.1186884E+00 -1.6532 8 H4SiO4 0.1008217E-02 0.1008217E-02 0.9481854E+02 -2.9964 9 Ca++ 0.1895231E-06 0.1958972E-06 0.7682112E-02 -4.0546 10 Mg++ 0.7646198E-10 0.7878241E-10 0.1874115E-05 -7.4530 11 Fe++ 0.2971274E-07 0.3068352E-07 0.1676685E-02 -4.8625 12 K+ 0.1328801E-03 0.1329584E-03 0.5086992E+01 -2.4426 13 Na+ 0.1865874E-01 0.1885898E-01 0.4242284E+03 -0.2969 14 Mn++ 0.1883430E-08 0.2120055E-08 0.1139637E-03 -6.0597 15 F- 0.2533525E-04 0.3765779E-02 0.7000179E+02 -3.1657 16 HPO4-- 0.1652660E-13 0.3924674E-07 0.3685753E-02 -11.1070 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1056722E+01 0.5208164E+00 0.2386758E+00 0.2972302E+00 2 H2O 0.5803340E+02 0.5852758E+02 -.2131048E+00 -.2810713E+00 3 Cl- 0.5913783E-01 0.5913782E-01 0.0000000E+00 0.2363610E-08 4 SO4-- 0.4773497E-01 -.1621285E-07 0.4773516E-01 -.1763578E-06 5 HCO3- 0.7230123E+00 0.4337241E+00 0.0000000E+00 0.2892883E+00 6 HS- 0.1952903E+00 0.4414255E-01 0.1432055E+00 0.7942264E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1070936E-02 0.1108208E-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- 0.4000096E-02 0.4000040E-02 0.0000000E+00 0.5610317E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2317E-17 Mass of aqueous solution: 0.108558E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 9.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.8217E-02 -2.085 0.1480 -0.830 1.125 3.263 CO2,gas 0.2893 -0.539 12.73 1.105 96.82 155.8 CH4,gas 0.1628E-06 -6.788 0.2611E-05 -5.583 0.1986E-04 0.1051E-03 H2,gas 0.5363E-07 -7.271 0.1083E-06 -6.965 0.8238E-06 0.3416E-04 H2S,gas 0.7942E-02 -2.100 0.2707 -0.568 2.058 4.043 S2,gas 0.3279E-11 -11.484 0.2102E-09 -9.677 0.1599E-08 0.2035E-08 CO,gas 0.6101E-09 -9.215 0.1709E-07 -7.767 0.1300E-06 0.3786E-06 SO3,gas 0.2712E-30 -30.567 0.2171E-28 -28.663 0.1651E-27 0.1683E-27 SO2,gas 0.9590E-13 -13.018 0.6143E-11 -11.212 0.4672E-10 0.5951E-10 HF,gas 0.5610E-07 -7.251 0.1122E-05 -5.950 0.8533E-05 0.3481E-04 HCl,gas 0.2364E-08 -8.626 0.8618E-07 -7.065 0.6553E-06 0.1467E-05 quartz 0.1108E-01 -1.955 0.6658 -0.177 9.810 0.2514 sulfur 0.1909 -0.719 6.122 0.787 90.19 2.962 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 0.9471E+00 0.4735E+02 0.8707 1.615 CH4,gas 0.5330E-06 0.2665E-04 1.0374 -4.558 H2,gas 0.1756E-06 0.8779E-05 1.0270 -5.045 H2S,gas 0.2600E-01 0.1300E+01 0.8293 0.033 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.1997E-08 0.9987E-07 1.0000 -7.001 SO3,gas 0.8879E-30 0.4439E-28 1.0000 -28.353 SO2,gas 0.3140E-12 0.1570E-10 1.0000 -10.804 HF,gas 0.1837E-06 0.9184E-05 1.0000 -5.037 HCl,gas 0.7738E-08 0.3869E-06 1.0000 -6.412 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: 1.189505 % Solid products produced: Mass = 6.787369 g Volume = 3.213005 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: 9.9999900 moles log = 1.0000 Original solution: 1000.0103000 g Original solution / Rock added: 100.00 (Water/Rock Ratio), log = 2.0000 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 0.60662E-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 -0.34122E-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 0.30331E-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 -1.66 -4.53 -0.756 0.77416E+04 69 diamond -3.10 -4.23 -1.12 -0.321 0.19173E+04 89 graphite -3.55 -4.23 -0.68 -0.194 0.11595E+04 92 halite 1.57 -3.22 -4.79 -2.397 0.81848E+04 145 pyrite -21.25 -21.91 -0.66 -0.156 0.11345E+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 -18.83 -2.28 -0.254 0.38959E+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: 0.4000000 MOLES Current total amount of reactant added: 9.9999900 MOLES New total amount of reactant added: 10.3999900 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 = 10.3999900 Water: Moles liquid = 0.5932E+02 kg liquid = 0.1069E+01 Moles total = 0.5836E+02 kg total = 0.1051E+01 Activity = 0.9919 Stoichiometric ionic strength = .2674297E+00 Osmotic coef. = 0.9149 True ionic strength = .5714684E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6150E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.38448E-01 -1.4151 0.29731E-01 -1.5268 0.77328E+00 -0.1117 2 H2O 0.99195E+00 -0.0035 0.99195E+00 -0.0035 3 Cl- 0.57100E-01 -1.2434 0.43589E-01 -1.3606 0.76337E+00 -0.1173 4 SO4-- 0.33185E-09 -9.4791 0.12410E-09 -9.9062 0.37396E+00 -0.4272 5 HCO3- 0.78533E-05 -5.1049 0.60139E-05 -5.2208 0.76577E+00 -0.1159 6 HS- 0.57023E-06 -6.2439 0.43544E-06 -6.3611 0.76361E+00 -0.1171 7 Al+++ 0.44380E-05 -5.3528 0.48707E-06 -6.3124 0.10975E+00 -0.9596 8 H4SiO4 0.10082E-02 -2.9965 0.10082E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18823E-06 -6.7253 0.69260E-07 -7.1595 0.36795E+00 -0.4342 10 Mg++ 0.75949E-10 -10.1195 0.27671E-10 -10.5580 0.36434E+00 -0.4385 11 Fe++ 0.29512E-07 -7.5300 0.10778E-07 -7.9675 0.36520E+00 -0.4375 12 K+ 0.13206E-03 -3.8792 0.10117E-03 -3.9949 0.76610E+00 -0.1157 13 Na+ 0.18539E-01 -1.7319 0.14145E-01 -1.8494 0.76298E+00 -0.1175 14 Mn++ 0.18675E-08 -8.7287 0.68323E-09 -9.1654 0.36585E+00 -0.4367 15 F- 0.24997E-04 -4.6021 0.19001E-04 -4.7212 0.76013E+00 -0.1191 16 HPO4-- 0.15114E-13 -13.8206 0.56537E-14 -14.2477 0.37408E+00 -0.4270 17 SiF6-2 0.32672E-12 -12.4858 0.12163E-12 -12.9150 0.37227E+00 -0.4291 18 HSiO3- 0.41815E-10 -10.3787 0.31920E-10 -10.4959 0.76337E+00 -0.1173 19 Ca(HSiO3)+ 0.65690E-16 -16.1825 0.50349E-16 -16.2980 0.76646E+00 -0.1155 20 Mg(HSiO3)+ 0.32662E-19 -19.4860 0.25034E-19 -19.6015 0.76646E+00 -0.1155 21 NaHSiO3,aq 0.73026E-11 -11.1365 0.73026E-11 -11.1365 0.10000E+01 0.0000 22 AlO+ 0.97018E-10 -10.0131 0.74360E-10 -10.1287 0.76646E+00 -0.1155 23 AlOH+2 0.30027E-07 -7.5225 0.11008E-07 -7.9583 0.36661E+00 -0.4358 24 HAlO2,aq 0.49408E-12 -12.3062 0.49408E-12 -12.3062 0.10000E+01 0.0000 25 AlO2- 0.48370E-16 -16.3154 0.36786E-16 -16.4343 0.76051E+00 -0.1189 26 CH4,aq 0.21547E-07 -7.6666 0.20332E-07 -7.6918 0.94362E+00 -0.0252 27 C2H6,aq 0.10691E-16 -16.9710 0.10088E-16 -16.9962 0.94362E+00 -0.0252 31 CO,aq 0.68334E-10 -10.1654 0.68334E-10 -10.1654 0.10000E+01 0.0000 32 CO2,aq 0.40817E+00 -0.3892 0.38515E+00 -0.4144 0.94362E+00 -0.0252 33 CO3-2 0.47461E-13 -13.3237 0.17668E-13 -13.7528 0.37227E+00 -0.4291 34 CaCO3,aq 0.15344E-16 -16.8141 0.15344E-16 -16.8141 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.13872E-10 -10.8579 0.10632E-10 -10.9734 0.76646E+00 -0.1155 36 CaCl+ 0.63743E-08 -8.1956 0.48856E-08 -8.3111 0.76646E+00 -0.1155 37 CaCl2,aq 0.50594E-10 -10.2959 0.50594E-10 -10.2959 0.10000E+01 0.0000 38 CaF+ 0.25069E-10 -10.6009 0.19214E-10 -10.7164 0.76646E+00 -0.1155 39 CaOH+ 0.21487E-15 -15.6678 0.16469E-15 -15.7833 0.76646E+00 -0.1155 40 CaSO4,aq 0.27293E-14 -14.5639 0.27293E-14 -14.5639 0.10000E+01 0.0000 41 HCl,aq 0.23747E-03 -3.6244 0.23747E-03 -3.6244 0.10000E+01 0.0000 45 HF,aq 0.38673E-02 -2.4126 0.38673E-02 -2.4126 0.10000E+01 0.0000 46 HF2- 0.32500E-07 -7.4881 0.24810E-07 -7.6054 0.76337E+00 -0.1173 47 Fe+3 0.28138E-17 -17.5507 0.31088E-18 -18.5074 0.11049E+00 -0.9567 48 FeCl+ 0.97016E-09 -9.0132 0.74358E-09 -9.1287 0.76646E+00 -0.1155 49 FeCl2,aq 0.10262E-14 -14.9888 0.10262E-14 -14.9888 0.10000E+01 0.0000 50 FeCl+2 0.26409E-17 -17.5782 0.96820E-18 -18.0140 0.36661E+00 -0.4358 51 FeF+ 0.13654E-10 -10.8648 0.10465E-10 -10.9803 0.76646E+00 -0.1155 52 FeF+2 0.14360E-15 -15.8428 0.52647E-16 -16.2786 0.36661E+00 -0.4358 54 FeOH+ 0.15271E-13 -13.8161 0.11705E-13 -13.9316 0.76646E+00 -0.1155 56 FeO+ 0.43518E-18 -18.3613 0.33355E-18 -18.4768 0.76646E+00 -0.1155 57 FeOH+2 0.51657E-17 -17.2869 0.18938E-17 -17.7227 0.36661E+00 -0.4358 60 H2,aq 0.74244E-08 -8.1293 0.70058E-08 -8.1545 0.94362E+00 -0.0252 61 KCl,aq 0.79928E-07 -7.0973 0.79928E-07 -7.0973 0.10000E+01 0.0000 62 KHSO4,aq 0.10554E-14 -14.9766 0.10554E-14 -14.9766 0.10000E+01 0.0000 63 KOH,aq 0.14416E-14 -14.8412 0.14416E-14 -14.8412 0.10000E+01 0.0000 64 KSO4- 0.25523E-12 -12.5931 0.19483E-12 -12.7103 0.76337E+00 -0.1173 66 Mg(HCO3)+ 0.56631E-14 -14.2469 0.43405E-14 -14.3625 0.76646E+00 -0.1155 67 MgCl+ 0.23082E-11 -11.6367 0.17691E-11 -11.7522 0.76646E+00 -0.1155 68 MgF+ 0.37101E-13 -13.4306 0.28436E-13 -13.5461 0.76646E+00 -0.1155 69 MgOH+ 0.47503E-18 -18.3233 0.36409E-18 -18.4388 0.76646E+00 -0.1155 71 MnF+ 0.28529E-12 -12.5447 0.21866E-12 -12.6602 0.76646E+00 -0.1155 73 MnOH+ 0.89933E-16 -16.0461 0.68930E-16 -16.1616 0.76646E+00 -0.1155 78 MnCl+ 0.23927E-09 -9.6211 0.18339E-09 -9.7366 0.76646E+00 -0.1155 79 MnSO4,aq 0.24478E-16 -16.6112 0.24478E-16 -16.6112 0.10000E+01 0.0000 80 NaCl,aq 0.20433E-03 -3.6897 0.20433E-03 -3.6897 0.10000E+01 0.0000 81 NaF,aq 0.62924E-07 -7.2012 0.62924E-07 -7.2012 0.10000E+01 0.0000 82 NaOH,aq 0.20276E-12 -12.6930 0.20276E-12 -12.6930 0.10000E+01 0.0000 84 OH- 0.25347E-10 -10.5961 0.19277E-10 -10.7150 0.76051E+00 -0.1189 90 H3PO3,aq 0.24408E-19 -19.6125 0.24408E-19 -19.6125 0.10000E+01 0.0000 92 H3PO4,aq 0.34953E-07 -7.4565 0.34953E-07 -7.4565 0.10000E+01 0.0000 93 H2PO4- 0.40538E-08 -8.3921 0.31008E-08 -8.5085 0.76493E+00 -0.1164 95 H4P2O7,aq 0.16238E-16 -16.7895 0.16238E-16 -16.7895 0.10000E+01 0.0000 96 H3P2O7- 0.91342E-17 -17.0393 0.69728E-17 -17.1566 0.76337E+00 -0.1173 97 H2P2O7-2 0.20417E-17 -17.6900 0.76005E-18 -18.1192 0.37227E+00 -0.4291 100 H2S,aq 0.42402E-01 -1.3726 0.40011E-01 -1.3978 0.94362E+00 -0.0252 101 S2-2 0.16109E-14 -14.7929 0.59969E-15 -15.2221 0.37227E+00 -0.4291 102 S3-2 0.12395E-13 -13.9068 0.46142E-14 -14.3359 0.37227E+00 -0.4291 103 S3- 0.14392E-08 -8.8419 0.10987E-08 -8.9591 0.76337E+00 -0.1173 104 S4-2 0.63000E-13 -13.2007 0.23453E-13 -13.6298 0.37227E+00 -0.4291 105 S5-2 0.21352E-12 -12.6706 0.79486E-13 -13.0997 0.37227E+00 -0.4291 106 SO2,aq 0.34881E-11 -11.4574 0.34881E-11 -11.4574 0.10000E+01 0.0000 107 SO3-2 0.29671E-18 -18.5277 0.11390E-18 -18.9435 0.38387E+00 -0.4158 108 HSO3- 0.27775E-12 -12.5564 0.21202E-12 -12.6736 0.76337E+00 -0.1173 109 HSO4- 0.46290E-08 -8.3345 0.35557E-08 -8.4491 0.76814E+00 -0.1146 111 S2O3-2 0.15795E-12 -12.8015 0.58801E-13 -13.2306 0.37227E+00 -0.4291 112 HS2O3- 0.40948E-12 -12.3878 0.31258E-12 -12.5050 0.76337E+00 -0.1173 113 H2S2O3,aq 0.14899E-12 -12.8269 0.14899E-12 -12.8269 0.10000E+01 0.0000 Charge balance for all species = -.5153E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3844828E-01 0.4931202E+00 0.4862902E+03 0.0000 2 H2O 0.1000000E+01 0.5510009E+02 0.9711847E+06 0.0000 3 Cl- 0.5709981E-01 0.5754170E-01 0.1995923E+04 0.1662 4 SO4-- 0.3318486E-09 -.1755604E-07 -.1650002E-02 -6.8527 5 HCO3- 0.7853314E-05 0.4081730E+00 0.2436714E+05 -3.6941 6 HS- 0.5702336E-06 0.4240260E-01 0.1372022E+04 -4.8343 7 Al+++ 0.4438032E-05 0.4468156E-05 0.1179512E+00 -1.7320 8 H4SiO4 0.1008192E-02 0.1008192E-02 0.9480782E+02 -2.9965 9 Ca++ 0.1882338E-06 0.1946976E-06 0.7634397E-02 -4.1059 10 Mg++ 0.7594904E-10 0.7829998E-10 0.1862475E-05 -7.5044 11 Fe++ 0.2951180E-07 0.3049563E-07 0.1666270E-02 -4.9139 12 K+ 0.1320643E-03 0.1321442E-03 0.5055395E+01 -2.4681 13 Na+ 0.1853910E-01 0.1874349E-01 0.4215934E+03 -0.3226 14 Mn++ 0.1867520E-08 0.2107073E-08 0.1132558E-03 -6.1119 15 F- 0.2499706E-04 0.3892420E-02 0.7234952E+02 -3.1944 16 HPO4-- 0.1511382E-13 0.3900641E-07 0.3662860E-02 -11.1941 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1099792E+01 0.5270233E+00 0.2482260E+00 0.3245431E+00 2 H2O 0.5836088E+02 0.5888834E+02 -.2207318E+00 -.3067247E+00 3 Cl- 0.6149783E-01 0.6149782E-01 0.0000000E+00 0.2795053E-08 4 SO4-- 0.4964497E-01 -.1876306E-07 0.4964519E-01 -.2075257E-06 5 HCO3- 0.7519323E+00 0.4362357E+00 0.0000000E+00 0.3156966E+00 6 HS- 0.2031003E+00 0.4531787E-01 0.1489356E+00 0.8846840E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1077507E-02 0.1107551E-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- 0.4160096E-02 0.4160033E-02 0.0000000E+00 0.6333821E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4758E-16 Mass of aqueous solution: 0.109237E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 10.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.8971E-02 -2.047 0.1616 -0.792 1.125 3.563 CO2,gas 0.3157 -0.501 13.89 1.143 96.77 170.0 CH4,gas 0.1924E-06 -6.716 0.3086E-05 -5.511 0.2150E-04 0.1242E-03 H2,gas 0.5974E-07 -7.224 0.1207E-06 -6.918 0.8405E-06 0.3805E-04 H2S,gas 0.8847E-02 -2.053 0.3015 -0.521 2.100 4.504 S2,gas 0.3580E-11 -11.446 0.2296E-09 -9.639 0.1599E-08 0.2222E-08 CO,gas 0.6792E-09 -9.168 0.1903E-07 -7.721 0.1325E-06 0.4215E-06 SO3,gas 0.2789E-30 -30.555 0.2233E-28 -28.651 0.1555E-27 0.1731E-27 SO2,gas 0.1006E-12 -12.997 0.6445E-11 -11.191 0.4489E-10 0.6243E-10 HF,gas 0.6334E-07 -7.198 0.1267E-05 -5.897 0.8823E-05 0.3930E-04 HCl,gas 0.2795E-08 -8.554 0.1019E-06 -6.992 0.7098E-06 0.1734E-05 quartz 0.1108E-01 -1.956 0.6654 -0.177 9.463 0.2513 sulfur 0.1986 -0.702 6.366 0.804 90.54 3.080 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 0.9466E+00 0.4733E+02 0.8707 1.615 CH4,gas 0.5770E-06 0.2885E-04 1.0374 -4.524 H2,gas 0.1791E-06 0.8956E-05 1.0270 -5.036 H2S,gas 0.2653E-01 0.1326E+01 0.8293 0.041 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2037E-08 0.1018E-06 1.0000 -6.992 SO3,gas 0.8363E-30 0.4181E-28 1.0000 -28.379 SO2,gas 0.3017E-12 0.1508E-10 1.0000 -10.821 HF,gas 0.1899E-06 0.9496E-05 1.0000 -5.022 HCl,gas 0.8381E-08 0.4190E-06 1.0000 -6.378 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: 1.289049 % Solid products produced: Mass = 7.031916 g Volume = 3.331358 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: 10.3999900 moles log = 1.0170 Original solution: 1000.0103000 g Original solution / Rock added: 96.15 (Water/Rock Ratio), log = 1.9830 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 0.00000E+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 -0.15165E-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 -0.60662E-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 0.37914E-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 -1.74 -4.61 -0.769 0.78762E+04 69 diamond -3.10 -4.21 -1.11 -0.316 0.18881E+04 89 graphite -3.55 -4.21 -0.66 -0.189 0.11303E+04 92 halite 1.57 -3.21 -4.78 -2.392 0.81696E+04 145 pyrite -21.25 -21.95 -0.71 -0.166 0.12075E+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 -18.96 -2.41 -0.268 0.41155E+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: 0.4000000 MOLES Current total amount of reactant added: 10.3999900 MOLES New total amount of reactant added: 10.7999900 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 = 10.7999900 Water: Moles liquid = 0.5969E+02 kg liquid = 0.1075E+01 Moles total = 0.5869E+02 kg total = 0.1057E+01 Activity = 0.9919 Stoichiometric ionic strength = .2687008E+00 Osmotic coef. = 0.9149 True ionic strength = .5896806E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6386E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.40389E-01 -1.3937 0.31152E-01 -1.5065 0.77132E+00 -0.1128 2 H2O 0.99194E+00 -0.0035 0.99194E+00 -0.0035 3 Cl- 0.58922E-01 -1.2297 0.44854E-01 -1.3482 0.76124E+00 -0.1185 4 SO4-- 0.28881E-09 -9.5394 0.10682E-09 -9.9713 0.36986E+00 -0.4320 5 HCO3- 0.75115E-05 -5.1243 0.57364E-05 -5.2414 0.76368E+00 -0.1171 6 HS- 0.55611E-06 -6.2548 0.42347E-06 -6.3732 0.76148E+00 -0.1183 7 Al+++ 0.44128E-05 -5.3553 0.47216E-06 -6.3259 0.10700E+00 -0.9706 8 H4SiO4 0.10082E-02 -2.9965 0.10082E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18696E-06 -6.7282 0.68015E-07 -7.1674 0.36379E+00 -0.4392 10 Mg++ 0.75444E-10 -10.1224 0.27171E-10 -10.5659 0.36015E+00 -0.4435 11 Fe++ 0.29314E-07 -7.5329 0.10583E-07 -7.9754 0.36101E+00 -0.4425 12 K+ 0.13126E-03 -3.8819 0.10028E-03 -3.9988 0.76401E+00 -0.1169 13 Na+ 0.18421E-01 -1.7347 0.14015E-01 -1.8534 0.76083E+00 -0.1187 14 Mn++ 0.18519E-08 -8.7324 0.66978E-09 -9.1741 0.36167E+00 -0.4417 15 F- 0.24701E-04 -4.6073 0.18722E-04 -4.7276 0.75795E+00 -0.1204 16 HPO4-- 0.13896E-13 -13.8571 0.51412E-14 -14.2889 0.36998E+00 -0.4318 17 SiF6-2 0.36442E-12 -12.4384 0.13416E-12 -12.8724 0.36815E+00 -0.4340 18 HSiO3- 0.40019E-10 -10.3977 0.30464E-10 -10.5162 0.76124E+00 -0.1185 19 Ca(HSiO3)+ 0.61733E-16 -16.2095 0.47187E-16 -16.3262 0.76437E+00 -0.1167 20 Mg(HSiO3)+ 0.30691E-19 -19.5130 0.23460E-19 -19.6297 0.76437E+00 -0.1167 21 NaHSiO3,aq 0.69055E-11 -11.1608 0.69055E-11 -11.1608 0.10000E+01 0.0000 22 AlO+ 0.85894E-10 -10.0660 0.65655E-10 -10.1827 0.76437E+00 -0.1167 23 AlOH+2 0.28100E-07 -7.5513 0.10184E-07 -7.9921 0.36244E+00 -0.4408 24 HAlO2,aq 0.41633E-12 -12.3806 0.41633E-12 -12.3806 0.10000E+01 0.0000 25 AlO2- 0.39011E-16 -16.4088 0.29583E-16 -16.5290 0.75833E+00 -0.1201 26 CH4,aq 0.23225E-07 -7.6340 0.21912E-07 -7.6593 0.94345E+00 -0.0253 27 C2H6,aq 0.12187E-16 -16.9141 0.11497E-16 -16.9394 0.94345E+00 -0.0253 31 CO,aq 0.69596E-10 -10.1574 0.69596E-10 -10.1574 0.10000E+01 0.0000 32 CO2,aq 0.40802E+00 -0.3893 0.38495E+00 -0.4146 0.94345E+00 -0.0253 33 CO3-2 0.43688E-13 -13.3596 0.16084E-13 -13.7936 0.36815E+00 -0.4340 34 CaCO3,aq 0.13717E-16 -16.8627 0.13717E-16 -16.8627 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.13029E-10 -10.8851 0.99592E-11 -11.0018 0.76437E+00 -0.1167 36 CaCl+ 0.64589E-08 -8.1898 0.49370E-08 -8.3065 0.76437E+00 -0.1167 37 CaCl2,aq 0.52610E-10 -10.2789 0.52610E-10 -10.2789 0.10000E+01 0.0000 38 CaF+ 0.24322E-10 -10.6140 0.18591E-10 -10.7307 0.76437E+00 -0.1167 39 CaOH+ 0.20193E-15 -15.6948 0.15435E-15 -15.8115 0.76437E+00 -0.1167 40 CaSO4,aq 0.23071E-14 -14.6369 0.23071E-14 -14.6369 0.10000E+01 0.0000 41 HCl,aq 0.25605E-03 -3.5917 0.25605E-03 -3.5917 0.10000E+01 0.0000 45 HF,aq 0.39927E-02 -2.3987 0.39927E-02 -2.3987 0.10000E+01 0.0000 46 HF2- 0.33154E-07 -7.4795 0.25238E-07 -7.5979 0.76124E+00 -0.1185 47 Fe+3 0.29411E-17 -17.5315 0.31685E-18 -18.4991 0.10773E+00 -0.9677 48 FeCl+ 0.98292E-09 -9.0075 0.75132E-09 -9.1242 0.76437E+00 -0.1167 49 FeCl2,aq 0.10669E-14 -14.9719 0.10669E-14 -14.9719 0.10000E+01 0.0000 50 FeCl+2 0.28017E-17 -17.5526 0.10154E-17 -17.9934 0.36244E+00 -0.4408 51 FeF+ 0.13246E-10 -10.8779 0.10125E-10 -10.9946 0.76437E+00 -0.1167 52 FeF+2 0.14587E-15 -15.8360 0.52870E-16 -16.2768 0.36244E+00 -0.4408 54 FeOH+ 0.14350E-13 -13.8432 0.10969E-13 -13.9599 0.76437E+00 -0.1167 56 FeO+ 0.40509E-18 -18.3925 0.30964E-18 -18.5091 0.76437E+00 -0.1167 57 FeOH+2 0.50825E-17 -17.2939 0.18421E-17 -17.7347 0.36244E+00 -0.4408 60 H2,aq 0.75669E-08 -8.1211 0.71390E-08 -8.1464 0.94345E+00 -0.0253 61 KCl,aq 0.81523E-07 -7.0887 0.81523E-07 -7.0887 0.10000E+01 0.0000 62 KHSO4,aq 0.94353E-15 -15.0252 0.94353E-15 -15.0252 0.10000E+01 0.0000 63 KOH,aq 0.13637E-14 -14.8653 0.13637E-14 -14.8653 0.10000E+01 0.0000 64 KSO4- 0.21837E-12 -12.6608 0.16623E-12 -12.7793 0.76124E+00 -0.1185 66 Mg(HCO3)+ 0.53185E-14 -14.2742 0.40653E-14 -14.3909 0.76437E+00 -0.1167 67 MgCl+ 0.23386E-11 -11.6311 0.17875E-11 -11.7477 0.76437E+00 -0.1167 68 MgF+ 0.35993E-13 -13.4438 0.27512E-13 -13.5605 0.76437E+00 -0.1167 69 MgOH+ 0.44637E-18 -18.3503 0.34119E-18 -18.4670 0.76437E+00 -0.1167 71 MnF+ 0.27632E-12 -12.5586 0.21122E-12 -12.6753 0.76437E+00 -0.1167 73 MnOH+ 0.84370E-16 -16.0738 0.64490E-16 -16.1905 0.76437E+00 -0.1167 78 MnCl+ 0.24203E-09 -9.6161 0.18500E-09 -9.7328 0.76437E+00 -0.1167 79 MnSO4,aq 0.20655E-16 -16.6850 0.20655E-16 -16.6850 0.10000E+01 0.0000 80 NaCl,aq 0.20833E-03 -3.6812 0.20833E-03 -3.6812 0.10000E+01 0.0000 81 NaF,aq 0.61432E-07 -7.2116 0.61432E-07 -7.2116 0.10000E+01 0.0000 82 NaOH,aq 0.19174E-12 -12.7173 0.19174E-12 -12.7173 0.10000E+01 0.0000 84 OH- 0.24260E-10 -10.6151 0.18397E-10 -10.7352 0.75833E+00 -0.1201 90 H3PO3,aq 0.24832E-19 -19.6050 0.24832E-19 -19.6050 0.10000E+01 0.0000 92 H3PO4,aq 0.34896E-07 -7.4572 0.34896E-07 -7.4572 0.10000E+01 0.0000 93 H2PO4- 0.38732E-08 -8.4119 0.29545E-08 -8.5295 0.76282E+00 -0.1176 95 H4P2O7,aq 0.16185E-16 -16.7909 0.16185E-16 -16.7909 0.10000E+01 0.0000 96 H3P2O7- 0.87136E-17 -17.0598 0.66331E-17 -17.1783 0.76124E+00 -0.1185 97 H2P2O7-2 0.18743E-17 -17.7272 0.69003E-18 -18.1611 0.36815E+00 -0.4340 100 H2S,aq 0.43216E-01 -1.3644 0.40772E-01 -1.3896 0.94345E+00 -0.0253 101 S2-2 0.15119E-14 -14.8205 0.55660E-15 -15.2545 0.36815E+00 -0.4340 102 S3-2 0.11633E-13 -13.9343 0.42827E-14 -14.3683 0.36815E+00 -0.4340 103 S3- 0.13904E-08 -8.8568 0.10585E-08 -8.9753 0.76124E+00 -0.1185 104 S4-2 0.59127E-13 -13.2282 0.21768E-13 -13.6622 0.36815E+00 -0.4340 105 S5-2 0.20039E-12 -12.6981 0.73775E-13 -13.1321 0.36815E+00 -0.4340 106 SO2,aq 0.33591E-11 -11.4738 0.33591E-11 -11.4738 0.10000E+01 0.0000 107 SO3-2 0.26299E-18 -18.5801 0.99904E-19 -19.0004 0.37987E+00 -0.4204 108 HSO3- 0.25598E-12 -12.5918 0.19486E-12 -12.7103 0.76124E+00 -0.1185 109 HSO4- 0.41862E-08 -8.3782 0.32070E-08 -8.4939 0.76609E+00 -0.1157 111 S2O3-2 0.14010E-12 -12.8536 0.51576E-13 -13.2875 0.36815E+00 -0.4340 112 HS2O3- 0.37739E-12 -12.4232 0.28729E-12 -12.5417 0.76124E+00 -0.1185 113 H2S2O3,aq 0.14347E-12 -12.8432 0.14347E-12 -12.8432 0.10000E+01 0.0000 Charge balance for all species = -.5122E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4038855E-01 0.4958751E+00 0.4889646E+03 0.0000 2 H2O 0.1000000E+01 0.5510023E+02 0.9711030E+06 0.0000 3 Cl- 0.5892177E-01 0.5938624E-01 0.2059725E+04 0.1583 4 SO4-- 0.2888103E-09 -.1978651E-07 -.1859471E-02 -6.9583 5 HCO3- 0.7511461E-05 0.4080295E+00 0.2435646E+05 -3.7349 6 HS- 0.5561134E-06 0.4321638E-01 0.1398232E+04 -4.8667 7 Al+++ 0.4412777E-05 0.4440962E-05 0.1172232E+00 -1.8064 8 H4SiO4 0.1008167E-02 0.1008168E-02 0.9479732E+02 -2.9965 9 Ca++ 0.1869638E-06 0.1935126E-06 0.7587274E-02 -4.1544 10 Mg++ 0.7544357E-10 0.7782344E-10 0.1850979E-05 -7.5529 11 Fe++ 0.2931385E-07 0.3031003E-07 0.1655986E-02 -4.9624 12 K+ 0.1312584E-03 0.1313399E-03 0.5024192E+01 -2.4923 13 Na+ 0.1842102E-01 0.1862942E-01 0.4189912E+03 -0.3469 14 Mn++ 0.1851947E-08 0.2094249E-08 0.1125568E-03 -6.1610 15 F- 0.2470119E-04 0.4017519E-02 0.7466830E+02 -3.2211 16 HPO4-- 0.1389600E-13 0.3876901E-07 0.3640251E-02 -11.2759 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1142862E+01 0.5332129E+00 0.2577761E+00 0.3518734E+00 2 H2O 0.5868836E+02 0.5924909E+02 -.2283588E+00 -.3323722E+00 3 Cl- 0.6385783E-01 0.6385782E-01 0.0000000E+00 0.3267450E-08 4 SO4-- 0.5155497E-01 -.2127637E-07 0.5155523E-01 -.2415174E-06 5 HCO3- 0.7808523E+00 0.4387527E+00 0.0000000E+00 0.3420996E+00 6 HS- 0.2109103E+00 0.4647043E-01 0.1546657E+00 0.9774170E-02 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1084079E-02 0.1106894E-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- 0.4320096E-02 0.4320025E-02 0.0000000E+00 0.7089865E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.5117E-16 Mass of aqueous solution: 0.109915E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 10.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.9727E-02 -2.012 0.1752 -0.757 1.126 3.863 CO2,gas 0.3421 -0.466 15.06 1.178 96.73 184.3 CH4,gas 0.2248E-06 -6.648 0.3606E-05 -5.443 0.2317E-04 0.1451E-03 H2,gas 0.6600E-07 -7.180 0.1333E-06 -6.875 0.8566E-06 0.4204E-04 H2S,gas 0.9774E-02 -2.010 0.3331 -0.477 2.140 4.976 S2,gas 0.3882E-11 -11.411 0.2489E-09 -9.604 0.1599E-08 0.2409E-08 CO,gas 0.7500E-09 -9.125 0.2101E-07 -7.678 0.1350E-06 0.4654E-06 SO3,gas 0.2858E-30 -30.544 0.2288E-28 -28.641 0.1470E-27 0.1773E-27 SO2,gas 0.1051E-12 -12.979 0.6730E-11 -11.172 0.4324E-10 0.6518E-10 HF,gas 0.7090E-07 -7.149 0.1418E-05 -5.848 0.9111E-05 0.4399E-04 HCl,gas 0.3267E-08 -8.486 0.1191E-06 -6.924 0.7654E-06 0.2027E-05 quartz 0.1107E-01 -1.956 0.6650 -0.177 9.139 0.2511 sulfur 0.2062 -0.686 6.611 0.820 90.86 3.199 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 0.9461E+00 0.4730E+02 0.8707 1.615 CH4,gas 0.6218E-06 0.3109E-04 1.0375 -4.491 H2,gas 0.1825E-06 0.9126E-05 1.0270 -5.028 H2S,gas 0.2703E-01 0.1351E+01 0.8293 0.050 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2074E-08 0.1037E-06 1.0000 -6.984 SO3,gas 0.7903E-30 0.3952E-28 1.0000 -28.403 SO2,gas 0.2905E-12 0.1453E-10 1.0000 -10.838 HF,gas 0.1961E-06 0.9803E-05 1.0000 -5.009 HCl,gas 0.9036E-08 0.4518E-06 1.0000 -6.345 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: 1.387181 % Solid products produced: Mass = 7.276465 g Volume = 3.449711 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: 10.7999900 moles log = 1.0334 Original solution: 1000.0103000 g Original solution / Rock added: 92.59 (Water/Rock Ratio), log = 1.9666 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 0.00000E+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 0.00000E+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 0.37914E-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 -1.81 -4.69 -0.781 0.80031E+04 69 diamond -3.10 -4.19 -1.09 -0.311 0.18605E+04 89 graphite -3.55 -4.19 -0.65 -0.185 0.11028E+04 92 halite 1.57 -3.20 -4.78 -2.388 0.81552E+04 145 pyrite -21.25 -21.99 -0.75 -0.176 0.12763E+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 -19.08 -2.53 -0.281 0.43221E+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: 0.4000000 MOLES Current total amount of reactant added: 10.7999900 MOLES New total amount of reactant added: 11.1999900 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 = 11.1999900 Water: Moles liquid = 0.6005E+02 kg liquid = 0.1082E+01 Moles total = 0.5902E+02 kg total = 0.1063E+01 Activity = 0.9919 Stoichiometric ionic strength = .2699488E+00 Osmotic coef. = 0.9148 True ionic strength = .6076684E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6622E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.42305E-01 -1.3736 0.32551E-01 -1.4874 0.76944E+00 -0.1138 2 H2O 0.99192E+00 -0.0035 0.99192E+00 -0.0035 3 Cl- 0.60721E-01 -1.2167 0.46099E-01 -1.3363 0.75919E+00 -0.1197 4 SO4-- 0.25344E-09 -9.5961 0.92746E-10 -10.0327 0.36595E+00 -0.4366 5 HCO3- 0.72039E-05 -5.1424 0.54870E-05 -5.2607 0.76167E+00 -0.1182 6 HS- 0.54324E-06 -6.2650 0.41256E-06 -6.3845 0.75943E+00 -0.1195 7 Al+++ 0.43876E-05 -5.3578 0.45811E-06 -6.3390 0.10441E+00 -0.9813 8 H4SiO4 0.10081E-02 -2.9965 0.10081E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18571E-06 -6.7312 0.66822E-07 -7.1751 0.35981E+00 -0.4439 10 Mg++ 0.74945E-10 -10.1253 0.26691E-10 -10.5736 0.35614E+00 -0.4484 11 Fe++ 0.29119E-07 -7.5358 0.10396E-07 -7.9831 0.35701E+00 -0.4473 12 K+ 0.13046E-03 -3.8845 0.99413E-04 -4.0026 0.76200E+00 -0.1180 13 Na+ 0.18304E-01 -1.7374 0.13889E-01 -1.8573 0.75877E+00 -0.1199 14 Mn++ 0.18367E-08 -8.7360 0.65694E-09 -9.1825 0.35768E+00 -0.4465 15 F- 0.24441E-04 -4.6119 0.18474E-04 -4.7334 0.75585E+00 -0.1216 16 HPO4-- 0.12838E-13 -13.8915 0.46994E-14 -14.3280 0.36607E+00 -0.4364 17 SiF6-2 0.40525E-12 -12.3923 0.14760E-12 -12.8309 0.36423E+00 -0.4386 18 HSiO3- 0.38402E-10 -10.4156 0.29155E-10 -10.5353 0.75919E+00 -0.1197 19 Ca(HSiO3)+ 0.58196E-16 -16.2351 0.44367E-16 -16.3529 0.76237E+00 -0.1178 20 Mg(HSiO3)+ 0.28930E-19 -19.5387 0.22055E-19 -19.6565 0.76237E+00 -0.1178 21 NaHSiO3,aq 0.65491E-11 -11.1838 0.65491E-11 -11.1838 0.10000E+01 0.0000 22 AlO+ 0.76530E-10 -10.1162 0.58344E-10 -10.2340 0.76237E+00 -0.1178 23 AlOH+2 0.26382E-07 -7.5787 0.94566E-08 -8.0243 0.35846E+00 -0.4456 24 HAlO2,aq 0.35407E-12 -12.4509 0.35407E-12 -12.4509 0.10000E+01 0.0000 25 AlO2- 0.31840E-16 -16.4970 0.24078E-16 -16.6184 0.75623E+00 -0.1213 26 CH4,aq 0.24932E-07 -7.6032 0.23517E-07 -7.6286 0.94328E+00 -0.0254 27 C2H6,aq 0.13793E-16 -16.8603 0.13011E-16 -16.8857 0.94328E+00 -0.0254 31 CO,aq 0.70811E-10 -10.1499 0.70811E-10 -10.1499 0.10000E+01 0.0000 32 CO2,aq 0.40789E+00 -0.3895 0.38475E+00 -0.4148 0.94328E+00 -0.0254 33 CO3-2 0.40425E-13 -13.3934 0.14724E-13 -13.8320 0.36423E+00 -0.4386 34 CaCO3,aq 0.12337E-16 -16.9088 0.12337E-16 -16.9088 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.12276E-10 -10.9109 0.93592E-11 -11.0288 0.76237E+00 -0.1178 36 CaCl+ 0.65389E-08 -8.1845 0.49851E-08 -8.3023 0.76237E+00 -0.1178 37 CaCl2,aq 0.54597E-10 -10.2628 0.54597E-10 -10.2628 0.10000E+01 0.0000 38 CaF+ 0.23641E-10 -10.6263 0.18023E-10 -10.7442 0.76237E+00 -0.1178 39 CaOH+ 0.19036E-15 -15.7204 0.14512E-15 -15.8383 0.76237E+00 -0.1178 40 CaSO4,aq 0.19680E-14 -14.7060 0.19680E-14 -14.7060 0.10000E+01 0.0000 41 HCl,aq 0.27497E-03 -3.5607 0.27497E-03 -3.5607 0.10000E+01 0.0000 45 HF,aq 0.41165E-02 -2.3855 0.41165E-02 -2.3855 0.10000E+01 0.0000 46 HF2- 0.33820E-07 -7.4708 0.25675E-07 -7.5905 0.75919E+00 -0.1197 47 Fe+3 0.30660E-17 -17.5134 0.32235E-18 -18.4917 0.10514E+00 -0.9782 48 FeCl+ 0.99498E-09 -9.0022 0.75855E-09 -9.1200 0.76237E+00 -0.1178 49 FeCl2,aq 0.11071E-14 -14.9558 0.11071E-14 -14.9558 0.10000E+01 0.0000 50 FeCl+2 0.29620E-17 -17.5284 0.10617E-17 -17.9740 0.35846E+00 -0.4456 51 FeF+ 0.12873E-10 -10.8903 0.98140E-11 -11.0082 0.76237E+00 -0.1178 52 FeF+2 0.14806E-15 -15.8296 0.53073E-16 -16.2751 0.35846E+00 -0.4456 54 FeOH+ 0.13526E-13 -13.8688 0.10312E-13 -13.9867 0.76237E+00 -0.1178 56 FeO+ 0.37845E-18 -18.4220 0.28852E-18 -18.5398 0.76237E+00 -0.1178 57 FeOH+2 0.50035E-17 -17.3007 0.17935E-17 -17.7463 0.35846E+00 -0.4456 60 H2,aq 0.77042E-08 -8.1133 0.72672E-08 -8.1386 0.94328E+00 -0.0254 61 KCl,aq 0.83060E-07 -7.0806 0.83060E-07 -7.0806 0.10000E+01 0.0000 62 KHSO4,aq 0.84857E-15 -15.0713 0.84857E-15 -15.0713 0.10000E+01 0.0000 63 KOH,aq 0.12937E-14 -14.8882 0.12937E-14 -14.8882 0.10000E+01 0.0000 64 KSO4- 0.18846E-12 -12.7248 0.14307E-12 -12.8444 0.75919E+00 -0.1197 66 Mg(HCO3)+ 0.50107E-14 -14.3001 0.38200E-14 -14.4179 0.76237E+00 -0.1178 67 MgCl+ 0.23673E-11 -11.6258 0.18047E-11 -11.7436 0.76237E+00 -0.1178 68 MgF+ 0.34980E-13 -13.4562 0.26668E-13 -13.5740 0.76237E+00 -0.1178 69 MgOH+ 0.42075E-18 -18.3760 0.32077E-18 -18.4938 0.76237E+00 -0.1178 71 MnF+ 0.26813E-12 -12.5717 0.20441E-12 -12.6895 0.76237E+00 -0.1178 73 MnOH+ 0.79404E-16 -16.1002 0.60535E-16 -16.2180 0.76237E+00 -0.1178 78 MnCl+ 0.24462E-09 -9.6115 0.18649E-09 -9.7293 0.76237E+00 -0.1178 79 MnSO4,aq 0.17590E-16 -16.7547 0.17590E-16 -16.7547 0.10000E+01 0.0000 80 NaCl,aq 0.21218E-03 -3.6733 0.21218E-03 -3.6733 0.10000E+01 0.0000 81 NaF,aq 0.60069E-07 -7.2213 0.60069E-07 -7.2213 0.10000E+01 0.0000 82 NaOH,aq 0.18184E-12 -12.7403 0.18184E-12 -12.7403 0.10000E+01 0.0000 84 OH- 0.23282E-10 -10.6330 0.17607E-10 -10.7543 0.75623E+00 -0.1213 90 H3PO3,aq 0.25227E-19 -19.5981 0.25227E-19 -19.5981 0.10000E+01 0.0000 92 H3PO4,aq 0.34825E-07 -7.4581 0.34825E-07 -7.4581 0.10000E+01 0.0000 93 H2PO4- 0.37092E-08 -8.4307 0.28219E-08 -8.5495 0.76079E+00 -0.1187 95 H4P2O7,aq 0.16120E-16 -16.7926 0.16120E-16 -16.7926 0.10000E+01 0.0000 96 H3P2O7- 0.83281E-17 -17.0795 0.63226E-17 -17.1991 0.75919E+00 -0.1197 97 H2P2O7-2 0.17283E-17 -17.7624 0.62947E-18 -18.2010 0.36423E+00 -0.4386 100 H2S,aq 0.44000E-01 -1.3565 0.41504E-01 -1.3819 0.94328E+00 -0.0254 101 S2-2 0.14248E-14 -14.8462 0.51895E-15 -15.2849 0.36423E+00 -0.4386 102 S3-2 0.10963E-13 -13.9601 0.39931E-14 -14.3987 0.36423E+00 -0.4386 103 S3- 0.13462E-08 -8.8709 0.10220E-08 -8.9905 0.75919E+00 -0.1197 104 S4-2 0.55723E-13 -13.2540 0.20296E-13 -13.6926 0.36423E+00 -0.4386 105 S5-2 0.18885E-12 -12.7239 0.68786E-13 -13.1625 0.36423E+00 -0.4386 106 SO2,aq 0.32415E-11 -11.4893 0.32415E-11 -11.4893 0.10000E+01 0.0000 107 SO3-2 0.23481E-18 -18.6293 0.88300E-19 -19.0540 0.37605E+00 -0.4247 108 HSO3- 0.23705E-12 -12.6252 0.17996E-12 -12.7448 0.75919E+00 -0.1197 109 HSO4- 0.38076E-08 -8.4194 0.29094E-08 -8.5362 0.76412E+00 -0.1168 111 S2O3-2 0.12516E-12 -12.9025 0.45586E-13 -13.3412 0.36423E+00 -0.4386 112 HS2O3- 0.34948E-12 -12.4566 0.26532E-12 -12.5762 0.75919E+00 -0.1197 113 H2S2O3,aq 0.13845E-12 -12.8587 0.13845E-12 -12.8587 0.10000E+01 0.0000 Charge balance for all species = -.5091E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4230484E-01 0.4985815E+00 0.4915913E+03 0.0000 2 H2O 0.1000000E+01 0.5510037E+02 0.9710227E+06 0.0000 3 Cl- 0.6072121E-01 0.6120845E-01 0.2122745E+04 0.1511 4 SO4-- 0.2534379E-09 -.2196932E-07 -.2064428E-02 -7.0578 5 HCO3- 0.7203935E-05 0.4078924E+00 0.2434621E+05 -3.7732 6 HS- 0.5432413E-06 0.4400043E-01 0.1423478E+04 -4.8971 7 Al+++ 0.4387639E-05 0.4414097E-05 0.1165042E+00 -1.8767 8 H4SiO4 0.1008144E-02 0.1008144E-02 0.9478706E+02 -2.9965 9 Ca++ 0.1857126E-06 0.1923420E-06 0.7540734E-02 -4.2002 10 Mg++ 0.7494539E-10 0.7735265E-10 0.1839625E-05 -7.5988 11 Fe++ 0.2911880E-07 0.3012667E-07 0.1645828E-02 -5.0083 12 K+ 0.1304624E-03 0.1305454E-03 0.4993373E+01 -2.5151 13 Na+ 0.1830448E-01 0.1851672E-01 0.4164211E+03 -0.3699 14 Mn++ 0.1836697E-08 0.2081580E-08 0.1118663E-03 -6.2076 15 F- 0.2444094E-04 0.4141105E-02 0.7695866E+02 -3.2460 16 HPO4-- 0.1283756E-13 0.3853448E-07 0.3617922E-02 -11.3531 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1185932E+01 0.5393859E+00 0.2673263E+00 0.3792201E+00 2 H2O 0.5901584E+02 0.5960984E+02 -.2359858E+00 -.3580143E+00 3 Cl- 0.6621783E-01 0.6621782E-01 0.0000000E+00 0.3781620E-08 4 SO4-- 0.5346497E-01 -.2376731E-07 0.5346527E-01 -.2783659E-06 5 HCO3- 0.8097723E+00 0.4412748E+00 0.0000000E+00 0.3684976E+00 6 HS- 0.2187203E+00 0.4760147E-01 0.1603958E+00 0.1072301E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1090652E-02 0.1106237E-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- 0.4480096E-02 0.4480017E-02 0.0000000E+00 0.7877876E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1225E-15 Mass of aqueous solution: 0.110594E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 11.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1048E-01 -1.980 0.1888 -0.724 1.126 4.164 CO2,gas 0.3685 -0.434 16.22 1.210 96.70 198.5 CH4,gas 0.2601E-06 -6.585 0.4171E-05 -5.380 0.2487E-04 0.1679E-03 H2,gas 0.7241E-07 -7.140 0.1463E-06 -6.835 0.8721E-06 0.4613E-04 H2S,gas 0.1072E-01 -1.970 0.3654 -0.437 2.179 5.459 S2,gas 0.4183E-11 -11.378 0.2682E-09 -9.571 0.1599E-08 0.2596E-08 CO,gas 0.8224E-09 -9.085 0.2304E-07 -7.638 0.1374E-06 0.5103E-06 SO3,gas 0.2920E-30 -30.535 0.2338E-28 -28.631 0.1394E-27 0.1812E-27 SO2,gas 0.1093E-12 -12.962 0.6999E-11 -11.155 0.4173E-10 0.6779E-10 HF,gas 0.7878E-07 -7.104 0.1576E-05 -5.803 0.9394E-05 0.4888E-04 HCl,gas 0.3782E-08 -8.422 0.1379E-06 -6.861 0.8221E-06 0.2346E-05 quartz 0.1106E-01 -1.956 0.6646 -0.177 8.837 0.2510 sulfur 0.2139 -0.670 6.856 0.836 91.16 3.317 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 0.9456E+00 0.4728E+02 0.8707 1.615 CH4,gas 0.6673E-06 0.3337E-04 1.0375 -4.461 H2,gas 0.1858E-06 0.9290E-05 1.0270 -5.020 H2S,gas 0.2752E-01 0.1376E+01 0.8293 0.057 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2110E-08 0.1055E-06 1.0000 -6.977 SO3,gas 0.7492E-30 0.3746E-28 1.0000 -28.426 SO2,gas 0.2804E-12 0.1402E-10 1.0000 -10.853 HF,gas 0.2022E-06 0.1011E-04 1.0000 -4.995 HCl,gas 0.9704E-08 0.4852E-06 1.0000 -6.314 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: 1.483929 % Solid products produced: Mass = 7.521013 g Volume = 3.568063 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: 11.1999900 moles log = 1.0492 Original solution: 1000.0103000 g Original solution / Rock added: 89.29 (Water/Rock Ratio), log = 1.9508 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 -0.30331E-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 0.22748E-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 -0.11374E-11 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 -1.88 -4.76 -0.793 0.81232E+04 69 diamond -3.10 -4.18 -1.07 -0.307 0.18345E+04 89 graphite -3.55 -4.18 -0.63 -0.180 0.10767E+04 92 halite 1.57 -3.19 -4.77 -2.384 0.81416E+04 145 pyrite -21.25 -22.03 -0.79 -0.185 0.13414E+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 -19.19 -2.65 -0.294 0.45170E+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: 0.4000000 MOLES Current total amount of reactant added: 11.1999900 MOLES New total amount of reactant added: 11.5999900 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 = 11.5999900 Water: Moles liquid = 0.6041E+02 kg liquid = 0.1088E+01 Moles total = 0.5934E+02 kg total = 0.1069E+01 Activity = 0.9919 Stoichiometric ionic strength = .2711746E+00 Osmotic coef. = 0.9148 True ionic strength = .6254359E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.6858E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.44198E-01 -1.3546 0.33927E-01 -1.4695 0.76763E+00 -0.1148 2 H2O 0.99191E+00 -0.0035 0.99191E+00 -0.0035 3 Cl- 0.62499E-01 -1.2041 0.47325E-01 -1.3249 0.75721E+00 -0.1208 4 SO4-- 0.22406E-09 -9.6496 0.81159E-10 -10.0907 0.36222E+00 -0.4410 5 HCO3- 0.69258E-05 -5.1595 0.52618E-05 -5.2789 0.75974E+00 -0.1193 6 HS- 0.53144E-06 -6.2745 0.40255E-06 -6.3952 0.75746E+00 -0.1206 7 Al+++ 0.43626E-05 -5.3603 0.44485E-06 -6.3518 0.10197E+00 -0.9915 8 H4SiO4 0.10081E-02 -2.9965 0.10081E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18448E-06 -6.7341 0.65678E-07 -7.1826 0.35602E+00 -0.4485 10 Mg++ 0.74454E-10 -10.1281 0.26232E-10 -10.5812 0.35232E+00 -0.4531 11 Fe++ 0.28927E-07 -7.5387 0.10217E-07 -7.9907 0.35320E+00 -0.4520 12 K+ 0.12968E-03 -3.8871 0.98563E-04 -4.0063 0.76007E+00 -0.1191 13 Na+ 0.18189E-01 -1.7402 0.13765E-01 -1.8612 0.75678E+00 -0.1210 14 Mn++ 0.18218E-08 -8.7395 0.64465E-09 -9.1907 0.35386E+00 -0.4512 15 F- 0.24211E-04 -4.6160 0.18251E-04 -4.7387 0.75382E+00 -0.1227 16 HPO4-- 0.11911E-13 -13.9241 0.43157E-14 -14.3650 0.36233E+00 -0.4409 17 SiF6-2 0.44933E-12 -12.3474 0.16197E-12 -12.7906 0.36047E+00 -0.4431 18 HSiO3- 0.36940E-10 -10.4325 0.27972E-10 -10.5533 0.75721E+00 -0.1208 19 Ca(HSiO3)+ 0.55018E-16 -16.2595 0.41838E-16 -16.3784 0.76045E+00 -0.1189 20 Mg(HSiO3)+ 0.27347E-19 -19.5631 0.20796E-19 -19.6820 0.76045E+00 -0.1189 21 NaHSiO3,aq 0.62275E-11 -11.2057 0.62275E-11 -11.2057 0.10000E+01 0.0000 22 AlO+ 0.68579E-10 -10.1638 0.52151E-10 -10.2827 0.76045E+00 -0.1189 23 AlOH+2 0.24842E-07 -7.6048 0.88103E-08 -8.0550 0.35465E+00 -0.4502 24 HAlO2,aq 0.30364E-12 -12.5176 0.30364E-12 -12.5176 0.10000E+01 0.0000 25 AlO2- 0.26267E-16 -16.5806 0.19811E-16 -16.7031 0.75422E+00 -0.1225 26 CH4,aq 0.26663E-07 -7.5741 0.25146E-07 -7.5995 0.94312E+00 -0.0254 27 C2H6,aq 0.15509E-16 -16.8094 0.14627E-16 -16.8349 0.94312E+00 -0.0254 31 CO,aq 0.71980E-10 -10.1428 0.71980E-10 -10.1428 0.10000E+01 0.0000 32 CO2,aq 0.40775E+00 -0.3896 0.38456E+00 -0.4150 0.94312E+00 -0.0254 33 CO3-2 0.37580E-13 -13.4250 0.13546E-13 -13.8682 0.36047E+00 -0.4431 34 CaCO3,aq 0.11156E-16 -16.9525 0.11156E-16 -16.9525 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.11600E-10 -10.9355 0.88214E-11 -11.0545 0.76045E+00 -0.1189 36 CaCl+ 0.66146E-08 -8.1795 0.50301E-08 -8.2984 0.76045E+00 -0.1189 37 CaCl2,aq 0.56555E-10 -10.2475 0.56555E-10 -10.2475 0.10000E+01 0.0000 38 CaF+ 0.23014E-10 -10.6380 0.17501E-10 -10.7569 0.76045E+00 -0.1189 39 CaOH+ 0.17996E-15 -15.7448 0.13685E-15 -15.8637 0.76045E+00 -0.1189 40 CaSO4,aq 0.16927E-14 -14.7714 0.16927E-14 -14.7714 0.10000E+01 0.0000 41 HCl,aq 0.29422E-03 -3.5313 0.29422E-03 -3.5313 0.10000E+01 0.0000 45 HF,aq 0.42389E-02 -2.3728 0.42389E-02 -2.3728 0.10000E+01 0.0000 46 HF2- 0.34494E-07 -7.4623 0.26120E-07 -7.5830 0.75721E+00 -0.1208 47 Fe+3 0.31884E-17 -17.4964 0.32742E-18 -18.4849 0.10269E+00 -0.9885 48 FeCl+ 0.10064E-08 -8.9972 0.76531E-09 -9.1162 0.76045E+00 -0.1189 49 FeCl2,aq 0.11467E-14 -14.9406 0.11467E-14 -14.9406 0.10000E+01 0.0000 50 FeCl+2 0.31217E-17 -17.5056 0.11071E-17 -17.9558 0.35465E+00 -0.4502 51 FeF+ 0.12530E-10 -10.9020 0.95286E-11 -11.0210 0.76045E+00 -0.1189 52 FeF+2 0.15017E-15 -15.8234 0.53258E-16 -16.2736 0.35465E+00 -0.4502 54 FeOH+ 0.12786E-13 -13.8933 0.97231E-14 -14.0122 0.76045E+00 -0.1189 56 FeO+ 0.35474E-18 -18.4501 0.26976E-18 -18.5690 0.76045E+00 -0.1189 57 FeOH+2 0.49283E-17 -17.3073 0.17478E-17 -17.7575 0.35465E+00 -0.4502 60 H2,aq 0.78366E-08 -8.1059 0.73908E-08 -8.1313 0.94312E+00 -0.0254 61 KCl,aq 0.84540E-07 -7.0729 0.84540E-07 -7.0729 0.10000E+01 0.0000 62 KHSO4,aq 0.76734E-15 -15.1150 0.76734E-15 -15.1150 0.10000E+01 0.0000 63 KOH,aq 0.12306E-14 -14.9099 0.12306E-14 -14.9099 0.10000E+01 0.0000 64 KSO4- 0.16393E-12 -12.7853 0.12413E-12 -12.9061 0.75721E+00 -0.1208 66 Mg(HCO3)+ 0.47342E-14 -14.3248 0.36001E-14 -14.4437 0.76045E+00 -0.1189 67 MgCl+ 0.23944E-11 -11.6208 0.18208E-11 -11.7397 0.76045E+00 -0.1189 68 MgF+ 0.34049E-13 -13.4679 0.25892E-13 -13.5868 0.76045E+00 -0.1189 69 MgOH+ 0.39773E-18 -18.4004 0.30245E-18 -18.5193 0.76045E+00 -0.1189 71 MnF+ 0.26060E-12 -12.5840 0.19817E-12 -12.7030 0.76045E+00 -0.1189 73 MnOH+ 0.74946E-16 -16.1253 0.56992E-16 -16.2442 0.76045E+00 -0.1189 78 MnCl+ 0.24705E-09 -9.6072 0.18787E-09 -9.7262 0.76045E+00 -0.1189 79 MnSO4,aq 0.15104E-16 -16.8209 0.15104E-16 -16.8209 0.10000E+01 0.0000 80 NaCl,aq 0.21589E-03 -3.6658 0.21589E-03 -3.6658 0.10000E+01 0.0000 81 NaF,aq 0.58818E-07 -7.2305 0.58818E-07 -7.2305 0.10000E+01 0.0000 82 NaOH,aq 0.17291E-12 -12.7622 0.17291E-12 -12.7622 0.10000E+01 0.0000 84 OH- 0.22397E-10 -10.6498 0.16892E-10 -10.7723 0.75422E+00 -0.1225 90 H3PO3,aq 0.25596E-19 -19.5918 0.25596E-19 -19.5918 0.10000E+01 0.0000 92 H3PO4,aq 0.34743E-07 -7.4591 0.34743E-07 -7.4591 0.10000E+01 0.0000 93 H2PO4- 0.35594E-08 -8.4486 0.27010E-08 -8.5685 0.75884E+00 -0.1198 95 H4P2O7,aq 0.16044E-16 -16.7947 0.16044E-16 -16.7947 0.10000E+01 0.0000 96 H3P2O7- 0.79735E-17 -17.0984 0.60376E-17 -17.2191 0.75721E+00 -0.1208 97 H2P2O7-2 0.15999E-17 -17.7959 0.57672E-18 -18.2390 0.36047E+00 -0.4431 100 H2S,aq 0.44756E-01 -1.3492 0.42210E-01 -1.3746 0.94312E+00 -0.0254 101 S2-2 0.13477E-14 -14.8704 0.48582E-15 -15.3135 0.36047E+00 -0.4431 102 S3-2 0.10370E-13 -13.9842 0.37381E-14 -14.4273 0.36047E+00 -0.4431 103 S3- 0.13059E-08 -8.8841 0.98887E-09 -9.0049 0.75721E+00 -0.1208 104 S4-2 0.52708E-13 -13.2781 0.19000E-13 -13.7212 0.36047E+00 -0.4431 105 S5-2 0.17864E-12 -12.7480 0.64394E-13 -13.1912 0.36047E+00 -0.4431 106 SO2,aq 0.31340E-11 -11.5039 0.31340E-11 -11.5039 0.10000E+01 0.0000 107 SO3-2 0.21101E-18 -18.6757 0.78583E-19 -19.1047 0.37241E+00 -0.4290 108 HSO3- 0.22046E-12 -12.6567 0.16693E-12 -12.7775 0.75721E+00 -0.1208 109 HSO4- 0.34814E-08 -8.4582 0.26536E-08 -8.5762 0.76223E+00 -0.1179 111 S2O3-2 0.11254E-12 -12.9487 0.40569E-13 -13.3918 0.36047E+00 -0.4431 112 HS2O3- 0.32501E-12 -12.4881 0.24611E-12 -12.6089 0.75721E+00 -0.1208 113 H2S2O3,aq 0.13386E-12 -12.8734 0.13386E-12 -12.8734 0.10000E+01 0.0000 Charge balance for all species = -.5060E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4419758E-01 0.5012409E+00 0.4941721E+03 0.0000 2 H2O 0.1000000E+01 0.5510050E+02 0.9709437E+06 0.0000 3 Cl- 0.6249855E-01 0.6300876E-01 0.2184997E+04 0.1445 4 SO4-- 0.2240629E-09 -.2411504E-07 -.2265869E-02 -7.1518 5 HCO3- 0.6925763E-05 0.4077614E+00 0.2433635E+05 -3.8094 6 HS- 0.5314426E-06 0.4475633E-01 0.1447811E+04 -4.9257 7 Al+++ 0.4362644E-05 0.4387555E-05 0.1157939E+00 -1.9434 8 H4SiO4 0.1008122E-02 0.1008122E-02 0.9477700E+02 -2.9965 9 Ca++ 0.1844797E-06 0.1911855E-06 0.7494764E-02 -4.2437 10 Mg++ 0.7445432E-10 0.7688753E-10 0.1828410E-05 -7.6423 11 Fe++ 0.2892658E-07 0.2994552E-07 0.1635794E-02 -5.0518 12 K+ 0.1296759E-03 0.1297604E-03 0.4962932E+01 -2.5368 13 Na+ 0.1818943E-01 0.1840538E-01 0.4138825E+03 -0.3918 14 Mn++ 0.1821756E-08 0.2069064E-08 0.1111844E-03 -6.2518 15 F- 0.2421093E-04 0.4263203E-02 0.7922112E+02 -3.2693 16 HPO4-- 0.1191081E-13 0.3830278E-07 0.3595866E-02 -11.4260 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1229002E+01 0.5455434E+00 0.2768766E+00 0.4065824E+00 2 H2O 0.5934332E+02 0.5997058E+02 -.2436128E+00 -.3836511E+00 3 Cl- 0.6857783E-01 0.6857782E-01 0.0000000E+00 0.4338310E-08 4 SO4-- 0.5537497E-01 -.2624646E-07 0.5537531E-01 -.3180956E-06 5 HCO3- 0.8386923E+00 0.4438016E+00 0.0000000E+00 0.3948908E+00 6 HS- 0.2265303E+00 0.4871215E-01 0.1661259E+00 0.1169221E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1097225E-02 0.1105579E-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- 0.4640096E-02 0.4640009E-02 0.0000000E+00 0.8697289E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.3221E-16 Mass of aqueous solution: 0.111272E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 11.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1124E-01 -1.949 0.2024 -0.694 1.126 4.464 CO2,gas 0.3949 -0.404 17.38 1.240 96.66 212.7 CH4,gas 0.2981E-06 -6.526 0.4782E-05 -5.320 0.2660E-04 0.1925E-03 H2,gas 0.7895E-07 -7.103 0.1595E-06 -6.797 0.8870E-06 0.5029E-04 H2S,gas 0.1169E-01 -1.932 0.3985 -0.400 2.216 5.952 S2,gas 0.4485E-11 -11.348 0.2876E-09 -9.541 0.1600E-08 0.2783E-08 CO,gas 0.8963E-09 -9.048 0.2511E-07 -7.600 0.1396E-06 0.5562E-06 SO3,gas 0.2976E-30 -30.526 0.2382E-28 -28.623 0.1325E-27 0.1846E-27 SO2,gas 0.1133E-12 -12.946 0.7255E-11 -11.139 0.4035E-10 0.7027E-10 HF,gas 0.8697E-07 -7.061 0.1739E-05 -5.760 0.9674E-05 0.5397E-04 HCl,gas 0.4338E-08 -8.363 0.1582E-06 -6.801 0.8797E-06 0.2692E-05 quartz 0.1106E-01 -1.956 0.6642 -0.178 8.554 0.2508 sulfur 0.2215 -0.655 7.101 0.851 91.45 3.436 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 0.9451E+00 0.4726E+02 0.8707 1.614 CH4,gas 0.7135E-06 0.3568E-04 1.0375 -4.432 H2,gas 0.1890E-06 0.9448E-05 1.0270 -5.013 H2S,gas 0.2798E-01 0.1399E+01 0.8293 0.065 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2145E-08 0.1073E-06 1.0000 -6.970 SO3,gas 0.7122E-30 0.3561E-28 1.0000 -28.448 SO2,gas 0.2711E-12 0.1355E-10 1.0000 -10.868 HF,gas 0.2082E-06 0.1041E-04 1.0000 -4.983 HCl,gas 0.1038E-07 0.5192E-06 1.0000 -6.285 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: 1.579320 % Solid products produced: Mass = 7.765562 g Volume = 3.686416 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: 11.5999900 moles log = 1.0645 Original solution: 1000.0103000 g Original solution / Rock added: 86.21 (Water/Rock Ratio), log = 1.9355 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 0.00000E+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 0.22748E-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 0.37914E-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 -1.95 -4.82 -0.804 0.82372E+04 69 diamond -3.10 -4.16 -1.06 -0.303 0.18098E+04 89 graphite -3.55 -4.16 -0.62 -0.176 0.10521E+04 92 halite 1.57 -3.19 -4.76 -2.380 0.81287E+04 145 pyrite -21.25 -22.07 -0.82 -0.193 0.14032E+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 -19.30 -2.75 -0.306 0.47014E+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: 0.4000000 MOLES Current total amount of reactant added: 11.5999900 MOLES New total amount of reactant added: 11.9999900 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 = 11.9999900 Water: Moles liquid = 0.6078E+02 kg liquid = 0.1095E+01 Moles total = 0.5967E+02 kg total = 0.1075E+01 Activity = 0.9919 Stoichiometric ionic strength = .2723790E+00 Osmotic coef. = 0.9148 True ionic strength = .6429870E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7094E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.46067E-01 -1.3366 0.35282E-01 -1.4524 0.76589E+00 -0.1158 2 H2O 0.99190E+00 -0.0035 0.99190E+00 -0.0035 3 Cl- 0.64254E-01 -1.1921 0.48532E-01 -1.3140 0.75531E+00 -0.1219 4 SO4-- 0.19944E-09 -9.7002 0.71527E-10 -10.1455 0.35864E+00 -0.4453 5 HCO3- 0.66729E-05 -5.1757 0.50572E-05 -5.2961 0.75788E+00 -0.1204 6 HS- 0.52057E-06 -6.2835 0.39333E-06 -6.4052 0.75557E+00 -0.1217 7 Al+++ 0.43378E-05 -5.3627 0.43231E-06 -6.3642 0.99662E-01 -1.0015 8 H4SiO4 0.10081E-02 -2.9965 0.10081E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18326E-06 -6.7369 0.64581E-07 -7.1899 0.35239E+00 -0.4530 10 Mg++ 0.73970E-10 -10.1309 0.25791E-10 -10.5885 0.34866E+00 -0.4576 11 Fe++ 0.28737E-07 -7.5416 0.10045E-07 -7.9981 0.34955E+00 -0.4565 12 K+ 0.12890E-03 -3.8898 0.97733E-04 -4.0100 0.75821E+00 -0.1202 13 Na+ 0.18076E-01 -1.7429 0.13645E-01 -1.8650 0.75487E+00 -0.1221 14 Mn++ 0.18071E-08 -8.7430 0.63288E-09 -9.1987 0.35022E+00 -0.4557 15 F- 0.24007E-04 -4.6197 0.18050E-04 -4.7435 0.75188E+00 -0.1239 16 HPO4-- 0.11094E-13 -13.9549 0.39800E-14 -14.4001 0.35876E+00 -0.4452 17 SiF6-2 0.49677E-12 -12.3038 0.17729E-12 -12.7513 0.35688E+00 -0.4475 18 HSiO3- 0.35610E-10 -10.4484 0.26897E-10 -10.5703 0.75531E+00 -0.1219 19 Ca(HSiO3)+ 0.52147E-16 -16.2828 0.39559E-16 -16.4028 0.75859E+00 -0.1200 20 Mg(HSiO3)+ 0.25917E-19 -19.5864 0.19661E-19 -19.7064 0.75859E+00 -0.1200 21 NaHSiO3,aq 0.59359E-11 -11.2265 0.59359E-11 -11.2265 0.10000E+01 0.0000 22 AlO+ 0.61776E-10 -10.2092 0.46863E-10 -10.3292 0.75859E+00 -0.1200 23 AlOH+2 0.23456E-07 -7.6298 0.82331E-08 -8.0844 0.35101E+00 -0.4547 24 HAlO2,aq 0.26237E-12 -12.5811 0.26237E-12 -12.5811 0.10000E+01 0.0000 25 AlO2- 0.21882E-16 -16.6599 0.16461E-16 -16.7835 0.75228E+00 -0.1236 26 CH4,aq 0.28416E-07 -7.5464 0.26795E-07 -7.5719 0.94295E+00 -0.0255 27 C2H6,aq 0.17333E-16 -16.7611 0.16344E-16 -16.7866 0.94295E+00 -0.0255 31 CO,aq 0.73106E-10 -10.1360 0.73106E-10 -10.1360 0.10000E+01 0.0000 32 CO2,aq 0.40763E+00 -0.3897 0.38438E+00 -0.4152 0.94295E+00 -0.0255 33 CO3-2 0.35081E-13 -13.4549 0.12520E-13 -13.9024 0.35688E+00 -0.4475 34 CaCO3,aq 0.10138E-16 -16.9940 0.10138E-16 -16.9940 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.10990E-10 -10.9590 0.83368E-11 -11.0790 0.75859E+00 -0.1200 36 CaCl+ 0.66863E-08 -8.1748 0.50722E-08 -8.2948 0.75859E+00 -0.1200 37 CaCl2,aq 0.58483E-10 -10.2330 0.58483E-10 -10.2330 0.10000E+01 0.0000 38 CaF+ 0.22435E-10 -10.6491 0.17019E-10 -10.7691 0.75859E+00 -0.1200 39 CaOH+ 0.17057E-15 -15.7681 0.12940E-15 -15.8881 0.75859E+00 -0.1200 40 CaSO4,aq 0.14668E-14 -14.8336 0.14668E-14 -14.8336 0.10000E+01 0.0000 41 HCl,aq 0.31378E-03 -3.5034 0.31378E-03 -3.5034 0.10000E+01 0.0000 45 HF,aq 0.43597E-02 -2.3605 0.43597E-02 -2.3605 0.10000E+01 0.0000 46 HF2- 0.35176E-07 -7.4538 0.26569E-07 -7.5756 0.75531E+00 -0.1219 47 Fe+3 0.33083E-17 -17.4804 0.33210E-18 -18.4787 0.10038E+00 -0.9983 48 FeCl+ 0.10172E-08 -8.9926 0.77163E-09 -9.1126 0.75859E+00 -0.1200 49 FeCl2,aq 0.11856E-14 -14.9260 0.11856E-14 -14.9260 0.10000E+01 0.0000 50 FeCl+2 0.32808E-17 -17.4840 0.11516E-17 -17.9387 0.35101E+00 -0.4547 51 FeF+ 0.12214E-10 -10.9131 0.92654E-11 -11.0331 0.75859E+00 -0.1200 52 FeF+2 0.15221E-15 -15.8176 0.53427E-16 -16.2722 0.35101E+00 -0.4547 54 FeOH+ 0.12118E-13 -13.9166 0.91923E-14 -14.0366 0.75859E+00 -0.1200 56 FeO+ 0.33352E-18 -18.4769 0.25301E-18 -18.5969 0.75859E+00 -0.1200 57 FeOH+2 0.48566E-17 -17.3137 0.17047E-17 -17.7683 0.35101E+00 -0.4547 60 H2,aq 0.79642E-08 -8.0989 0.75099E-08 -8.1244 0.94295E+00 -0.0255 61 KCl,aq 0.85966E-07 -7.0657 0.85966E-07 -7.0657 0.10000E+01 0.0000 62 KHSO4,aq 0.69735E-15 -15.1566 0.69735E-15 -15.1566 0.10000E+01 0.0000 63 KOH,aq 0.11734E-14 -14.9306 0.11734E-14 -14.9306 0.10000E+01 0.0000 64 KSO4- 0.14362E-12 -12.8428 0.10848E-12 -12.9647 0.75531E+00 -0.1219 66 Mg(HCO3)+ 0.44846E-14 -14.3483 0.34020E-14 -14.4683 0.75859E+00 -0.1200 67 MgCl+ 0.24201E-11 -11.6162 0.18359E-11 -11.7362 0.75859E+00 -0.1200 68 MgF+ 0.33189E-13 -13.4790 0.25177E-13 -13.5990 0.75859E+00 -0.1200 69 MgOH+ 0.37694E-18 -18.4237 0.28594E-18 -18.5437 0.75859E+00 -0.1200 71 MnF+ 0.25365E-12 -12.5958 0.19242E-12 -12.7158 0.75859E+00 -0.1200 73 MnOH+ 0.70924E-16 -16.1492 0.53802E-16 -16.2692 0.75859E+00 -0.1200 78 MnCl+ 0.24933E-09 -9.6032 0.18914E-09 -9.7232 0.75859E+00 -0.1200 79 MnSO4,aq 0.13069E-16 -16.8838 0.13069E-16 -16.8838 0.10000E+01 0.0000 80 NaCl,aq 0.21946E-03 -3.6586 0.21946E-03 -3.6586 0.10000E+01 0.0000 81 NaF,aq 0.57662E-07 -7.2391 0.57662E-07 -7.2391 0.10000E+01 0.0000 82 NaOH,aq 0.16482E-12 -12.7830 0.16482E-12 -12.7830 0.10000E+01 0.0000 84 OH- 0.21592E-10 -10.6657 0.16243E-10 -10.7893 0.75228E+00 -0.1236 90 H3PO3,aq 0.25940E-19 -19.5860 0.25940E-19 -19.5860 0.10000E+01 0.0000 92 H3PO4,aq 0.34652E-07 -7.4603 0.34652E-07 -7.4603 0.10000E+01 0.0000 93 H2PO4- 0.34221E-08 -8.4657 0.25905E-08 -8.5866 0.75697E+00 -0.1209 95 H4P2O7,aq 0.15960E-16 -16.7970 0.15960E-16 -16.7970 0.10000E+01 0.0000 96 H3P2O7- 0.76461E-17 -17.1166 0.57752E-17 -17.2384 0.75531E+00 -0.1219 97 H2P2O7-2 0.14864E-17 -17.8279 0.53047E-18 -18.2753 0.35688E+00 -0.4475 100 H2S,aq 0.45485E-01 -1.3421 0.42890E-01 -1.3676 0.94295E+00 -0.0255 101 S2-2 0.12790E-14 -14.8931 0.45647E-15 -15.3406 0.35688E+00 -0.4475 102 S3-2 0.98414E-14 -14.0069 0.35123E-14 -14.4544 0.35688E+00 -0.4475 103 S3- 0.12691E-08 -8.8965 0.95853E-09 -9.0184 0.75531E+00 -0.1219 104 S4-2 0.50021E-13 -13.3008 0.17852E-13 -13.7483 0.35688E+00 -0.4475 105 S5-2 0.16953E-12 -12.7707 0.60503E-13 -13.2182 0.35688E+00 -0.4475 106 SO2,aq 0.30353E-11 -11.5178 0.30353E-11 -11.5178 0.10000E+01 0.0000 107 SO3-2 0.19076E-18 -18.7195 0.70374E-19 -19.1526 0.36891E+00 -0.4331 108 HSO3- 0.20583E-12 -12.6865 0.15546E-12 -12.8084 0.75531E+00 -0.1219 109 HSO4- 0.31984E-08 -8.4951 0.24321E-08 -8.6140 0.76040E+00 -0.1190 111 S2O3-2 0.10180E-12 -12.9922 0.36331E-13 -13.4397 0.35688E+00 -0.4475 112 HS2O3- 0.30345E-12 -12.5179 0.22920E-12 -12.6398 0.75531E+00 -0.1219 113 H2S2O3,aq 0.12964E-12 -12.8873 0.12964E-12 -12.8873 0.10000E+01 0.0000 Charge balance for all species = -.5030E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4606720E-01 0.5038551E+00 0.4967085E+03 0.0000 2 H2O 0.1000000E+01 0.5510062E+02 0.9708660E+06 0.0000 3 Cl- 0.6425421E-01 0.6478754E-01 0.2246497E+04 0.1385 4 SO4-- 0.1994381E-09 -.2623134E-07 -.2464516E-02 -7.2406 5 HCO3- 0.6672890E-05 0.4076360E+00 0.2432686E+05 -3.8436 6 HS- 0.5205750E-06 0.4548558E-01 0.1471281E+04 -4.9528 7 Al+++ 0.4337813E-05 0.4361331E-05 0.1150923E+00 -2.0069 8 H4SiO4 0.1008100E-02 0.1008100E-02 0.9476716E+02 -2.9965 9 Ca++ 0.1832646E-06 0.1900427E-06 0.7449354E-02 -4.2850 10 Mg++ 0.7397018E-10 0.7642797E-10 0.1817332E-05 -7.6837 11 Fe++ 0.2873712E-07 0.2976653E-07 0.1625883E-02 -5.0932 12 K+ 0.1288989E-03 0.1289849E-03 0.4932863E+01 -2.5575 13 Na+ 0.1807585E-01 0.1829537E-01 0.4113748E+03 -0.4126 14 Mn++ 0.1807112E-08 0.2056697E-08 0.1105107E-03 -6.2938 15 F- 0.2400679E-04 0.4383842E-02 0.8145619E+02 -3.2911 16 HPO4-- 0.1109391E-13 0.3807384E-07 0.3574079E-02 -11.4952 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1272072E+01 0.5516860E+00 0.2864268E+00 0.4339596E+00 2 H2O 0.5967080E+02 0.6033132E+02 -.2512399E+00 -.4092831E+00 3 Cl- 0.7093783E-01 0.7093782E-01 0.0000000E+00 0.4938201E-08 4 SO4-- 0.5728497E-01 -.2872149E-07 0.5728536E-01 -.3607233E-06 5 HCO3- 0.8676123E+00 0.4463329E+00 0.0000000E+00 0.4212795E+00 6 HS- 0.2343403E+00 0.4980352E-01 0.1718561E+00 0.1268070E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1103799E-02 0.1104922E-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- 0.4800096E-02 0.4800001E-02 0.0000000E+00 0.9547557E-07 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4869E-16 Mass of aqueous solution: 0.111950E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 11.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1200E-01 -1.921 0.2160 -0.665 1.126 4.765 CO2,gas 0.4213 -0.375 18.54 1.268 96.62 226.9 CH4,gas 0.3391E-06 -6.470 0.5439E-05 -5.264 0.2834E-04 0.2189E-03 H2,gas 0.8563E-07 -7.067 0.1730E-06 -6.762 0.9014E-06 0.5455E-04 H2S,gas 0.1268E-01 -1.897 0.4321 -0.364 2.252 6.455 S2,gas 0.4787E-11 -11.320 0.3070E-09 -9.513 0.1600E-08 0.2971E-08 CO,gas 0.9717E-09 -9.012 0.2722E-07 -7.565 0.1418E-06 0.6029E-06 SO3,gas 0.3027E-30 -30.519 0.2424E-28 -28.616 0.1263E-27 0.1878E-27 SO2,gas 0.1171E-12 -12.932 0.7499E-11 -11.125 0.3908E-10 0.7264E-10 HF,gas 0.9548E-07 -7.020 0.1910E-05 -5.719 0.9951E-05 0.5924E-04 HCl,gas 0.4938E-08 -8.306 0.1800E-06 -6.745 0.9383E-06 0.3064E-05 quartz 0.1105E-01 -1.957 0.6638 -0.178 8.287 0.2507 sulfur 0.2291 -0.640 7.346 0.866 91.71 3.554 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 0.9447E+00 0.4723E+02 0.8707 1.614 CH4,gas 0.7603E-06 0.3802E-04 1.0375 -4.404 H2,gas 0.1920E-06 0.9600E-05 1.0270 -5.006 H2S,gas 0.2843E-01 0.1422E+01 0.8293 0.072 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2179E-08 0.1089E-06 1.0000 -6.963 SO3,gas 0.6788E-30 0.3394E-28 1.0000 -28.469 SO2,gas 0.2625E-12 0.1313E-10 1.0000 -10.882 HF,gas 0.2141E-06 0.1070E-04 1.0000 -4.970 HCl,gas 0.1107E-07 0.5537E-06 1.0000 -6.257 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: 1.673382 % Solid products produced: Mass = 8.010111 g Volume = 3.804769 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: 11.9999900 moles log = 1.0792 Original solution: 1000.0103000 g Original solution / Rock added: 83.33 (Water/Rock Ratio), log = 1.9208 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 -0.45496E-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 0.00000E+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 0.37914E-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 0.30331E-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 -2.01 -4.89 -0.815 0.83455E+04 69 diamond -3.10 -4.15 -1.05 -0.299 0.17864E+04 89 graphite -3.55 -4.15 -0.60 -0.172 0.10287E+04 92 halite 1.57 -3.18 -4.75 -2.377 0.81166E+04 145 pyrite -21.25 -22.10 -0.86 -0.201 0.14620E+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 -19.40 -2.86 -0.317 0.48764E+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: 0.4000000 MOLES Current total amount of reactant added: 11.9999900 MOLES New total amount of reactant added: 12.3999900 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 = 12.3999900 Water: Moles liquid = 0.6114E+02 kg liquid = 0.1101E+01 Moles total = 0.6000E+02 kg total = 0.1081E+01 Activity = 0.9919 Stoichiometric ionic strength = .2735626E+00 Osmotic coef. = 0.9148 True ionic strength = .6603256E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7330E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.47914E-01 -1.3195 0.36616E-01 -1.4363 0.76421E+00 -0.1168 2 H2O 0.99189E+00 -0.0035 0.99189E+00 -0.0035 3 Cl- 0.65989E-01 -1.1805 0.49721E-01 -1.3035 0.75348E+00 -0.1229 4 SO4-- 0.17862E-09 -9.7481 0.63448E-10 -10.1976 0.35522E+00 -0.4495 5 HCO3- 0.64420E-05 -5.1910 0.48707E-05 -5.3124 0.75608E+00 -0.1214 6 HS- 0.51052E-06 -6.2920 0.38480E-06 -6.4148 0.75374E+00 -0.1228 7 Al+++ 0.43132E-05 -5.3652 0.42045E-06 -6.3763 0.97481E-01 -1.0111 8 H4SiO4 0.10081E-02 -2.9965 0.10081E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18207E-06 -6.7398 0.63525E-07 -7.1971 0.34891E+00 -0.4573 10 Mg++ 0.73493E-10 -10.1338 0.25367E-10 -10.5957 0.34516E+00 -0.4620 11 Fe++ 0.28550E-07 -7.5444 0.98798E-08 -8.0053 0.34605E+00 -0.4609 12 K+ 0.12813E-03 -3.8923 0.96921E-04 -4.0136 0.75642E+00 -0.1212 13 Na+ 0.17964E-01 -1.7456 0.13527E-01 -1.8688 0.75303E+00 -0.1232 14 Mn++ 0.17928E-08 -8.7465 0.62159E-09 -9.2065 0.34673E+00 -0.4600 15 F- 0.23825E-04 -4.6230 0.17869E-04 -4.7479 0.75001E+00 -0.1249 16 HPO4-- 0.10369E-13 -13.9842 0.36846E-14 -14.4336 0.35534E+00 -0.4494 17 SiF6-2 0.54767E-12 -12.2615 0.19357E-12 -12.7132 0.35345E+00 -0.4517 18 HSiO3- 0.34396E-10 -10.4635 0.25917E-10 -10.5864 0.75348E+00 -0.1229 19 Ca(HSiO3)+ 0.49542E-16 -16.3050 0.37494E-16 -16.4260 0.75681E+00 -0.1210 20 Mg(HSiO3)+ 0.24620E-19 -19.6087 0.18633E-19 -19.7297 0.75681E+00 -0.1210 21 NaHSiO3,aq 0.56702E-11 -11.2464 0.56702E-11 -11.2464 0.10000E+01 0.0000 22 AlO+ 0.55914E-10 -10.2525 0.42316E-10 -10.3735 0.75681E+00 -0.1210 23 AlOH+2 0.22201E-07 -7.6536 0.77154E-08 -8.1126 0.34752E+00 -0.4590 24 HAlO2,aq 0.22828E-12 -12.6415 0.22828E-12 -12.6415 0.10000E+01 0.0000 25 AlO2- 0.18391E-16 -16.7354 0.13800E-16 -16.8601 0.75041E+00 -0.1247 26 CH4,aq 0.30188E-07 -7.5202 0.28462E-07 -7.5457 0.94280E+00 -0.0256 27 C2H6,aq 0.19264E-16 -16.7153 0.18162E-16 -16.7408 0.94280E+00 -0.0256 31 CO,aq 0.74192E-10 -10.1296 0.74192E-10 -10.1296 0.10000E+01 0.0000 32 CO2,aq 0.40751E+00 -0.3899 0.38420E+00 -0.4154 0.94280E+00 -0.0256 33 CO3-2 0.32872E-13 -13.4832 0.11619E-13 -13.9348 0.35345E+00 -0.4517 34 CaCO3,aq 0.92547E-17 -17.0336 0.92547E-17 -17.0336 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.10436E-10 -10.9815 0.78980E-11 -11.1025 0.75681E+00 -0.1210 36 CaCl+ 0.67541E-08 -8.1704 0.51115E-08 -8.2914 0.75681E+00 -0.1210 37 CaCl2,aq 0.60381E-10 -10.2191 0.60381E-10 -10.2191 0.10000E+01 0.0000 38 CaF+ 0.21898E-10 -10.6596 0.16573E-10 -10.7806 0.75681E+00 -0.1210 39 CaOH+ 0.16205E-15 -15.7903 0.12264E-15 -15.9114 0.75681E+00 -0.1210 40 CaSO4,aq 0.12799E-14 -14.8928 0.12799E-14 -14.8928 0.10000E+01 0.0000 41 HCl,aq 0.33362E-03 -3.4767 0.33362E-03 -3.4767 0.10000E+01 0.0000 45 HF,aq 0.44791E-02 -2.3488 0.44791E-02 -2.3488 0.10000E+01 0.0000 46 HF2- 0.35863E-07 -7.4454 0.27022E-07 -7.5683 0.75348E+00 -0.1229 47 Fe+3 0.34260E-17 -17.4652 0.33643E-18 -18.4731 0.98199E-01 -1.0079 48 FeCl+ 0.10274E-08 -8.9883 0.77754E-09 -9.1093 0.75681E+00 -0.1210 49 FeCl2,aq 0.12240E-14 -14.9122 0.12240E-14 -14.9122 0.10000E+01 0.0000 50 FeCl+2 0.34392E-17 -17.4635 0.11952E-17 -17.9226 0.34752E+00 -0.4590 51 FeF+ 0.11920E-10 -10.9237 0.90215E-11 -11.0447 0.75681E+00 -0.1210 52 FeF+2 0.15417E-15 -15.8120 0.53579E-16 -16.2710 0.34752E+00 -0.4590 54 FeOH+ 0.11511E-13 -13.9389 0.87117E-14 -14.0599 0.75681E+00 -0.1210 56 FeO+ 0.31443E-18 -18.5025 0.23796E-18 -18.6235 0.75681E+00 -0.1210 57 FeOH+2 0.47882E-17 -17.3198 0.16640E-17 -17.7788 0.34752E+00 -0.4590 60 H2,aq 0.80875E-08 -8.0922 0.76249E-08 -8.1178 0.94280E+00 -0.0256 61 KCl,aq 0.87341E-07 -7.0588 0.87341E-07 -7.0588 0.10000E+01 0.0000 62 KHSO4,aq 0.63664E-15 -15.1961 0.63664E-15 -15.1961 0.10000E+01 0.0000 63 KOH,aq 0.11212E-14 -14.9503 0.11212E-14 -14.9503 0.10000E+01 0.0000 64 KSO4- 0.12664E-12 -12.8974 0.95424E-13 -13.0203 0.75348E+00 -0.1229 66 Mg(HCO3)+ 0.42582E-14 -14.3708 0.32226E-14 -14.4918 0.75681E+00 -0.1210 67 MgCl+ 0.24444E-11 -11.6118 0.18500E-11 -11.7328 0.75681E+00 -0.1210 68 MgF+ 0.32392E-13 -13.4896 0.24515E-13 -13.6106 0.75681E+00 -0.1210 69 MgOH+ 0.35807E-18 -18.4460 0.27099E-18 -18.5670 0.75681E+00 -0.1210 71 MnF+ 0.24720E-12 -12.6069 0.18708E-12 -12.7280 0.75681E+00 -0.1210 73 MnOH+ 0.67278E-16 -16.1721 0.50917E-16 -16.2931 0.75681E+00 -0.1210 78 MnCl+ 0.25148E-09 -9.5995 0.19032E-09 -9.7205 0.75681E+00 -0.1210 79 MnSO4,aq 0.11386E-16 -16.9436 0.11386E-16 -16.9436 0.10000E+01 0.0000 80 NaCl,aq 0.22290E-03 -3.6519 0.22290E-03 -3.6519 0.10000E+01 0.0000 81 NaF,aq 0.56590E-07 -7.2473 0.56590E-07 -7.2473 0.10000E+01 0.0000 82 NaOH,aq 0.15744E-12 -12.8029 0.15744E-12 -12.8029 0.10000E+01 0.0000 84 OH- 0.20857E-10 -10.6807 0.15651E-10 -10.8055 0.75041E+00 -0.1247 90 H3PO3,aq 0.26262E-19 -19.5807 0.26262E-19 -19.5807 0.10000E+01 0.0000 92 H3PO4,aq 0.34552E-07 -7.4615 0.34552E-07 -7.4615 0.10000E+01 0.0000 93 H2PO4- 0.32958E-08 -8.4820 0.24889E-08 -8.6040 0.75516E+00 -0.1220 95 H4P2O7,aq 0.15868E-16 -16.7995 0.15868E-16 -16.7995 0.10000E+01 0.0000 96 H3P2O7- 0.73430E-17 -17.1341 0.55328E-17 -17.2571 0.75348E+00 -0.1229 97 H2P2O7-2 0.13854E-17 -17.8584 0.48968E-18 -18.3101 0.35345E+00 -0.4517 100 H2S,aq 0.46189E-01 -1.3355 0.43547E-01 -1.3610 0.94280E+00 -0.0256 101 S2-2 0.12174E-14 -14.9146 0.43030E-15 -15.3662 0.35345E+00 -0.4517 102 S3-2 0.93674E-14 -14.0284 0.33109E-14 -14.4801 0.35345E+00 -0.4517 103 S3- 0.12351E-08 -8.9083 0.93065E-09 -9.0312 0.75348E+00 -0.1229 104 S4-2 0.47612E-13 -13.3223 0.16828E-13 -13.7740 0.35345E+00 -0.4517 105 S5-2 0.16137E-12 -12.7922 0.57034E-13 -13.2439 0.35345E+00 -0.4517 106 SO2,aq 0.29444E-11 -11.5310 0.29444E-11 -11.5310 0.10000E+01 0.0000 107 SO3-2 0.17338E-18 -18.7610 0.63381E-19 -19.1980 0.36557E+00 -0.4370 108 HSO3- 0.19285E-12 -12.7148 0.14531E-12 -12.8377 0.75348E+00 -0.1229 109 HSO4- 0.29512E-08 -8.5300 0.22389E-08 -8.6500 0.75865E+00 -0.1200 111 S2O3-2 0.92578E-13 -13.0335 0.32721E-13 -13.4852 0.35345E+00 -0.4517 112 HS2O3- 0.28432E-12 -12.5462 0.21423E-12 -12.6691 0.75348E+00 -0.1229 113 H2S2O3,aq 0.12575E-12 -12.9005 0.12575E-12 -12.9005 0.10000E+01 0.0000 Charge balance for all species = -.5000E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4791413E-01 0.5064254E+00 0.4992020E+03 0.0000 2 H2O 0.1000000E+01 0.5510074E+02 0.9707895E+06 0.0000 3 Cl- 0.6598857E-01 0.6654518E-01 0.2307256E+04 0.1329 4 SO4-- 0.1786177E-09 -.2832382E-07 -.2660896E-02 -7.3249 5 HCO3- 0.6441977E-05 0.4075160E+00 0.2431773E+05 -3.8761 6 HS- 0.5105207E-06 0.4618955E-01 0.1493930E+04 -4.9784 7 Al+++ 0.4313161E-05 0.4335418E-05 0.1143993E+00 -2.0673 8 H4SiO4 0.1008079E-02 0.1008079E-02 0.9475751E+02 -2.9965 9 Ca++ 0.1820668E-06 0.1889136E-06 0.7404494E-02 -4.3244 10 Mg++ 0.7349280E-10 0.7597387E-10 0.1806388E-05 -7.7231 11 Fe++ 0.2855034E-07 0.2958967E-07 0.1616092E-02 -5.1326 12 K+ 0.1281312E-03 0.1282185E-03 0.4903157E+01 -2.5773 13 Na+ 0.1796371E-01 0.1818667E-01 0.4088975E+03 -0.4325 14 Mn++ 0.1792753E-08 0.2044477E-08 0.1098452E-03 -6.3338 15 F- 0.2382492E-04 0.4503047E-02 0.8366437E+02 -3.3116 16 HPO4-- 0.1036946E-13 0.3784762E-07 0.3552556E-02 -11.5610 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1315142E+01 0.5578147E+00 0.2959770E+00 0.4613507E+00 2 H2O 0.5999828E+02 0.6069206E+02 -.2588669E+00 -.4349104E+00 3 Cl- 0.7329783E-01 0.7329782E-01 0.0000000E+00 0.5581911E-08 4 SO4-- 0.5919497E-01 -.3119797E-07 0.5919540E-01 -.4062590E-06 5 HCO3- 0.8965323E+00 0.4488684E+00 0.0000000E+00 0.4476639E+00 6 HS- 0.2421503E+00 0.5087661E-01 0.1775862E+00 0.1368747E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1110373E-02 0.1104265E-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- 0.4960096E-02 0.4959992E-02 0.0000000E+00 0.1042814E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2943E-16 Mass of aqueous solution: 0.112628E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 12.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1275E-01 -1.894 0.2297 -0.639 1.126 5.066 CO2,gas 0.4477 -0.349 19.70 1.295 96.59 241.1 CH4,gas 0.3829E-06 -6.417 0.6142E-05 -5.212 0.3011E-04 0.2472E-03 H2,gas 0.9243E-07 -7.034 0.1867E-06 -6.729 0.9153E-06 0.5888E-04 H2S,gas 0.1369E-01 -1.864 0.4665 -0.331 2.287 6.968 S2,gas 0.5090E-11 -11.293 0.3263E-09 -9.486 0.1600E-08 0.3158E-08 CO,gas 0.1048E-08 -8.979 0.2936E-07 -7.532 0.1440E-06 0.6505E-06 SO3,gas 0.3075E-30 -30.512 0.2462E-28 -28.609 0.1207E-27 0.1908E-27 SO2,gas 0.1207E-12 -12.918 0.7734E-11 -11.112 0.3792E-10 0.7491E-10 HF,gas 0.1043E-06 -6.982 0.2086E-05 -5.681 0.1022E-04 0.6471E-04 HCl,gas 0.5582E-08 -8.253 0.2035E-06 -6.691 0.9977E-06 0.3464E-05 quartz 0.1104E-01 -1.957 0.6634 -0.178 8.037 0.2505 sulfur 0.2368 -0.626 7.591 0.880 91.96 3.673 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 0.9442E+00 0.4721E+02 0.8707 1.614 CH4,gas 0.8076E-06 0.4038E-04 1.0375 -4.378 H2,gas 0.1949E-06 0.9747E-05 1.0270 -5.000 H2S,gas 0.2887E-01 0.1443E+01 0.8293 0.078 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2211E-08 0.1106E-06 1.0000 -6.956 SO3,gas 0.6486E-30 0.3243E-28 1.0000 -28.489 SO2,gas 0.2547E-12 0.1273E-10 1.0000 -10.895 HF,gas 0.2200E-06 0.1100E-04 1.0000 -4.959 HCl,gas 0.1177E-07 0.5887E-06 1.0000 -6.230 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: 1.766140 % Solid products produced: Mass = 8.254661 g Volume = 3.923123 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: 12.3999900 moles log = 1.0934 Original solution: 1000.0103000 g Original solution / Rock added: 80.65 (Water/Rock Ratio), log = 1.9066 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 0.00000E+00 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 0.15165E-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 0.00000E+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 0.75827E-12 172 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 -2.07 -4.95 -0.825 0.84487E+04 69 diamond -3.10 -4.14 -1.03 -0.295 0.17642E+04 89 graphite -3.55 -4.14 -0.59 -0.168 0.10065E+04 92 halite 1.57 -3.17 -4.75 -2.373 0.81051E+04 145 pyrite -21.25 -22.14 -0.89 -0.209 0.15181E+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 -19.50 -2.95 -0.328 0.50427E+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: 0.4000000 MOLES Current total amount of reactant added: 12.3999900 MOLES New total amount of reactant added: 12.7999900 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 = 12.7999900 Water: Moles liquid = 0.6150E+02 kg liquid = 0.1108E+01 Moles total = 0.6033E+02 kg total = 0.1087E+01 Activity = 0.9919 Stoichiometric ionic strength = .2747263E+00 Osmotic coef. = 0.9148 True ionic strength = .6774556E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7566E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.49739E-01 -1.3033 0.37930E-01 -1.4210 0.76259E+00 -0.1177 2 H2O 0.99188E+00 -0.0035 0.99188E+00 -0.0035 3 Cl- 0.67702E-01 -1.1694 0.50893E-01 -1.2933 0.75172E+00 -0.1239 4 SO4-- 0.16088E-09 -9.7935 0.56617E-10 -10.2471 0.35193E+00 -0.4535 5 HCO3- 0.62303E-05 -5.2055 0.46998E-05 -5.3279 0.75435E+00 -0.1224 6 HS- 0.50118E-06 -6.3000 0.37688E-06 -6.4238 0.75198E+00 -0.1238 7 Al+++ 0.42887E-05 -5.3677 0.40921E-06 -6.3881 0.95415E-01 -1.0204 8 H4SiO4 0.10081E-02 -2.9965 0.10081E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.18089E-06 -6.7426 0.62510E-07 -7.2040 0.34558E+00 -0.4615 10 Mg++ 0.73022E-10 -10.1365 0.24959E-10 -10.6028 0.34180E+00 -0.4662 11 Fe++ 0.28366E-07 -7.5472 0.97210E-08 -8.0123 0.34270E+00 -0.4651 12 K+ 0.12737E-03 -3.8949 0.96127E-04 -4.0172 0.75469E+00 -0.1222 13 Na+ 0.17853E-01 -1.7483 0.13412E-01 -1.8725 0.75125E+00 -0.1242 14 Mn++ 0.17787E-08 -8.7499 0.61075E-09 -9.2141 0.34338E+00 -0.4642 15 F- 0.23662E-04 -4.6259 0.17704E-04 -4.7519 0.74820E+00 -0.1260 16 HPO4-- 0.97234E-14 -14.0122 0.34232E-14 -14.4656 0.35205E+00 -0.4534 17 SiF6-2 0.60216E-12 -12.2203 0.21085E-12 -12.6760 0.35015E+00 -0.4557 18 HSiO3- 0.33282E-10 -10.4778 0.25019E-10 -10.6017 0.75172E+00 -0.1239 19 Ca(HSiO3)+ 0.47169E-16 -16.3263 0.35617E-16 -16.4483 0.75508E+00 -0.1220 20 Mg(HSiO3)+ 0.23439E-19 -19.6301 0.17698E-19 -19.7521 0.75508E+00 -0.1220 21 NaHSiO3,aq 0.54271E-11 -11.2654 0.54271E-11 -11.2654 0.10000E+01 0.0000 22 AlO+ 0.50829E-10 -10.2939 0.38380E-10 -10.4159 0.75508E+00 -0.1220 23 AlOH+2 0.21061E-07 -7.6765 0.72489E-08 -8.1397 0.34418E+00 -0.4632 24 HAlO2,aq 0.19987E-12 -12.6992 0.19987E-12 -12.6992 0.10000E+01 0.0000 25 AlO2- 0.15582E-16 -16.8074 0.11664E-16 -16.9331 0.74860E+00 -0.1257 26 CH4,aq 0.31977E-07 -7.4952 0.30142E-07 -7.5208 0.94264E+00 -0.0257 27 C2H6,aq 0.21300E-16 -16.6716 0.20078E-16 -16.6973 0.94264E+00 -0.0257 31 CO,aq 0.75239E-10 -10.1236 0.75239E-10 -10.1236 0.10000E+01 0.0000 32 CO2,aq 0.40739E+00 -0.3900 0.38403E+00 -0.4156 0.94264E+00 -0.0257 33 CO3-2 0.30909E-13 -13.5099 0.10823E-13 -13.9657 0.35015E+00 -0.4557 34 CaCO3,aq 0.84829E-17 -17.0715 0.84829E-17 -17.0715 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.99316E-11 -11.0030 0.74992E-11 -11.1250 0.75508E+00 -0.1220 36 CaCl+ 0.68183E-08 -8.1663 0.51484E-08 -8.2883 0.75508E+00 -0.1220 37 CaCl2,aq 0.62249E-10 -10.2059 0.62249E-10 -10.2059 0.10000E+01 0.0000 38 CaF+ 0.21399E-10 -10.6696 0.16158E-10 -10.7916 0.75508E+00 -0.1220 39 CaOH+ 0.15429E-15 -15.8117 0.11650E-15 -15.9337 0.75508E+00 -0.1220 40 CaSO4,aq 0.11239E-14 -14.9493 0.11239E-14 -14.9493 0.10000E+01 0.0000 41 HCl,aq 0.35373E-03 -3.4513 0.35373E-03 -3.4513 0.10000E+01 0.0000 45 HF,aq 0.45971E-02 -2.3375 0.45971E-02 -2.3375 0.10000E+01 0.0000 46 HF2- 0.36554E-07 -7.4371 0.27478E-07 -7.5610 0.75172E+00 -0.1239 47 Fe+3 0.35414E-17 -17.4508 0.34043E-18 -18.4680 0.96130E-01 -1.0171 48 FeCl+ 0.10371E-08 -8.9842 0.78307E-09 -9.1062 0.75508E+00 -0.1220 49 FeCl2,aq 0.12617E-14 -14.8990 0.12617E-14 -14.8990 0.10000E+01 0.0000 50 FeCl+2 0.35967E-17 -17.4441 0.12379E-17 -17.9073 0.34418E+00 -0.4632 51 FeF+ 0.11647E-10 -10.9338 0.87947E-11 -11.0558 0.75508E+00 -0.1220 52 FeF+2 0.15607E-15 -15.8067 0.53716E-16 -16.2699 0.34418E+00 -0.4632 54 FeOH+ 0.10959E-13 -13.9602 0.82746E-14 -14.0823 0.75508E+00 -0.1220 56 FeO+ 0.29718E-18 -18.5270 0.22440E-18 -18.6490 0.75508E+00 -0.1220 57 FeOH+2 0.47227E-17 -17.3258 0.16254E-17 -17.7890 0.34418E+00 -0.4632 60 H2,aq 0.82066E-08 -8.0858 0.77359E-08 -8.1115 0.94264E+00 -0.0257 61 KCl,aq 0.88666E-07 -7.0522 0.88666E-07 -7.0522 0.10000E+01 0.0000 62 KHSO4,aq 0.58367E-15 -15.2338 0.58367E-15 -15.2338 0.10000E+01 0.0000 63 KOH,aq 0.10735E-14 -14.9692 0.10735E-14 -14.9692 0.10000E+01 0.0000 64 KSO4- 0.11235E-12 -12.9494 0.84454E-13 -13.0734 0.75172E+00 -0.1239 66 Mg(HCO3)+ 0.40520E-14 -14.3923 0.30596E-14 -14.5143 0.75508E+00 -0.1220 67 MgCl+ 0.24674E-11 -11.6078 0.18631E-11 -11.7298 0.75508E+00 -0.1220 68 MgF+ 0.31650E-13 -13.4996 0.23898E-13 -13.6216 0.75508E+00 -0.1220 69 MgOH+ 0.34089E-18 -18.4674 0.25740E-18 -18.5894 0.75508E+00 -0.1220 71 MnF+ 0.24120E-12 -12.6176 0.18213E-12 -12.7396 0.75508E+00 -0.1220 73 MnOH+ 0.63960E-16 -16.1941 0.48295E-16 -16.3161 0.75508E+00 -0.1220 78 MnCl+ 0.25349E-09 -9.5960 0.19141E-09 -9.7180 0.75508E+00 -0.1220 79 MnSO4,aq 0.99828E-17 -17.0007 0.99828E-17 -17.0007 0.10000E+01 0.0000 80 NaCl,aq 0.22621E-03 -3.6455 0.22621E-03 -3.6455 0.10000E+01 0.0000 81 NaF,aq 0.55591E-07 -7.2550 0.55591E-07 -7.2550 0.10000E+01 0.0000 82 NaOH,aq 0.15069E-12 -12.8219 0.15069E-12 -12.8219 0.10000E+01 0.0000 84 OH- 0.20183E-10 -10.6950 0.15109E-10 -10.8208 0.74860E+00 -0.1257 90 H3PO3,aq 0.26562E-19 -19.5757 0.26562E-19 -19.5757 0.10000E+01 0.0000 92 H3PO4,aq 0.34445E-07 -7.4629 0.34445E-07 -7.4629 0.10000E+01 0.0000 93 H2PO4- 0.31792E-08 -8.4977 0.23952E-08 -8.6207 0.75342E+00 -0.1230 95 H4P2O7,aq 0.15770E-16 -16.8022 0.15770E-16 -16.8022 0.10000E+01 0.0000 96 H3P2O7- 0.70615E-17 -17.1511 0.53082E-17 -17.2751 0.75172E+00 -0.1239 97 H2P2O7-2 0.12952E-17 -17.8876 0.45353E-18 -18.3434 0.35015E+00 -0.4557 100 H2S,aq 0.46869E-01 -1.3291 0.44181E-01 -1.3548 0.94264E+00 -0.0257 101 S2-2 0.11619E-14 -14.9348 0.40684E-15 -15.3906 0.35015E+00 -0.4557 102 S3-2 0.89401E-14 -14.0487 0.31304E-14 -14.5044 0.35015E+00 -0.4557 103 S3- 0.12038E-08 -8.9194 0.90493E-09 -9.0434 0.75172E+00 -0.1239 104 S4-2 0.45440E-13 -13.3426 0.15911E-13 -13.7983 0.35015E+00 -0.4557 105 S5-2 0.15401E-12 -12.8125 0.53925E-13 -13.2682 0.35015E+00 -0.4557 106 SO2,aq 0.28604E-11 -11.5436 0.28604E-11 -11.5436 0.10000E+01 0.0000 107 SO3-2 0.15836E-18 -18.8004 0.57382E-19 -19.2412 0.36236E+00 -0.4409 108 HSO3- 0.18129E-12 -12.7416 0.13628E-12 -12.8656 0.75172E+00 -0.1239 109 HSO4- 0.27341E-08 -8.5632 0.20696E-08 -8.6841 0.75695E+00 -0.1209 111 S2O3-2 0.84603E-13 -13.0726 0.29624E-13 -13.5284 0.35015E+00 -0.4557 112 HS2O3- 0.26727E-12 -12.5731 0.20091E-12 -12.6970 0.75172E+00 -0.1239 113 H2S2O3,aq 0.12217E-12 -12.9130 0.12217E-12 -12.9130 0.10000E+01 0.0000 Charge balance for all species = -.4971E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4973876E-01 0.5089534E+00 0.5016540E+03 0.0000 2 H2O 0.1000000E+01 0.5510086E+02 0.9707143E+06 0.0000 3 Cl- 0.6770203E-01 0.6828207E-01 0.2367289E+04 0.1277 4 SO4-- 0.1608756E-09 -.3039651E-07 -.2855388E-02 -7.4050 5 HCO3- 0.6230254E-05 0.4074010E+00 0.2430894E+05 -3.9069 6 HS- 0.5011821E-06 0.4686953E-01 0.1515803E+04 -5.0028 7 Al+++ 0.4288699E-05 0.4309811E-05 0.1137145E+00 -2.1250 8 H4SiO4 0.1008058E-02 0.1008058E-02 0.9474805E+02 -2.9965 9 Ca++ 0.1808859E-06 0.1877978E-06 0.7360174E-02 -4.3620 10 Mg++ 0.7302202E-10 0.7552514E-10 0.1795576E-05 -7.7607 11 Fe++ 0.2836618E-07 0.2941491E-07 0.1606419E-02 -5.1703 12 K+ 0.1273725E-03 0.1274612E-03 0.4873809E+01 -2.5961 13 Na+ 0.1785299E-01 0.1807925E-01 0.4064500E+03 -0.4515 14 Mn++ 0.1778670E-08 0.2032401E-08 0.1091877E-03 -6.3721 15 F- 0.2366235E-04 0.4620844E-02 0.8584614E+02 -3.3309 16 HPO4-- 0.9723435E-14 0.3762408E-07 0.3531292E-02 -11.6235 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1358212E+01 0.5639300E+00 0.3055273E+00 0.4887551E+00 2 H2O 0.6032576E+02 0.6105279E+02 -.2664940E+00 -.4605333E+00 3 Cl- 0.7565783E-01 0.7565782E-01 0.0000000E+00 0.6270000E-08 4 SO4-- 0.6110497E-01 -.3367991E-07 0.6110546E-01 -.4547063E-06 5 HCO3- 0.9254523E+00 0.4514080E+00 0.0000000E+00 0.4740443E+00 6 HS- 0.2499603E+00 0.5193232E-01 0.1833164E+00 0.1471160E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1116948E-02 0.1103607E-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- 0.5120096E-02 0.5119983E-02 0.0000000E+00 0.1133852E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1425E-15 Mass of aqueous solution: 0.113307E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 12.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1351E-01 -1.869 0.2433 -0.614 1.126 5.367 CO2,gas 0.4740 -0.324 20.86 1.319 96.55 255.3 CH4,gas 0.4296E-06 -6.367 0.6891E-05 -5.162 0.3189E-04 0.2773E-03 H2,gas 0.9934E-07 -7.003 0.2007E-06 -6.698 0.9287E-06 0.6328E-04 H2S,gas 0.1471E-01 -1.832 0.5014 -0.300 2.320 7.489 S2,gas 0.5392E-11 -11.268 0.3457E-09 -9.461 0.1600E-08 0.3346E-08 CO,gas 0.1126E-08 -8.948 0.3155E-07 -7.501 0.1460E-06 0.6989E-06 SO3,gas 0.3119E-30 -30.506 0.2497E-28 -28.603 0.1156E-27 0.1935E-27 SO2,gas 0.1243E-12 -12.906 0.7960E-11 -11.099 0.3684E-10 0.7710E-10 HF,gas 0.1134E-06 -6.945 0.2268E-05 -5.644 0.1050E-04 0.7036E-04 HCl,gas 0.6270E-08 -8.203 0.2286E-06 -6.641 0.1058E-05 0.3891E-05 quartz 0.1104E-01 -1.957 0.6630 -0.178 7.801 0.2504 sulfur 0.2444 -0.612 7.836 0.894 92.20 3.791 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 0.9438E+00 0.4719E+02 0.8707 1.614 CH4,gas 0.8553E-06 0.4277E-04 1.0375 -4.353 H2,gas 0.1978E-06 0.9889E-05 1.0270 -4.993 H2S,gas 0.2929E-01 0.1464E+01 0.8293 0.084 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2242E-08 0.1121E-06 1.0000 -6.950 SO3,gas 0.6210E-30 0.3105E-28 1.0000 -28.508 SO2,gas 0.2474E-12 0.1237E-10 1.0000 -10.908 HF,gas 0.2257E-06 0.1129E-04 1.0000 -4.947 HCl,gas 0.1248E-07 0.6242E-06 1.0000 -6.205 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: 1.857621 % Solid products produced: Mass = 8.499211 g Volume = 4.041476 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: 12.7999900 moles log = 1.1072 Original solution: 1000.0103000 g Original solution / Rock added: 78.13 (Water/Rock Ratio), log = 1.8928 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 0.30331E-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 0.00000E+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 -0.37914E-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 0.00000E+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 69 diamond -3.10 -4.12 -1.02 -0.292 0.17431E+04 89 graphite -3.55 -4.12 -0.58 -0.165 0.98536E+03 92 halite 1.57 -3.17 -4.74 -2.370 0.80941E+04 145 pyrite -21.25 -22.17 -0.92 -0.217 0.15717E+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 -19.59 -3.05 -0.338 0.52013E+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: 0.4000000 MOLES Current total amount of reactant added: 12.7999900 MOLES New total amount of reactant added: 13.1999900 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 = 13.1999900 Water: Moles liquid = 0.6187E+02 kg liquid = 0.1115E+01 Moles total = 0.6065E+02 kg total = 0.1093E+01 Activity = 0.9919 Stoichiometric ionic strength = .2758705E+00 Osmotic coef. = 0.9148 True ionic strength = .6943807E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.7802E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.51542E-01 -1.2878 0.39225E-01 -1.4064 0.76103E+00 -0.1186 2 H2O 0.99187E+00 -0.0035 0.99187E+00 -0.0035 3 Cl- 0.69395E-01 -1.1587 0.52047E-01 -1.2836 0.75001E+00 -0.1249 4 SO4-- 0.14565E-09 -9.8367 0.50799E-10 -10.2941 0.34878E+00 -0.4574 5 HCO3- 0.60354E-05 -5.2193 0.45427E-05 -5.3427 0.75268E+00 -0.1234 6 HS- 0.49248E-06 -6.3076 0.36949E-06 -6.4324 0.75027E+00 -0.1248 7 Al+++ 0.42644E-05 -5.3701 0.39853E-06 -6.3995 0.93455E-01 -1.0294 8 H4SiO4 0.10080E-02 -2.9965 0.10080E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.17972E-06 -6.7454 0.61533E-07 -7.2109 0.34238E+00 -0.4655 10 Mg++ 0.72558E-10 -10.1393 0.24566E-10 -10.6097 0.33858E+00 -0.4703 11 Fe++ 0.28185E-07 -7.5500 0.95681E-08 -8.0192 0.33948E+00 -0.4692 12 K+ 0.12662E-03 -3.8975 0.95350E-04 -4.0207 0.75302E+00 -0.1232 13 Na+ 0.17744E-01 -1.7510 0.13300E-01 -1.8762 0.74954E+00 -0.1252 14 Mn++ 0.17649E-08 -8.7533 0.60034E-09 -9.2216 0.34016E+00 -0.4683 15 F- 0.23517E-04 -4.6286 0.17554E-04 -4.7556 0.74645E+00 -0.1270 16 HPO4-- 0.91444E-14 -14.0388 0.31905E-14 -14.4961 0.34890E+00 -0.4573 17 SiF6-2 0.66034E-12 -12.1802 0.22913E-12 -12.6399 0.34699E+00 -0.4597 18 HSiO3- 0.32257E-10 -10.4914 0.24193E-10 -10.6163 0.75001E+00 -0.1249 19 Ca(HSiO3)+ 0.44998E-16 -16.3468 0.33902E-16 -16.4698 0.75342E+00 -0.1230 20 Mg(HSiO3)+ 0.22358E-19 -19.6506 0.16845E-19 -19.7735 0.75342E+00 -0.1230 21 NaHSiO3,aq 0.52039E-11 -11.2837 0.52039E-11 -11.2837 0.10000E+01 0.0000 22 AlO+ 0.46392E-10 -10.3336 0.34953E-10 -10.4565 0.75342E+00 -0.1230 23 AlOH+2 0.20022E-07 -7.6985 0.68268E-08 -8.1658 0.34097E+00 -0.4673 24 HAlO2,aq 0.17602E-12 -12.7544 0.17602E-12 -12.7544 0.10000E+01 0.0000 25 AlO2- 0.13300E-16 -16.8762 0.99332E-17 -17.0029 0.74686E+00 -0.1268 26 CH4,aq 0.33778E-07 -7.4714 0.31836E-07 -7.4971 0.94249E+00 -0.0257 27 C2H6,aq 0.23439E-16 -16.6301 0.22091E-16 -16.6558 0.94249E+00 -0.0257 31 CO,aq 0.76250E-10 -10.1178 0.76250E-10 -10.1178 0.10000E+01 0.0000 32 CO2,aq 0.40728E+00 -0.3901 0.38386E+00 -0.4158 0.94249E+00 -0.0257 33 CO3-2 0.29153E-13 -13.5353 0.10116E-13 -13.9950 0.34699E+00 -0.4597 34 CaCO3,aq 0.78049E-17 -17.1076 0.78049E-17 -17.1076 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.94704E-11 -11.0236 0.71352E-11 -11.1466 0.75342E+00 -0.1230 36 CaCl+ 0.68790E-08 -8.1625 0.51828E-08 -8.2854 0.75342E+00 -0.1230 37 CaCl2,aq 0.64086E-10 -10.1932 0.64086E-10 -10.1932 0.10000E+01 0.0000 38 CaF+ 0.20932E-10 -10.6792 0.15770E-10 -10.8022 0.75342E+00 -0.1230 39 CaOH+ 0.14719E-15 -15.8321 0.11089E-15 -15.9551 0.75342E+00 -0.1230 40 CaSO4,aq 0.99259E-15 -15.0032 0.99259E-15 -15.0032 0.10000E+01 0.0000 41 HCl,aq 0.37410E-03 -3.4270 0.37410E-03 -3.4270 0.10000E+01 0.0000 45 HF,aq 0.47136E-02 -2.3266 0.47136E-02 -2.3266 0.10000E+01 0.0000 46 HF2- 0.37248E-07 -7.4289 0.27936E-07 -7.5538 0.75001E+00 -0.1249 47 Fe+3 0.36545E-17 -17.4372 0.34413E-18 -18.4633 0.94166E-01 -1.0261 48 FeCl+ 0.10462E-08 -8.9804 0.78823E-09 -9.1033 0.75342E+00 -0.1230 49 FeCl2,aq 0.12989E-14 -14.8864 0.12989E-14 -14.8864 0.10000E+01 0.0000 50 FeCl+2 0.37532E-17 -17.4256 0.12797E-17 -17.8929 0.34097E+00 -0.4673 51 FeF+ 0.11392E-10 -10.9434 0.85829E-11 -11.0664 0.75342E+00 -0.1230 52 FeF+2 0.15790E-15 -15.8016 0.53840E-16 -16.2689 0.34097E+00 -0.4673 54 FeOH+ 0.10453E-13 -13.9808 0.78756E-14 -14.1037 0.75342E+00 -0.1230 56 FeO+ 0.28153E-18 -18.5505 0.21211E-18 -18.6734 0.75342E+00 -0.1230 57 FeOH+2 0.46599E-17 -17.3316 0.15889E-17 -17.7989 0.34097E+00 -0.4673 60 H2,aq 0.83216E-08 -8.0798 0.78431E-08 -8.1055 0.94249E+00 -0.0257 61 KCl,aq 0.89944E-07 -7.0460 0.89944E-07 -7.0460 0.10000E+01 0.0000 62 KHSO4,aq 0.53718E-15 -15.2699 0.53718E-15 -15.2699 0.10000E+01 0.0000 63 KOH,aq 0.10297E-14 -14.9873 0.10297E-14 -14.9873 0.10000E+01 0.0000 64 KSO4- 0.10021E-12 -12.9991 0.75162E-13 -13.1240 0.75001E+00 -0.1249 66 Mg(HCO3)+ 0.38635E-14 -14.4130 0.29108E-14 -14.5360 0.75342E+00 -0.1230 67 MgCl+ 0.24892E-11 -11.6039 0.18754E-11 -11.7269 0.75342E+00 -0.1230 68 MgF+ 0.30956E-13 -13.5093 0.23323E-13 -13.6322 0.75342E+00 -0.1230 69 MgOH+ 0.32517E-18 -18.4879 0.24499E-18 -18.6109 0.75342E+00 -0.1230 71 MnF+ 0.23560E-12 -12.6278 0.17750E-12 -12.7508 0.75342E+00 -0.1230 73 MnOH+ 0.60928E-16 -16.2152 0.45905E-16 -16.3381 0.75342E+00 -0.1230 78 MnCl+ 0.25538E-09 -9.5928 0.19241E-09 -9.7158 0.75342E+00 -0.1230 79 MnSO4,aq 0.88041E-17 -17.0553 0.88041E-17 -17.0553 0.10000E+01 0.0000 80 NaCl,aq 0.22940E-03 -3.6394 0.22940E-03 -3.6394 0.10000E+01 0.0000 81 NaF,aq 0.54657E-07 -7.2624 0.54657E-07 -7.2624 0.10000E+01 0.0000 82 NaOH,aq 0.14449E-12 -12.8402 0.14449E-12 -12.8402 0.10000E+01 0.0000 84 OH- 0.19562E-10 -10.7086 0.14610E-10 -10.8353 0.74686E+00 -0.1268 90 H3PO3,aq 0.26842E-19 -19.5712 0.26842E-19 -19.5712 0.10000E+01 0.0000 92 H3PO4,aq 0.34332E-07 -7.4643 0.34332E-07 -7.4643 0.10000E+01 0.0000 93 H2PO4- 0.30710E-08 -8.5127 0.23086E-08 -8.6366 0.75173E+00 -0.1239 95 H4P2O7,aq 0.15667E-16 -16.8050 0.15667E-16 -16.8050 0.10000E+01 0.0000 96 H3P2O7- 0.67993E-17 -17.1675 0.50996E-17 -17.2925 0.75001E+00 -0.1249 97 H2P2O7-2 0.12142E-17 -17.9157 0.42132E-18 -18.3754 0.34699E+00 -0.4597 100 H2S,aq 0.47526E-01 -1.3231 0.44793E-01 -1.3488 0.94249E+00 -0.0257 101 S2-2 0.11116E-14 -14.9541 0.38571E-15 -15.4137 0.34699E+00 -0.4597 102 S3-2 0.85530E-14 -14.0679 0.29678E-14 -14.5276 0.34699E+00 -0.4597 103 S3- 0.11748E-08 -8.9300 0.88111E-09 -9.0550 0.75001E+00 -0.1249 104 S4-2 0.43473E-13 -13.3618 0.15084E-13 -13.8215 0.34699E+00 -0.4597 105 S5-2 0.14734E-12 -12.8317 0.51124E-13 -13.2914 0.34699E+00 -0.4597 106 SO2,aq 0.27827E-11 -11.5555 0.27827E-11 -11.5555 0.10000E+01 0.0000 107 SO3-2 0.14529E-18 -18.8378 0.52199E-19 -19.2823 0.35928E+00 -0.4446 108 HSO3- 0.17093E-12 -12.7672 0.12820E-12 -12.8921 0.75001E+00 -0.1249 109 HSO4- 0.25423E-08 -8.5948 0.19203E-08 -8.7166 0.75532E+00 -0.1219 111 S2O3-2 0.77664E-13 -13.1098 0.26948E-13 -13.5695 0.34699E+00 -0.4597 112 HS2O3- 0.25200E-12 -12.5986 0.18900E-12 -12.7235 0.75001E+00 -0.1249 113 H2S2O3,aq 0.11885E-12 -12.9250 0.11885E-12 -12.9250 0.10000E+01 0.0000 Charge balance for all species = -.4941E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5154152E-01 0.5114403E+00 0.5040658E+03 0.0000 2 H2O 0.1000000E+01 0.5510097E+02 0.9706402E+06 0.0000 3 Cl- 0.6939496E-01 0.6999855E-01 0.2426608E+04 0.1228 4 SO4-- 0.1456475E-09 -.3245229E-07 -.3048265E-02 -7.4813 5 HCO3- 0.6035395E-05 0.4072909E+00 0.2430046E+05 -3.9362 6 HS- 0.4924767E-06 0.4752673E-01 0.1536937E+04 -5.0260 7 Al+++ 0.4264437E-05 0.4284505E-05 0.1130380E+00 -2.1802 8 H4SiO4 0.1008039E-02 0.1008039E-02 0.9473878E+02 -2.9965 9 Ca++ 0.1797216E-06 0.1866951E-06 0.7316384E-02 -4.3980 10 Mg++ 0.7255769E-10 0.7508168E-10 0.1784893E-05 -7.7968 11 Fe++ 0.2818458E-07 0.2924219E-07 0.1596862E-02 -5.2063 12 K+ 0.1266228E-03 0.1267128E-03 0.4844812E+01 -2.6142 13 Na+ 0.1774364E-01 0.1797309E-01 0.4040318E+03 -0.4697 14 Mn++ 0.1764852E-08 0.2020468E-08 0.1085381E-03 -6.4087 15 F- 0.2351659E-04 0.4737257E-02 0.8800198E+02 -3.3492 16 HPO4-- 0.9144425E-14 0.3740316E-07 0.3510283E-02 -11.6833 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1401282E+01 0.5700326E+00 0.3150775E+00 0.5161722E+00 2 H2O 0.6065324E+02 0.6141351E+02 -.2741210E+00 -.4861520E+00 3 Cl- 0.7801783E-01 0.7801782E-01 0.0000000E+00 0.7002973E-08 4 SO4-- 0.6301497E-01 -.3617013E-07 0.6301551E-01 -.5060631E-06 5 HCO3- 0.9543723E+00 0.4539515E+00 0.0000000E+00 0.5004209E+00 6 HS- 0.2577703E+00 0.5297155E-01 0.1890465E+00 0.1575222E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1123523E-02 0.1102950E-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- 0.5280096E-02 0.5279973E-02 0.0000000E+00 0.1227817E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1133E-15 Mass of aqueous solution: 0.113985E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 13.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1427E-01 -1.846 0.2570 -0.590 1.126 5.668 CO2,gas 0.5004 -0.301 22.02 1.343 96.52 269.5 CH4,gas 0.4792E-06 -6.320 0.7686E-05 -5.114 0.3368E-04 0.3093E-03 H2,gas 0.1064E-06 -6.973 0.2149E-06 -6.668 0.9417E-06 0.6776E-04 H2S,gas 0.1575E-01 -1.803 0.5368 -0.270 2.353 8.019 S2,gas 0.5694E-11 -11.245 0.3651E-09 -9.438 0.1600E-08 0.3533E-08 CO,gas 0.1205E-08 -8.919 0.3376E-07 -7.472 0.1480E-06 0.7480E-06 SO3,gas 0.3161E-30 -30.500 0.2531E-28 -28.597 0.1109E-27 0.1961E-27 SO2,gas 0.1277E-12 -12.894 0.8178E-11 -11.087 0.3584E-10 0.7921E-10 HF,gas 0.1228E-06 -6.911 0.2456E-05 -5.610 0.1076E-04 0.7619E-04 HCl,gas 0.7003E-08 -8.155 0.2553E-06 -6.593 0.1119E-05 0.4345E-05 quartz 0.1103E-01 -1.957 0.6627 -0.179 7.579 0.2502 sulfur 0.2521 -0.598 8.081 0.907 92.42 3.910 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 0.9434E+00 0.4717E+02 0.8707 1.614 CH4,gas 0.9033E-06 0.4517E-04 1.0375 -4.329 H2,gas 0.2005E-06 0.1003E-04 1.0270 -4.987 H2S,gas 0.2970E-01 0.1485E+01 0.8293 0.090 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2273E-08 0.1136E-06 1.0000 -6.945 SO3,gas 0.5959E-30 0.2979E-28 1.0000 -28.526 SO2,gas 0.2407E-12 0.1203E-10 1.0000 -10.920 HF,gas 0.2315E-06 0.1157E-04 1.0000 -4.937 HCl,gas 0.1320E-07 0.6601E-06 1.0000 -6.180 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: 1.947849 % Solid products produced: Mass = 8.743761 g Volume = 4.159830 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: 13.1999900 moles log = 1.1206 Original solution: 1000.0103000 g Original solution / Rock added: 75.76 (Water/Rock Ratio), log = 1.8794 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 -0.15165E-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 -0.75827E-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 0.00000E+00 150 quartz -2.99 -2.99 0.00 0.000 -0.75827E-12 172 sulfur -9.15 -9.15 0.00 0.000 -0.30331E-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 69 diamond -3.10 -4.11 -1.01 -0.288 0.17230E+04 89 graphite -3.55 -4.11 -0.57 -0.162 0.96525E+03 92 halite 1.57 -3.16 -4.73 -2.367 0.80837E+04 145 pyrite -21.25 -22.20 -0.95 -0.224 0.16230E+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 -19.68 -3.13 -0.348 0.53526E+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: 0.4000000 MOLES Current total amount of reactant added: 13.1999900 MOLES New total amount of reactant added: 13.5999900 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 = 13.5999900 Water: Moles liquid = 0.6223E+02 kg liquid = 0.1121E+01 Moles total = 0.6098E+02 kg total = 0.1099E+01 Activity = 0.9919 Stoichiometric ionic strength = .2769960E+00 Osmotic coef. = 0.9148 True ionic strength = .7111045E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8038E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.53323E-01 -1.2731 0.40500E-01 -1.3925 0.75952E+00 -0.1195 2 H2O 0.99186E+00 -0.0035 0.99186E+00 -0.0035 3 Cl- 0.71068E-01 -1.1483 0.53184E-01 -1.2742 0.74836E+00 -0.1259 4 SO4-- 0.13249E-09 -9.8778 0.45809E-10 -10.3391 0.34575E+00 -0.4612 5 HCO3- 0.58554E-05 -5.2324 0.43978E-05 -5.3568 0.75107E+00 -0.1243 6 HS- 0.48434E-06 -6.3149 0.36259E-06 -6.4406 0.74863E+00 -0.1257 7 Al+++ 0.42404E-05 -5.3726 0.38839E-06 -6.4107 0.91593E-01 -1.0381 8 H4SiO4 0.10080E-02 -2.9965 0.10080E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.17857E-06 -6.7482 0.60591E-07 -7.2176 0.33930E+00 -0.4694 10 Mg++ 0.72100E-10 -10.1421 0.24188E-10 -10.6164 0.33548E+00 -0.4743 11 Fe++ 0.28005E-07 -7.5528 0.94207E-08 -8.0259 0.33639E+00 -0.4732 12 K+ 0.12588E-03 -3.9000 0.94589E-04 -4.0242 0.75141E+00 -0.1241 13 Na+ 0.17636E-01 -1.7536 0.13189E-01 -1.8798 0.74788E+00 -0.1262 14 Mn++ 0.17513E-08 -8.7566 0.59032E-09 -9.2289 0.33708E+00 -0.4723 15 F- 0.23386E-04 -4.6311 0.17417E-04 -4.7590 0.74477E+00 -0.1280 16 HPO4-- 0.86231E-14 -14.0643 0.29825E-14 -14.5254 0.34587E+00 -0.4611 17 SiF6-2 0.72230E-12 -12.1413 0.24843E-12 -12.6048 0.34395E+00 -0.4635 18 HSiO3- 0.31310E-10 -10.5043 0.23431E-10 -10.6302 0.74836E+00 -0.1259 19 Ca(HSiO3)+ 0.43005E-16 -16.3665 0.32332E-16 -16.4904 0.75181E+00 -0.1239 20 Mg(HSiO3)+ 0.21366E-19 -19.6703 0.16063E-19 -19.7942 0.75181E+00 -0.1239 21 NaHSiO3,aq 0.49983E-11 -11.3012 0.49983E-11 -11.3012 0.10000E+01 0.0000 22 AlO+ 0.42499E-10 -10.3716 0.31951E-10 -10.4955 0.75181E+00 -0.1239 23 AlOH+2 0.19070E-07 -7.7197 0.64435E-08 -8.1909 0.33789E+00 -0.4712 24 HAlO2,aq 0.15583E-12 -12.8073 0.15583E-12 -12.8073 0.10000E+01 0.0000 25 AlO2- 0.11430E-16 -16.9420 0.85174E-17 -17.0697 0.74518E+00 -0.1277 26 CH4,aq 0.35590E-07 -7.4487 0.33539E-07 -7.4745 0.94234E+00 -0.0258 27 C2H6,aq 0.25679E-16 -16.5904 0.24198E-16 -16.6162 0.94234E+00 -0.0258 31 CO,aq 0.77226E-10 -10.1122 0.77226E-10 -10.1122 0.10000E+01 0.0000 32 CO2,aq 0.40718E+00 -0.3902 0.38370E+00 -0.4160 0.94234E+00 -0.0258 33 CO3-2 0.27576E-13 -13.5595 0.94848E-14 -14.0230 0.34395E+00 -0.4635 34 CaCO3,aq 0.72060E-17 -17.1423 0.72060E-17 -17.1423 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.90473E-11 -11.0435 0.68018E-11 -11.1674 0.75181E+00 -0.1239 36 CaCl+ 0.69365E-08 -8.1589 0.52150E-08 -8.2827 0.75181E+00 -0.1239 37 CaCl2,aq 0.65894E-10 -10.1812 0.65894E-10 -10.1812 0.10000E+01 0.0000 38 CaF+ 0.20494E-10 -10.6884 0.15407E-10 -10.8123 0.75181E+00 -0.1239 39 CaOH+ 0.14067E-15 -15.8518 0.10576E-15 -15.9757 0.75181E+00 -0.1239 40 CaSO4,aq 0.88137E-15 -15.0548 0.88137E-15 -15.0548 0.10000E+01 0.0000 41 HCl,aq 0.39470E-03 -3.4037 0.39470E-03 -3.4037 0.10000E+01 0.0000 45 HF,aq 0.48288E-02 -2.3162 0.48288E-02 -2.3162 0.10000E+01 0.0000 46 HF2- 0.37943E-07 -7.4209 0.28395E-07 -7.5468 0.74836E+00 -0.1259 47 Fe+3 0.37655E-17 -17.4242 0.34756E-18 -18.4590 0.92301E-01 -1.0348 48 FeCl+ 0.10548E-08 -8.9768 0.79305E-09 -9.1007 0.75181E+00 -0.1239 49 FeCl2,aq 0.13354E-14 -14.8744 0.13354E-14 -14.8744 0.10000E+01 0.0000 50 FeCl+2 0.39088E-17 -17.4080 0.13207E-17 -17.8792 0.33789E+00 -0.4712 51 FeF+ 0.11153E-10 -10.9526 0.83846E-11 -11.0765 0.75181E+00 -0.1239 52 FeF+2 0.15967E-15 -15.7968 0.53951E-16 -16.2680 0.33789E+00 -0.4712 54 FeOH+ 0.99893E-14 -14.0005 0.75101E-14 -14.1244 0.75181E+00 -0.1239 56 FeO+ 0.26728E-18 -18.5730 0.20094E-18 -18.6969 0.75181E+00 -0.1239 57 FeOH+2 0.45996E-17 -17.3373 0.15542E-17 -17.8085 0.33789E+00 -0.4712 60 H2,aq 0.84329E-08 -8.0740 0.79467E-08 -8.0998 0.94234E+00 -0.0258 61 KCl,aq 0.91176E-07 -7.0401 0.91176E-07 -7.0401 0.10000E+01 0.0000 62 KHSO4,aq 0.49616E-15 -15.3044 0.49616E-15 -15.3044 0.10000E+01 0.0000 63 KOH,aq 0.98929E-15 -15.0047 0.98929E-15 -15.0047 0.10000E+01 0.0000 64 KSO4- 0.89846E-13 -13.0465 0.67237E-13 -13.1724 0.74836E+00 -0.1259 66 Mg(HCO3)+ 0.36905E-14 -14.4329 0.27746E-14 -14.5568 0.75181E+00 -0.1239 67 MgCl+ 0.25098E-11 -11.6004 0.18869E-11 -11.7243 0.75181E+00 -0.1239 68 MgF+ 0.30305E-13 -13.5185 0.22784E-13 -13.6424 0.75181E+00 -0.1239 69 MgOH+ 0.31074E-18 -18.5076 0.23362E-18 -18.6315 0.75181E+00 -0.1239 71 MnF+ 0.23034E-12 -12.6376 0.17318E-12 -12.7615 0.75181E+00 -0.1239 73 MnOH+ 0.58148E-16 -16.2355 0.43717E-16 -16.3594 0.75181E+00 -0.1239 78 MnCl+ 0.25715E-09 -9.5898 0.19333E-09 -9.7137 0.75181E+00 -0.1239 79 MnSO4,aq 0.78067E-17 -17.1075 0.78067E-17 -17.1075 0.10000E+01 0.0000 80 NaCl,aq 0.23247E-03 -3.6336 0.23247E-03 -3.6336 0.10000E+01 0.0000 81 NaF,aq 0.53780E-07 -7.2694 0.53780E-07 -7.2694 0.10000E+01 0.0000 82 NaOH,aq 0.13878E-12 -12.8577 0.13878E-12 -12.8577 0.10000E+01 0.0000 84 OH- 0.18989E-10 -10.7215 0.14150E-10 -10.8492 0.74518E+00 -0.1277 90 H3PO3,aq 0.27104E-19 -19.5670 0.27104E-19 -19.5670 0.10000E+01 0.0000 92 H3PO4,aq 0.34214E-07 -7.4658 0.34214E-07 -7.4658 0.10000E+01 0.0000 93 H2PO4- 0.29706E-08 -8.5272 0.22282E-08 -8.6520 0.75011E+00 -0.1249 95 H4P2O7,aq 0.15560E-16 -16.8080 0.15560E-16 -16.8080 0.10000E+01 0.0000 96 H3P2O7- 0.65546E-17 -17.1835 0.49052E-17 -17.3093 0.74836E+00 -0.1259 97 H2P2O7-2 0.11412E-17 -17.9426 0.39251E-18 -18.4062 0.34395E+00 -0.4635 100 H2S,aq 0.48162E-01 -1.3173 0.45385E-01 -1.3431 0.94234E+00 -0.0258 101 S2-2 0.10658E-14 -14.9723 0.36658E-15 -15.4358 0.34395E+00 -0.4635 102 S3-2 0.82008E-14 -14.0861 0.28206E-14 -14.5497 0.34395E+00 -0.4635 103 S3- 0.11478E-08 -8.9401 0.85899E-09 -9.0660 0.74836E+00 -0.1259 104 S4-2 0.41682E-13 -13.3800 0.14336E-13 -13.8436 0.34395E+00 -0.4635 105 S5-2 0.14127E-12 -12.8500 0.48589E-13 -13.3135 0.34395E+00 -0.4635 106 SO2,aq 0.27105E-11 -11.5669 0.27105E-11 -11.5669 0.10000E+01 0.0000 107 SO3-2 0.13385E-18 -18.8734 0.47693E-19 -19.3215 0.35632E+00 -0.4482 108 HSO3- 0.16161E-12 -12.7915 0.12094E-12 -12.9174 0.74836E+00 -0.1259 109 HSO4- 0.23721E-08 -8.6249 0.17879E-08 -8.7476 0.75374E+00 -0.1228 111 S2O3-2 0.71588E-13 -13.1452 0.24622E-13 -13.6087 0.34395E+00 -0.4635 112 HS2O3- 0.23826E-12 -12.6230 0.17830E-12 -12.7488 0.74836E+00 -0.1259 113 H2S2O3,aq 0.11576E-12 -12.9364 0.11576E-12 -12.9364 0.10000E+01 0.0000 Charge balance for all species = -.4913E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5332277E-01 0.5138875E+00 0.5064386E+03 0.0000 2 H2O 0.1000000E+01 0.5510107E+02 0.9705672E+06 0.0000 3 Cl- 0.7106773E-01 0.7169500E-01 0.2485226E+04 0.1183 4 SO4-- 0.1324904E-09 -.3449320E-07 -.3239720E-02 -7.5540 5 HCO3- 0.5855441E-05 0.4071853E+00 0.2429229E+05 -3.9642 6 HS- 0.4843352E-06 0.4816227E-01 0.1557369E+04 -5.0480 7 Al+++ 0.4240382E-05 0.4259494E-05 0.1123694E+00 -2.2331 8 H4SiO4 0.1008020E-02 0.1008020E-02 0.9472968E+02 -2.9965 9 Ca++ 0.1785733E-06 0.1856053E-06 0.7273115E-02 -4.4325 10 Mg++ 0.7209964E-10 0.7464339E-10 0.1774337E-05 -7.8313 11 Fe++ 0.2800548E-07 0.2907149E-07 0.1587418E-02 -5.2408 12 K+ 0.1258819E-03 0.1259731E-03 0.4816159E+01 -2.6316 13 Na+ 0.1763566E-01 0.1786818E-01 0.4016424E+03 -0.4872 14 Mn++ 0.1751289E-08 0.2008673E-08 0.1078962E-03 -6.4438 15 F- 0.2338556E-04 0.4852311E-02 0.9013233E+02 -3.3665 16 HPO4-- 0.8623062E-14 0.3718482E-07 0.3489523E-02 -11.7403 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1444352E+01 0.5761232E+00 0.3246278E+00 0.5436013E+00 2 H2O 0.6098072E+02 0.6177424E+02 -.2817481E+00 -.5117668E+00 3 Cl- 0.8037783E-01 0.8037782E-01 0.0000000E+00 0.7781284E-08 4 SO4-- 0.6492497E-01 -.3867060E-07 0.6492557E-01 -.5603222E-06 5 HCO3- 0.9832923E+00 0.4564986E+00 0.0000000E+00 0.5267938E+00 6 HS- 0.2655803E+00 0.5399509E-01 0.1947767E+00 0.1680850E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1130099E-02 0.1102292E-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- 0.5440096E-02 0.5439964E-02 0.0000000E+00 0.1324661E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1058E-15 Mass of aqueous solution: 0.114663E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 13.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1503E-01 -1.823 0.2706 -0.568 1.126 5.969 CO2,gas 0.5268 -0.278 23.18 1.365 96.49 283.7 CH4,gas 0.5316E-06 -6.274 0.8527E-05 -5.069 0.3549E-04 0.3432E-03 H2,gas 0.1135E-06 -6.945 0.2293E-06 -6.640 0.9542E-06 0.7230E-04 H2S,gas 0.1681E-01 -1.774 0.5728 -0.242 2.384 8.557 S2,gas 0.5997E-11 -11.222 0.3845E-09 -9.415 0.1600E-08 0.3721E-08 CO,gas 0.1286E-08 -8.891 0.3601E-07 -7.444 0.1499E-06 0.7978E-06 SO3,gas 0.3200E-30 -30.495 0.2562E-28 -28.591 0.1066E-27 0.1986E-27 SO2,gas 0.1310E-12 -12.883 0.8389E-11 -11.076 0.3491E-10 0.8126E-10 HF,gas 0.1325E-06 -6.878 0.2649E-05 -5.577 0.1103E-04 0.8219E-04 HCl,gas 0.7781E-08 -8.109 0.2837E-06 -6.547 0.1181E-05 0.4828E-05 quartz 0.1102E-01 -1.958 0.6623 -0.179 7.368 0.2501 sulfur 0.2597 -0.586 8.326 0.920 92.63 4.028 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 0.9430E+00 0.4715E+02 0.8707 1.613 CH4,gas 0.9517E-06 0.4758E-04 1.0375 -4.307 H2,gas 0.2032E-06 0.1016E-04 1.0270 -4.982 H2S,gas 0.3009E-01 0.1504E+01 0.8293 0.096 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2302E-08 0.1151E-06 1.0000 -6.939 SO3,gas 0.5729E-30 0.2864E-28 1.0000 -28.543 SO2,gas 0.2344E-12 0.1172E-10 1.0000 -10.931 HF,gas 0.2371E-06 0.1186E-04 1.0000 -4.926 HCl,gas 0.1393E-07 0.6965E-06 1.0000 -6.157 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: 2.036850 % Solid products produced: Mass = 8.988312 g Volume = 4.278184 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: 13.5999900 moles log = 1.1335 Original solution: 1000.0103000 g Original solution / Rock added: 73.53 (Water/Rock Ratio), log = 1.8665 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 0.00000E+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 0.00000E+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 0.00000E+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 -0.75827E-12 172 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 69 diamond -3.10 -4.10 -1.00 -0.285 0.17038E+04 89 graphite -3.55 -4.10 -0.55 -0.158 0.94608E+03 92 halite 1.57 -3.15 -4.73 -2.364 0.80739E+04 145 pyrite -21.25 -22.23 -0.98 -0.230 0.16722E+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 -19.77 -3.22 -0.358 0.54974E+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: 0.4000000 MOLES Current total amount of reactant added: 13.5999900 MOLES New total amount of reactant added: 13.9999900 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 = 22 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 13.9999900 Water: Moles liquid = 0.6259E+02 kg liquid = 0.1128E+01 Moles total = 0.6131E+02 kg total = 0.1104E+01 Activity = 0.9919 Stoichiometric ionic strength = .2781033E+00 Osmotic coef. = 0.9148 True ionic strength = .7276305E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8274E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.55083E-01 -1.2590 0.41756E-01 -1.3793 0.75806E+00 -0.1203 2 H2O 0.99185E+00 -0.0036 0.99185E+00 -0.0036 3 Cl- 0.72721E-01 -1.1383 0.54305E-01 -1.2652 0.74677E+00 -0.1268 4 SO4-- 0.12105E-09 -9.9170 0.41501E-10 -10.3819 0.34284E+00 -0.4649 5 HCO3- 0.56887E-05 -5.2450 0.42637E-05 -5.3702 0.74950E+00 -0.1252 6 HS- 0.47670E-06 -6.3218 0.35611E-06 -6.4484 0.74704E+00 -0.1267 7 Al+++ 0.42165E-05 -5.3750 0.37874E-06 -6.4217 0.89822E-01 -1.0466 8 H4SiO4 0.10080E-02 -2.9965 0.10080E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.17744E-06 -6.7509 0.59682E-07 -7.2242 0.33635E+00 -0.4732 10 Mg++ 0.71648E-10 -10.1448 0.23823E-10 -10.6230 0.33250E+00 -0.4782 11 Fe++ 0.27829E-07 -7.5555 0.92785E-08 -8.0325 0.33341E+00 -0.4770 12 K+ 0.12515E-03 -3.9026 0.93843E-04 -4.0276 0.74985E+00 -0.1250 13 Na+ 0.17529E-01 -1.7562 0.13081E-01 -1.8833 0.74627E+00 -0.1271 14 Mn++ 0.17380E-08 -8.7600 0.58067E-09 -9.2361 0.33411E+00 -0.4761 15 F- 0.23267E-04 -4.6333 0.17291E-04 -4.7622 0.74313E+00 -0.1289 16 HPO4-- 0.81516E-14 -14.0888 0.27957E-14 -14.5535 0.34296E+00 -0.4648 17 SiF6-2 0.78816E-12 -12.1034 0.26878E-12 -12.5706 0.34102E+00 -0.4672 18 HSiO3- 0.30432E-10 -10.5167 0.22726E-10 -10.6435 0.74677E+00 -0.1268 19 Ca(HSiO3)+ 0.41170E-16 -16.3854 0.30888E-16 -16.5102 0.75026E+00 -0.1248 20 Mg(HSiO3)+ 0.20452E-19 -19.6893 0.15344E-19 -19.8141 0.75026E+00 -0.1248 21 NaHSiO3,aq 0.48082E-11 -11.3180 0.48082E-11 -11.3180 0.10000E+01 0.0000 22 AlO+ 0.39067E-10 -10.4082 0.29310E-10 -10.5330 0.75026E+00 -0.1248 23 AlOH+2 0.18196E-07 -7.7400 0.60942E-08 -8.2151 0.33492E+00 -0.4751 24 HAlO2,aq 0.13865E-12 -12.8581 0.13865E-12 -12.8581 0.10000E+01 0.0000 25 AlO2- 0.98851E-17 -17.0050 0.73501E-17 -17.1337 0.74355E+00 -0.1287 26 CH4,aq 0.37412E-07 -7.4270 0.35249E-07 -7.4529 0.94220E+00 -0.0259 27 C2H6,aq 0.28016E-16 -16.5526 0.26397E-16 -16.5784 0.94220E+00 -0.0259 31 CO,aq 0.78170E-10 -10.1070 0.78170E-10 -10.1070 0.10000E+01 0.0000 32 CO2,aq 0.40708E+00 -0.3903 0.38355E+00 -0.4162 0.94220E+00 -0.0259 33 CO3-2 0.26153E-13 -13.5825 0.89189E-14 -14.0497 0.34102E+00 -0.4672 34 CaCO3,aq 0.66744E-17 -17.1756 0.66744E-17 -17.1756 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.86577E-11 -11.0626 0.64955E-11 -11.1874 0.75026E+00 -0.1248 36 CaCl+ 0.69910E-08 -8.1555 0.52450E-08 -8.2803 0.75026E+00 -0.1248 37 CaCl2,aq 0.67670E-10 -10.1696 0.67670E-10 -10.1696 0.10000E+01 0.0000 38 CaF+ 0.20082E-10 -10.6972 0.15067E-10 -10.8220 0.75026E+00 -0.1248 39 CaOH+ 0.13467E-15 -15.8707 0.10103E-15 -15.9955 0.75026E+00 -0.1248 40 CaSO4,aq 0.78652E-15 -15.1043 0.78652E-15 -15.1043 0.10000E+01 0.0000 41 HCl,aq 0.41553E-03 -3.3814 0.41553E-03 -3.3814 0.10000E+01 0.0000 45 HF,aq 0.49426E-02 -2.3060 0.49426E-02 -2.3060 0.10000E+01 0.0000 46 HF2- 0.38639E-07 -7.4130 0.28854E-07 -7.5398 0.74677E+00 -0.1268 47 Fe+3 0.38744E-17 -17.4118 0.35073E-18 -18.4550 0.90526E-01 -1.0432 48 FeCl+ 0.10630E-08 -8.9735 0.79755E-09 -9.0982 0.75026E+00 -0.1248 49 FeCl2,aq 0.13712E-14 -14.8629 0.13712E-14 -14.8629 0.10000E+01 0.0000 50 FeCl+2 0.40632E-17 -17.3911 0.13609E-17 -17.8662 0.33492E+00 -0.4751 51 FeF+ 0.10927E-10 -10.9615 0.81984E-11 -11.0863 0.75026E+00 -0.1248 52 FeF+2 0.16138E-15 -15.7922 0.54049E-16 -16.2672 0.33492E+00 -0.4751 54 FeOH+ 0.95622E-14 -14.0194 0.71741E-14 -14.1442 0.75026E+00 -0.1248 56 FeO+ 0.25425E-18 -18.5947 0.19076E-18 -18.7195 0.75026E+00 -0.1248 57 FeOH+2 0.45417E-17 -17.3428 0.15211E-17 -17.8178 0.33492E+00 -0.4751 60 H2,aq 0.85406E-08 -8.0685 0.80469E-08 -8.0944 0.94220E+00 -0.0259 61 KCl,aq 0.92364E-07 -7.0345 0.92364E-07 -7.0345 0.10000E+01 0.0000 62 KHSO4,aq 0.45980E-15 -15.3374 0.45980E-15 -15.3374 0.10000E+01 0.0000 63 KOH,aq 0.95195E-15 -15.0214 0.95195E-15 -15.0214 0.10000E+01 0.0000 64 KSO4- 0.80929E-13 -13.0919 0.60435E-13 -13.2187 0.74677E+00 -0.1268 66 Mg(HCO3)+ 0.35313E-14 -14.4521 0.26494E-14 -14.5769 0.75026E+00 -0.1248 67 MgCl+ 0.25292E-11 -11.5970 0.18976E-11 -11.7218 0.75026E+00 -0.1248 68 MgF+ 0.29694E-13 -13.5273 0.22278E-13 -13.6521 0.75026E+00 -0.1248 69 MgOH+ 0.29745E-18 -18.5266 0.22317E-18 -18.6514 0.75026E+00 -0.1248 71 MnF+ 0.22541E-12 -12.6470 0.16911E-12 -12.7718 0.75026E+00 -0.1248 73 MnOH+ 0.55591E-16 -16.2550 0.41708E-16 -16.3798 0.75026E+00 -0.1248 78 MnCl+ 0.25882E-09 -9.5870 0.19418E-09 -9.7118 0.75026E+00 -0.1248 79 MnSO4,aq 0.69570E-17 -17.1576 0.69570E-17 -17.1576 0.10000E+01 0.0000 80 NaCl,aq 0.23543E-03 -3.6281 0.23543E-03 -3.6281 0.10000E+01 0.0000 81 NaF,aq 0.52955E-07 -7.2761 0.52955E-07 -7.2761 0.10000E+01 0.0000 82 NaOH,aq 0.13350E-12 -12.8745 0.13350E-12 -12.8745 0.10000E+01 0.0000 84 OH- 0.18458E-10 -10.7338 0.13724E-10 -10.8625 0.74355E+00 -0.1287 90 H3PO3,aq 0.27348E-19 -19.5631 0.27348E-19 -19.5631 0.10000E+01 0.0000 92 H3PO4,aq 0.34092E-07 -7.4673 0.34092E-07 -7.4673 0.10000E+01 0.0000 93 H2PO4- 0.28769E-08 -8.5411 0.21535E-08 -8.6669 0.74853E+00 -0.1258 95 H4P2O7,aq 0.15449E-16 -16.8111 0.15449E-16 -16.8111 0.10000E+01 0.0000 96 H3P2O7- 0.63255E-17 -17.1989 0.47237E-17 -17.3257 0.74677E+00 -0.1268 97 H2P2O7-2 0.10750E-17 -17.9686 0.36661E-18 -18.4358 0.34102E+00 -0.4672 100 H2S,aq 0.48777E-01 -1.3118 0.45957E-01 -1.3376 0.94220E+00 -0.0259 101 S2-2 0.10240E-14 -14.9897 0.34920E-15 -15.4569 0.34102E+00 -0.4672 102 S3-2 0.78789E-14 -14.1035 0.26869E-14 -14.5708 0.34102E+00 -0.4672 103 S3- 0.11227E-08 -8.9497 0.83837E-09 -9.0766 0.74677E+00 -0.1268 104 S4-2 0.40046E-13 -13.3974 0.13657E-13 -13.8647 0.34102E+00 -0.4672 105 S5-2 0.13572E-12 -12.8673 0.46285E-13 -13.3346 0.34102E+00 -0.4672 106 SO2,aq 0.26434E-11 -11.5778 0.26434E-11 -11.5778 0.10000E+01 0.0000 107 SO3-2 0.12379E-18 -18.9073 0.43754E-19 -19.3590 0.35347E+00 -0.4516 108 HSO3- 0.15319E-12 -12.8148 0.11439E-12 -12.9416 0.74677E+00 -0.1268 109 HSO4- 0.22202E-08 -8.6536 0.16701E-08 -8.7773 0.75221E+00 -0.1237 111 S2O3-2 0.66238E-13 -13.1789 0.22589E-13 -13.6461 0.34102E+00 -0.4672 112 HS2O3- 0.22584E-12 -12.6462 0.16865E-12 -12.7730 0.74677E+00 -0.1268 113 H2S2O3,aq 0.11290E-12 -12.9473 0.11290E-12 -12.9473 0.10000E+01 0.0000 Charge balance for all species = -.4884E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5508292E-01 0.5162961E+00 0.5087737E+03 0.0000 2 H2O 0.1000000E+01 0.5510117E+02 0.9704954E+06 0.0000 3 Cl- 0.7272070E-01 0.7337176E-01 0.2543156E+04 0.1141 4 SO4-- 0.1210529E-09 -.3652065E-07 -.3429884E-02 -7.6234 5 HCO3- 0.5688725E-05 0.4070840E+00 0.2428440E+05 -3.9909 6 HS- 0.4766980E-06 0.4877720E-01 0.1577134E+04 -5.0691 7 Al+++ 0.4216539E-05 0.4234774E-05 0.1117088E+00 -2.2838 8 H4SiO4 0.1008001E-02 0.1008001E-02 0.9472075E+02 -2.9965 9 Ca++ 0.1774407E-06 0.1845281E-06 0.7230356E-02 -4.4656 10 Mg++ 0.7164775E-10 0.7421019E-10 0.1763906E-05 -7.8644 11 Fe++ 0.2782880E-07 0.2890277E-07 0.1578085E-02 -5.2740 12 K+ 0.1251496E-03 0.1252420E-03 0.4787845E+01 -2.6483 13 Na+ 0.1752900E-01 0.1776448E-01 0.3992811E+03 -0.5041 14 Mn++ 0.1737972E-08 0.1997016E-08 0.1072619E-03 -6.4775 15 F- 0.2326747E-04 0.4966029E-02 0.9223767E+02 -3.3829 16 HPO4-- 0.8151590E-14 0.3696902E-07 0.3469008E-02 -11.7950 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1487422E+01 0.5822024E+00 0.3341781E+00 0.5710419E+00 2 H2O 0.6130820E+02 0.6213495E+02 -.2893752E+00 -.5373778E+00 3 Cl- 0.8273783E-01 0.8273782E-01 0.0000000E+00 0.8605340E-08 4 SO4-- 0.6683497E-01 -.4118259E-07 0.6683563E-01 -.6174719E-06 5 HCO3- 0.1012212E+01 0.4590491E+00 0.0000000E+00 0.5531633E+00 6 HS- 0.2733903E+00 0.5500372E-01 0.2005069E+00 0.1787970E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1136675E-02 0.1101635E-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- 0.5600096E-02 0.5599954E-02 0.0000000E+00 0.1424333E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8720E-16 Mass of aqueous solution: 0.115341E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 13.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1578E-01 -1.802 0.2843 -0.546 1.126 6.270 CO2,gas 0.5532 -0.257 24.34 1.386 96.46 297.9 CH4,gas 0.5870E-06 -6.231 0.9415E-05 -5.026 0.3730E-04 0.3789E-03 H2,gas 0.1207E-06 -6.918 0.2439E-06 -6.613 0.9663E-06 0.7691E-04 H2S,gas 0.1788E-01 -1.748 0.6093 -0.215 2.414 9.102 S2,gas 0.6300E-11 -11.201 0.4039E-09 -9.394 0.1600E-08 0.3909E-08 CO,gas 0.1367E-08 -8.864 0.3829E-07 -7.417 0.1517E-06 0.8483E-06 SO3,gas 0.3238E-30 -30.490 0.2592E-28 -28.586 0.1027E-27 0.2009E-27 SO2,gas 0.1342E-12 -12.872 0.8594E-11 -11.066 0.3405E-10 0.8325E-10 HF,gas 0.1424E-06 -6.846 0.2849E-05 -5.545 0.1129E-04 0.8838E-04 HCl,gas 0.8605E-08 -8.065 0.3138E-06 -6.503 0.1243E-05 0.5340E-05 quartz 0.1102E-01 -1.958 0.6619 -0.179 7.169 0.2499 sulfur 0.2673 -0.573 8.571 0.933 92.83 4.147 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 0.9426E+00 0.4713E+02 0.8707 1.613 CH4,gas 0.1000E-05 0.5001E-04 1.0375 -4.285 H2,gas 0.2057E-06 0.1029E-04 1.0270 -4.976 H2S,gas 0.3047E-01 0.1523E+01 0.8293 0.102 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2330E-08 0.1165E-06 1.0000 -6.934 SO3,gas 0.5517E-30 0.2758E-28 1.0000 -28.559 SO2,gas 0.2286E-12 0.1143E-10 1.0000 -10.942 HF,gas 0.2427E-06 0.1214E-04 1.0000 -4.916 HCl,gas 0.1466E-07 0.7332E-06 1.0000 -6.135 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: 2.124647 % Solid products produced: Mass = 9.232863 g Volume = 4.396537 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: 13.9999900 moles log = 1.1461 Original solution: 1000.0103000 g Original solution / Rock added: 71.43 (Water/Rock Ratio), log = 1.8539 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 0.00000E+00 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 -0.15165E-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 -0.60662E-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 0.26539E-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 69 diamond -3.10 -4.09 -0.99 -0.282 0.16855E+04 89 graphite -3.55 -4.09 -0.54 -0.155 0.92777E+03 92 halite 1.57 -3.15 -4.72 -2.362 0.80645E+04 145 pyrite -21.25 -22.25 -1.01 -0.237 0.17195E+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 -19.85 -3.30 -0.367 0.56361E+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: 0.4000000 MOLES Current total amount of reactant added: 13.9999900 MOLES New total amount of reactant added: 14.3999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 14.3999900 Water: Moles liquid = 0.6296E+02 kg liquid = 0.1134E+01 Moles total = 0.6164E+02 kg total = 0.1110E+01 Activity = 0.9918 Stoichiometric ionic strength = .2791930E+00 Osmotic coef. = 0.9148 True ionic strength = .7439623E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8510E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.56822E-01 -1.2455 0.42995E-01 -1.3666 0.75665E+00 -0.1211 2 H2O 0.99185E+00 -0.0036 0.99185E+00 -0.0036 3 Cl- 0.74354E-01 -1.1287 0.55411E-01 -1.2564 0.74522E+00 -0.1277 4 SO4-- 0.11105E-09 -9.9545 0.37762E-10 -10.4229 0.34003E+00 -0.4685 5 HCO3- 0.55338E-05 -5.2570 0.41393E-05 -5.3831 0.74799E+00 -0.1261 6 HS- 0.46951E-06 -6.3284 0.35002E-06 -6.4559 0.74550E+00 -0.1276 7 Al+++ 0.41929E-05 -5.3775 0.36954E-06 -6.4323 0.88135E-01 -1.0548 8 H4SiO4 0.10080E-02 -2.9965 0.10080E-02 -2.9965 0.10000E+01 0.0000 9 Ca++ 0.17632E-06 -6.7537 0.58804E-07 -7.2306 0.33350E+00 -0.4769 10 Mg++ 0.71202E-10 -10.1475 0.23471E-10 -10.6295 0.32964E+00 -0.4820 11 Fe++ 0.27655E-07 -7.5582 0.91412E-08 -8.0390 0.33055E+00 -0.4808 12 K+ 0.12443E-03 -3.9051 0.93113E-04 -4.0310 0.74834E+00 -0.1259 13 Na+ 0.17424E-01 -1.7589 0.12976E-01 -1.8869 0.74472E+00 -0.1280 14 Mn++ 0.17249E-08 -8.7632 0.57137E-09 -9.2431 0.33125E+00 -0.4798 15 F- 0.23161E-04 -4.6352 0.17175E-04 -4.7651 0.74156E+00 -0.1299 16 HPO4-- 0.77235E-14 -14.1122 0.26272E-14 -14.5805 0.34015E+00 -0.4683 17 SiF6-2 0.85800E-12 -12.0665 0.29018E-12 -12.5373 0.33821E+00 -0.4708 18 HSiO3- 0.29616E-10 -10.5285 0.22071E-10 -10.6562 0.74522E+00 -0.1277 19 Ca(HSiO3)+ 0.39475E-16 -16.4037 0.29557E-16 -16.5293 0.74875E+00 -0.1257 20 Mg(HSiO3)+ 0.19608E-19 -19.7076 0.14682E-19 -19.8332 0.74875E+00 -0.1257 21 NaHSiO3,aq 0.46319E-11 -11.3342 0.46319E-11 -11.3342 0.10000E+01 0.0000 22 AlO+ 0.36026E-10 -10.4434 0.26975E-10 -10.5690 0.74875E+00 -0.1257 23 AlOH+2 0.17391E-07 -7.7597 0.57749E-08 -8.2385 0.33207E+00 -0.4788 24 HAlO2,aq 0.12392E-12 -12.9068 0.12392E-12 -12.9068 0.10000E+01 0.0000 25 AlO2- 0.85990E-17 -17.0656 0.63803E-17 -17.1952 0.74197E+00 -0.1296 26 CH4,aq 0.39239E-07 -7.4063 0.36966E-07 -7.4322 0.94206E+00 -0.0259 27 C2H6,aq 0.30449E-16 -16.5164 0.28685E-16 -16.5424 0.94206E+00 -0.0259 31 CO,aq 0.79082E-10 -10.1019 0.79082E-10 -10.1019 0.10000E+01 0.0000 32 CO2,aq 0.40698E+00 -0.3904 0.38340E+00 -0.4163 0.94206E+00 -0.0259 33 CO3-2 0.24864E-13 -13.6044 0.84091E-14 -14.0753 0.33821E+00 -0.4708 34 CaCO3,aq 0.62003E-17 -17.2076 0.62003E-17 -17.2076 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.82980E-11 -11.0810 0.62132E-11 -11.2067 0.74875E+00 -0.1257 36 CaCl+ 0.70424E-08 -8.1523 0.52731E-08 -8.2779 0.74875E+00 -0.1257 37 CaCl2,aq 0.69416E-10 -10.1585 0.69416E-10 -10.1585 0.10000E+01 0.0000 38 CaF+ 0.19693E-10 -10.7057 0.14746E-10 -10.8313 0.74875E+00 -0.1257 39 CaOH+ 0.12912E-15 -15.8890 0.96680E-16 -16.0147 0.74875E+00 -0.1257 40 CaSO4,aq 0.70512E-15 -15.1517 0.70512E-15 -15.1517 0.10000E+01 0.0000 41 HCl,aq 0.43656E-03 -3.3600 0.43656E-03 -3.3600 0.10000E+01 0.0000 45 HF,aq 0.50551E-02 -2.2963 0.50551E-02 -2.2963 0.10000E+01 0.0000 46 HF2- 0.39335E-07 -7.4052 0.29313E-07 -7.5329 0.74522E+00 -0.1277 47 Fe+3 0.39811E-17 -17.4000 0.35367E-18 -18.4514 0.88836E-01 -1.0514 48 FeCl+ 0.10708E-08 -8.9703 0.80174E-09 -9.0960 0.74875E+00 -0.1257 49 FeCl2,aq 0.14065E-14 -14.8519 0.14065E-14 -14.8519 0.10000E+01 0.0000 50 FeCl+2 0.42165E-17 -17.3750 0.14002E-17 -17.8538 0.33207E+00 -0.4788 51 FeF+ 0.10715E-10 -10.9700 0.80230E-11 -11.0957 0.74875E+00 -0.1257 52 FeF+2 0.16303E-15 -15.7877 0.54137E-16 -16.2665 0.33207E+00 -0.4788 54 FeOH+ 0.91677E-14 -14.0377 0.68643E-14 -14.1634 0.74875E+00 -0.1257 56 FeO+ 0.24231E-18 -18.6156 0.18143E-18 -18.7413 0.74875E+00 -0.1257 57 FeOH+2 0.44860E-17 -17.3481 0.14897E-17 -17.8269 0.33207E+00 -0.4788 60 H2,aq 0.86448E-08 -8.0632 0.81439E-08 -8.0892 0.94206E+00 -0.0259 61 KCl,aq 0.93510E-07 -7.0291 0.93510E-07 -7.0291 0.10000E+01 0.0000 62 KHSO4,aq 0.42743E-15 -15.3691 0.42743E-15 -15.3691 0.10000E+01 0.0000 63 KOH,aq 0.91732E-15 -15.0375 0.91732E-15 -15.0375 0.10000E+01 0.0000 64 KSO4- 0.73214E-13 -13.1354 0.54561E-13 -13.2631 0.74522E+00 -0.1277 66 Mg(HCO3)+ 0.33843E-14 -14.4705 0.25340E-14 -14.5962 0.74875E+00 -0.1257 67 MgCl+ 0.25476E-11 -11.5939 0.19075E-11 -11.7195 0.74875E+00 -0.1257 68 MgF+ 0.29117E-13 -13.5359 0.21802E-13 -13.6615 0.74875E+00 -0.1257 69 MgOH+ 0.28518E-18 -18.5449 0.21353E-18 -18.6705 0.74875E+00 -0.1257 71 MnF+ 0.22075E-12 -12.6561 0.16529E-12 -12.7818 0.74875E+00 -0.1257 73 MnOH+ 0.53231E-16 -16.2738 0.39857E-16 -16.3995 0.74875E+00 -0.1257 78 MnCl+ 0.26038E-09 -9.5844 0.19496E-09 -9.7101 0.74875E+00 -0.1257 79 MnSO4,aq 0.62288E-17 -17.2056 0.62288E-17 -17.2056 0.10000E+01 0.0000 80 NaCl,aq 0.23828E-03 -3.6229 0.23828E-03 -3.6229 0.10000E+01 0.0000 81 NaF,aq 0.52176E-07 -7.2825 0.52176E-07 -7.2825 0.10000E+01 0.0000 82 NaOH,aq 0.12861E-12 -12.8907 0.12861E-12 -12.8907 0.10000E+01 0.0000 84 OH- 0.17964E-10 -10.7456 0.13329E-10 -10.8752 0.74197E+00 -0.1296 90 H3PO3,aq 0.27575E-19 -19.5595 0.27575E-19 -19.5595 0.10000E+01 0.0000 92 H3PO4,aq 0.33966E-07 -7.4690 0.33966E-07 -7.4690 0.10000E+01 0.0000 93 H2PO4- 0.27894E-08 -8.5545 0.20837E-08 -8.6812 0.74701E+00 -0.1267 95 H4P2O7,aq 0.15336E-16 -16.8143 0.15336E-16 -16.8143 0.10000E+01 0.0000 96 H3P2O7- 0.61108E-17 -17.2139 0.45539E-17 -17.3416 0.74522E+00 -0.1277 97 H2P2O7-2 0.10149E-17 -17.9936 0.34325E-18 -18.4644 0.33821E+00 -0.4708 100 H2S,aq 0.49372E-01 -1.3065 0.46511E-01 -1.3324 0.94206E+00 -0.0259 101 S2-2 0.98562E-15 -15.0063 0.33334E-15 -15.4771 0.33821E+00 -0.4708 102 S3-2 0.75837E-14 -14.1201 0.25649E-14 -14.5909 0.33821E+00 -0.4708 103 S3- 0.10992E-08 -8.9589 0.81912E-09 -9.0867 0.74522E+00 -0.1277 104 S4-2 0.38546E-13 -13.4140 0.13037E-13 -13.8848 0.33821E+00 -0.4708 105 S5-2 0.13064E-12 -12.8839 0.44183E-13 -13.3547 0.33821E+00 -0.4708 106 SO2,aq 0.25808E-11 -11.5883 0.25808E-11 -11.5883 0.10000E+01 0.0000 107 SO3-2 0.11488E-18 -18.9398 0.40292E-19 -19.3948 0.35073E+00 -0.4550 108 HSO3- 0.14555E-12 -12.8370 0.10847E-12 -12.9647 0.74522E+00 -0.1277 109 HSO4- 0.20842E-08 -8.6811 0.15647E-08 -8.8056 0.75073E+00 -0.1245 111 S2O3-2 0.61504E-13 -13.2111 0.20801E-13 -13.6819 0.33821E+00 -0.4708 112 HS2O3- 0.21458E-12 -12.6684 0.15991E-12 -12.7961 0.74522E+00 -0.1277 113 H2S2O3,aq 0.11022E-12 -12.9577 0.11022E-12 -12.9577 0.10000E+01 0.0000 Charge balance for all species = -.4856E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5682232E-01 0.5186673E+00 0.5110721E+03 0.0000 2 H2O 0.1000000E+01 0.5510127E+02 0.9704246E+06 0.0000 3 Cl- 0.7435422E-01 0.7502916E-01 0.2600410E+04 0.1102 4 SO4-- 0.1110537E-09 -.3853556E-07 -.3618847E-02 -7.6898 5 HCO3- 0.5533820E-05 0.4069867E+00 0.2427679E+05 -4.0165 6 HS- 0.4695144E-06 0.4937252E-01 0.1596263E+04 -5.0893 7 Al+++ 0.4192912E-05 0.4210339E-05 0.1110560E+00 -2.3326 8 H4SiO4 0.1007983E-02 0.1007983E-02 0.9471199E+02 -2.9965 9 Ca++ 0.1763235E-06 0.1834634E-06 0.7188099E-02 -4.4974 10 Mg++ 0.7120186E-10 0.7378199E-10 0.1753597E-05 -7.8963 11 Fe++ 0.2765451E-07 0.2873600E-07 0.1568862E-02 -5.3058 12 K+ 0.1244258E-03 0.1245193E-03 0.4759863E+01 -2.6644 13 Na+ 0.1742365E-01 0.1766197E-01 0.3969476E+03 -0.5203 14 Mn++ 0.1724894E-08 0.1985493E-08 0.1066350E-03 -6.5099 15 F- 0.2316083E-04 0.5078435E-02 0.9431841E+02 -3.3985 16 HPO4-- 0.7723546E-14 0.3675570E-07 0.3448734E-02 -11.8473 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1530492E+01 0.5882706E+00 0.3437284E+00 0.5984933E+00 2 H2O 0.6163568E+02 0.6249567E+02 -.2970023E+00 -.5629852E+00 3 Cl- 0.8509783E-01 0.8509782E-01 0.0000000E+00 0.9475501E-08 4 SO4-- 0.6874497E-01 -.4370690E-07 0.6874569E-01 -.6774964E-06 5 HCO3- 0.1041132E+01 0.4616029E+00 0.0000000E+00 0.5795294E+00 6 HS- 0.2812003E+00 0.5599814E-01 0.2062371E+00 0.1896509E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1143251E-02 0.1100977E-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- 0.5760096E-02 0.5759943E-02 0.0000000E+00 0.1526785E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.6722E-16 Mass of aqueous solution: 0.116019E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 14.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1654E-01 -1.781 0.2979 -0.526 1.126 6.572 CO2,gas 0.5795 -0.237 25.51 1.407 96.43 312.1 CH4,gas 0.6451E-06 -6.190 0.1035E-04 -4.985 0.3912E-04 0.4165E-03 H2,gas 0.1281E-06 -6.893 0.2587E-06 -6.587 0.9780E-06 0.8158E-04 H2S,gas 0.1896E-01 -1.722 0.6463 -0.190 2.444 9.655 S2,gas 0.6602E-11 -11.180 0.4233E-09 -9.373 0.1601E-08 0.4097E-08 CO,gas 0.1450E-08 -8.839 0.4060E-07 -7.391 0.1535E-06 0.8995E-06 SO3,gas 0.3273E-30 -30.485 0.2621E-28 -28.582 0.9908E-28 0.2031E-27 SO2,gas 0.1373E-12 -12.862 0.8794E-11 -11.056 0.3325E-10 0.8518E-10 HF,gas 0.1527E-06 -6.816 0.3054E-05 -5.515 0.1154E-04 0.9474E-04 HCl,gas 0.9476E-08 -8.023 0.3455E-06 -6.462 0.1306E-05 0.5880E-05 quartz 0.1101E-01 -1.958 0.6615 -0.179 6.979 0.2498 sulfur 0.2750 -0.561 8.816 0.945 93.02 4.265 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 0.9423E+00 0.4711E+02 0.8707 1.613 CH4,gas 0.1049E-05 0.5245E-04 1.0375 -4.264 H2,gas 0.2082E-06 0.1041E-04 1.0270 -4.971 H2S,gas 0.3083E-01 0.1542E+01 0.8293 0.107 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2357E-08 0.1178E-06 1.0000 -6.929 SO3,gas 0.5322E-30 0.2661E-28 1.0000 -28.575 SO2,gas 0.2232E-12 0.1116E-10 1.0000 -10.952 HF,gas 0.2482E-06 0.1241E-04 1.0000 -4.906 HCl,gas 0.1541E-07 0.7703E-06 1.0000 -6.113 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: 2.211263 % Solid products produced: Mass = 9.477414 g Volume = 4.514892 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: 14.3999900 moles log = 1.1584 Original solution: 1000.0103000 g Original solution / Rock added: 69.45 (Water/Rock Ratio), log = 1.8416 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 0.00000E+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 -0.75827E-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 69 diamond -3.10 -4.08 -0.98 -0.279 0.16680E+04 89 graphite -3.55 -4.08 -0.53 -0.152 0.91028E+03 92 halite 1.57 -3.14 -4.72 -2.359 0.80556E+04 145 pyrite -21.25 -22.28 -1.03 -0.243 0.17651E+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 -19.93 -3.38 -0.375 0.57693E+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: 0.4000000 MOLES Current total amount of reactant added: 14.3999900 MOLES New total amount of reactant added: 14.7999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 14.7999900 Water: Moles liquid = 0.6332E+02 kg liquid = 0.1141E+01 Moles total = 0.6196E+02 kg total = 0.1116E+01 Activity = 0.9918 Stoichiometric ionic strength = .2802657E+00 Osmotic coef. = 0.9148 True ionic strength = .7601033E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8746E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.58541E-01 -1.2325 0.44216E-01 -1.3544 0.75529E+00 -0.1219 2 H2O 0.99184E+00 -0.0036 0.99184E+00 -0.0036 3 Cl- 0.75969E-01 -1.1194 0.56500E-01 -1.2479 0.74373E+00 -0.1286 4 SO4-- 0.10227E-09 -9.9903 0.34497E-10 -10.4622 0.33733E+00 -0.4719 5 HCO3- 0.53895E-05 -5.2685 0.40234E-05 -5.3954 0.74653E+00 -0.1270 6 HS- 0.46274E-06 -6.3347 0.34428E-06 -6.4631 0.74401E+00 -0.1284 7 Al+++ 0.41695E-05 -5.3799 0.36077E-06 -6.4428 0.86527E-01 -1.0628 8 H4SiO4 0.10080E-02 -2.9966 0.10080E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.17522E-06 -6.7564 0.57956E-07 -7.2369 0.33076E+00 -0.4805 10 Mg++ 0.70762E-10 -10.1502 0.23130E-10 -10.6358 0.32688E+00 -0.4856 11 Fe++ 0.27483E-07 -7.5609 0.90086E-08 -8.0453 0.32779E+00 -0.4844 12 K+ 0.12371E-03 -3.9076 0.92396E-04 -4.0343 0.74688E+00 -0.1268 13 Na+ 0.17320E-01 -1.7615 0.12872E-01 -1.8903 0.74322E+00 -0.1289 14 Mn++ 0.17120E-08 -8.7665 0.56240E-09 -9.2500 0.32849E+00 -0.4835 15 F- 0.23064E-04 -4.6371 0.17068E-04 -4.7678 0.74003E+00 -0.1308 16 HPO4-- 0.73335E-14 -14.1347 0.24747E-14 -14.6065 0.33745E+00 -0.4718 17 SiF6-2 0.93192E-12 -12.0306 0.31265E-12 -12.5049 0.33549E+00 -0.4743 18 HSiO3- 0.28856E-10 -10.5398 0.21461E-10 -10.6683 0.74373E+00 -0.1286 19 Ca(HSiO3)+ 0.37905E-16 -16.4213 0.28326E-16 -16.5478 0.74730E+00 -0.1265 20 Mg(HSiO3)+ 0.18827E-19 -19.7252 0.14069E-19 -19.8517 0.74730E+00 -0.1265 21 NaHSiO3,aq 0.44680E-11 -11.3499 0.44680E-11 -11.3499 0.10000E+01 0.0000 22 AlO+ 0.33320E-10 -10.4773 0.24900E-10 -10.6038 0.74730E+00 -0.1265 23 AlOH+2 0.16647E-07 -7.7787 0.54822E-08 -8.2610 0.32932E+00 -0.4824 24 HAlO2,aq 0.11124E-12 -12.9538 0.11124E-12 -12.9538 0.10000E+01 0.0000 25 AlO2- 0.75209E-17 -17.1237 0.55688E-17 -17.2542 0.74045E+00 -0.1305 26 CH4,aq 0.41072E-07 -7.3865 0.38686E-07 -7.4124 0.94192E+00 -0.0260 27 C2H6,aq 0.32974E-16 -16.4818 0.31059E-16 -16.5078 0.94192E+00 -0.0260 31 CO,aq 0.79964E-10 -10.0971 0.79964E-10 -10.0971 0.10000E+01 0.0000 32 CO2,aq 0.40689E+00 -0.3905 0.38326E+00 -0.4165 0.94192E+00 -0.0260 33 CO3-2 0.23691E-13 -13.6254 0.79481E-14 -14.0997 0.33549E+00 -0.4743 34 CaCO3,aq 0.57759E-17 -17.2384 0.57759E-17 -17.2384 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.79650E-11 -11.0988 0.59522E-11 -11.2253 0.74730E+00 -0.1265 36 CaCl+ 0.70912E-08 -8.1493 0.52992E-08 -8.2758 0.74730E+00 -0.1265 37 CaCl2,aq 0.71132E-10 -10.1479 0.71132E-10 -10.1479 0.10000E+01 0.0000 38 CaF+ 0.19326E-10 -10.7139 0.14443E-10 -10.8404 0.74730E+00 -0.1265 39 CaOH+ 0.12399E-15 -15.9066 0.92654E-16 -16.0331 0.74730E+00 -0.1265 40 CaSO4,aq 0.63487E-15 -15.1973 0.63487E-15 -15.1973 0.10000E+01 0.0000 41 HCl,aq 0.45778E-03 -3.3393 0.45778E-03 -3.3393 0.10000E+01 0.0000 45 HF,aq 0.51664E-02 -2.2868 0.51664E-02 -2.2868 0.10000E+01 0.0000 46 HF2- 0.40031E-07 -7.3976 0.29772E-07 -7.5262 0.74373E+00 -0.1286 47 Fe+3 0.40858E-17 -17.3887 0.35638E-18 -18.4481 0.87224E-01 -1.0594 48 FeCl+ 0.10781E-08 -8.9673 0.80564E-09 -9.0939 0.74730E+00 -0.1265 49 FeCl2,aq 0.14411E-14 -14.8413 0.14411E-14 -14.8413 0.10000E+01 0.0000 50 FeCl+2 0.43687E-17 -17.3597 0.14387E-17 -17.8420 0.32932E+00 -0.4824 51 FeF+ 0.10515E-10 -10.9782 0.78575E-11 -11.1047 0.74730E+00 -0.1265 52 FeF+2 0.16462E-15 -15.7835 0.54213E-16 -16.2659 0.32932E+00 -0.4824 54 FeOH+ 0.88023E-14 -14.0554 0.65779E-14 -14.1819 0.74730E+00 -0.1265 56 FeO+ 0.23132E-18 -18.6358 0.17286E-18 -18.7623 0.74730E+00 -0.1265 57 FeOH+2 0.44323E-17 -17.3534 0.14596E-17 -17.8358 0.32932E+00 -0.4824 60 H2,aq 0.87458E-08 -8.0582 0.82378E-08 -8.0842 0.94192E+00 -0.0260 61 KCl,aq 0.94616E-07 -7.0240 0.94616E-07 -7.0240 0.10000E+01 0.0000 62 KHSO4,aq 0.39847E-15 -15.3996 0.39847E-15 -15.3996 0.10000E+01 0.0000 63 KOH,aq 0.88513E-15 -15.0530 0.88513E-15 -15.0530 0.10000E+01 0.0000 64 KSO4- 0.66504E-13 -13.1772 0.49461E-13 -13.3057 0.74373E+00 -0.1286 66 Mg(HCO3)+ 0.32482E-14 -14.4884 0.24274E-14 -14.6149 0.74730E+00 -0.1265 67 MgCl+ 0.25650E-11 -11.5909 0.19168E-11 -11.7174 0.74730E+00 -0.1265 68 MgF+ 0.28572E-13 -13.5441 0.21352E-13 -13.6706 0.74730E+00 -0.1265 69 MgOH+ 0.27381E-18 -18.5625 0.20462E-18 -18.6891 0.74730E+00 -0.1265 71 MnF+ 0.21636E-12 -12.6648 0.16168E-12 -12.7913 0.74730E+00 -0.1265 73 MnOH+ 0.51048E-16 -16.2920 0.38148E-16 -16.4185 0.74730E+00 -0.1265 78 MnCl+ 0.26184E-09 -9.5820 0.19567E-09 -9.7085 0.74730E+00 -0.1265 79 MnSO4,aq 0.56009E-17 -17.2517 0.56009E-17 -17.2517 0.10000E+01 0.0000 80 NaCl,aq 0.24102E-03 -3.6179 0.24102E-03 -3.6179 0.10000E+01 0.0000 81 NaF,aq 0.51437E-07 -7.2887 0.51437E-07 -7.2887 0.10000E+01 0.0000 82 NaOH,aq 0.12406E-12 -12.9064 0.12406E-12 -12.9064 0.10000E+01 0.0000 84 OH- 0.17504E-10 -10.7569 0.12961E-10 -10.8874 0.74045E+00 -0.1305 90 H3PO3,aq 0.27788E-19 -19.5561 0.27788E-19 -19.5561 0.10000E+01 0.0000 92 H3PO4,aq 0.33837E-07 -7.4706 0.33837E-07 -7.4706 0.10000E+01 0.0000 93 H2PO4- 0.27075E-08 -8.5674 0.20185E-08 -8.6950 0.74554E+00 -0.1275 95 H4P2O7,aq 0.15220E-16 -16.8176 0.15220E-16 -16.8176 0.10000E+01 0.0000 96 H3P2O7- 0.59089E-17 -17.2285 0.43947E-17 -17.3571 0.74373E+00 -0.1286 97 H2P2O7-2 0.96008E-18 -18.0177 0.32210E-18 -18.4920 0.33549E+00 -0.4743 100 H2S,aq 0.49949E-01 -1.3015 0.47048E-01 -1.3275 0.94192E+00 -0.0260 101 S2-2 0.95031E-15 -15.0221 0.31882E-15 -15.4965 0.33549E+00 -0.4743 102 S3-2 0.73121E-14 -14.1360 0.24532E-14 -14.6103 0.33549E+00 -0.4743 103 S3- 0.10771E-08 -8.9677 0.80108E-09 -9.0963 0.74373E+00 -0.1286 104 S4-2 0.37165E-13 -13.4299 0.12469E-13 -13.9042 0.33549E+00 -0.4743 105 S5-2 0.12596E-12 -12.8998 0.42259E-13 -13.3741 0.33549E+00 -0.4743 106 SO2,aq 0.25222E-11 -11.5982 0.25222E-11 -11.5982 0.10000E+01 0.0000 107 SO3-2 0.10697E-18 -18.9708 0.37233E-19 -19.4291 0.34808E+00 -0.4583 108 HSO3- 0.13860E-12 -12.8583 0.10308E-12 -12.9868 0.74373E+00 -0.1286 109 HSO4- 0.19618E-08 -8.7073 0.14700E-08 -8.8327 0.74930E+00 -0.1253 111 S2O3-2 0.57295E-13 -13.2419 0.19222E-13 -13.7162 0.33549E+00 -0.4743 112 HS2O3- 0.20433E-12 -12.6897 0.15197E-12 -12.8183 0.74373E+00 -0.1286 113 H2S2O3,aq 0.10772E-12 -12.9677 0.10772E-12 -12.9677 0.10000E+01 0.0000 Charge balance for all species = -.4828E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5854136E-01 0.5210021E+00 0.5133350E+03 0.0000 2 H2O 0.1000000E+01 0.5510136E+02 0.9703549E+06 0.0000 3 Cl- 0.7596864E-01 0.7666755E-01 0.2656999E+04 0.1065 4 SO4-- 0.1022658E-09 -.4053850E-07 -.3806662E-02 -7.7534 5 HCO3- 0.5389499E-05 0.4068933E+00 0.2426943E+05 -4.0410 6 HS- 0.4627403E-06 0.4994913E-01 0.1614787E+04 -5.1087 7 Al+++ 0.4169504E-05 0.4186185E-05 0.1104107E+00 -2.3795 8 H4SiO4 0.1007966E-02 0.1007966E-02 0.9470339E+02 -2.9966 9 Ca++ 0.1752212E-06 0.1824108E-06 0.7146336E-02 -4.5281 10 Mg++ 0.7076185E-10 0.7335871E-10 0.1743408E-05 -7.9270 11 Fe++ 0.2748254E-07 0.2857114E-07 0.1559747E-02 -5.3365 12 K+ 0.1237104E-03 0.1238050E-03 0.4732208E+01 -2.6799 13 Na+ 0.1731957E-01 0.1756065E-01 0.3946413E+03 -0.5359 14 Mn++ 0.1712046E-08 0.1974102E-08 0.1060155E-03 -6.5411 15 F- 0.2306433E-04 0.5189551E-02 0.9637500E+02 -3.4134 16 HPO4-- 0.7333500E-14 0.3654484E-07 0.3428696E-02 -11.8976 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1573562E+01 0.5943284E+00 0.3532788E+00 0.6259552E+00 2 H2O 0.6196316E+02 0.6285638E+02 -.3046294E+00 -.5885892E+00 3 Cl- 0.8745783E-01 0.8745781E-01 0.0000000E+00 0.1039209E-07 4 SO4-- 0.7065497E-01 -.4624393E-07 0.7065575E-01 -.7403765E-06 5 HCO3- 0.1070052E+01 0.4641598E+00 0.0000000E+00 0.6058925E+00 6 HS- 0.2890103E+00 0.5697902E-01 0.2119673E+00 0.2006401E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1149828E-02 0.1100319E-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- 0.5920096E-02 0.5919933E-02 0.0000000E+00 0.1631971E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1622E-15 Mass of aqueous solution: 0.116697E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 14.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1730E-01 -1.762 0.3116 -0.506 1.127 6.873 CO2,gas 0.6059 -0.218 26.67 1.426 96.40 326.3 CH4,gas 0.7061E-06 -6.151 0.1133E-04 -4.946 0.4095E-04 0.4559E-03 H2,gas 0.1355E-06 -6.868 0.2737E-06 -6.563 0.9894E-06 0.8630E-04 H2S,gas 0.2006E-01 -1.698 0.6838 -0.165 2.472 10.21 S2,gas 0.6905E-11 -11.161 0.4428E-09 -9.354 0.1601E-08 0.4285E-08 CO,gas 0.1533E-08 -8.814 0.4294E-07 -7.367 0.1552E-06 0.9512E-06 SO3,gas 0.3308E-30 -30.480 0.2648E-28 -28.577 0.9574E-28 0.2052E-27 SO2,gas 0.1403E-12 -12.853 0.8989E-11 -11.046 0.3250E-10 0.8707E-10 HF,gas 0.1632E-06 -6.787 0.3264E-05 -5.486 0.1180E-04 0.1013E-03 HCl,gas 0.1039E-07 -7.983 0.3789E-06 -6.421 0.1370E-05 0.6448E-05 quartz 0.1100E-01 -1.958 0.6611 -0.180 6.800 0.2496 sulfur 0.2826 -0.549 9.061 0.957 93.20 4.384 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 0.9419E+00 0.4710E+02 0.8707 1.613 CH4,gas 0.1098E-05 0.5489E-04 1.0375 -4.245 H2,gas 0.2106E-06 0.1053E-04 1.0270 -4.966 H2S,gas 0.3119E-01 0.1560E+01 0.8293 0.112 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2383E-08 0.1192E-06 1.0000 -6.924 SO3,gas 0.5142E-30 0.2571E-28 1.0000 -28.590 SO2,gas 0.2181E-12 0.1091E-10 1.0000 -10.962 HF,gas 0.2537E-06 0.1269E-04 1.0000 -4.897 HCl,gas 0.1616E-07 0.8078E-06 1.0000 -6.093 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: 2.296723 % Solid products produced: Mass = 9.721966 g Volume = 4.633246 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: 14.7999900 moles log = 1.1703 Original solution: 1000.0103000 g Original solution / Rock added: 67.57 (Water/Rock Ratio), log = 1.8297 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 0.00000E+00 3 CH4,gas 4.54 4.54 0.00 0.000 0.60662E-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 -0.37914E-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 0.00000E+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 69 diamond -3.10 -4.07 -0.97 -0.276 0.16513E+04 89 graphite -3.55 -4.07 -0.52 -0.150 0.89354E+03 92 halite 1.57 -3.14 -4.71 -2.356 0.80471E+04 145 pyrite -21.25 -22.31 -1.06 -0.249 0.18089E+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 -20.00 -3.45 -0.384 0.58972E+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: 0.4000000 MOLES Current total amount of reactant added: 14.7999900 MOLES New total amount of reactant added: 15.1999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 15.1999900 Water: Moles liquid = 0.6368E+02 kg liquid = 0.1147E+01 Moles total = 0.6229E+02 kg total = 0.1122E+01 Activity = 0.9918 Stoichiometric ionic strength = .2813217E+00 Osmotic coef. = 0.9148 True ionic strength = .7760568E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.8982E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.60240E-01 -1.2201 0.45419E-01 -1.3428 0.75397E+00 -0.1226 2 H2O 0.99183E+00 -0.0036 0.99183E+00 -0.0036 3 Cl- 0.77564E-01 -1.1103 0.57575E-01 -1.2398 0.74228E+00 -0.1294 4 SO4-- 0.94505E-10 -10.0245 0.31633E-10 -10.4999 0.33472E+00 -0.4753 5 HCO3- 0.52547E-05 -5.2795 0.39153E-05 -5.4072 0.74511E+00 -0.1278 6 HS- 0.45634E-06 -6.3407 0.33886E-06 -6.4700 0.74256E+00 -0.1293 7 Al+++ 0.41463E-05 -5.3823 0.35240E-06 -6.4530 0.84992E-01 -1.0706 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.17413E-06 -6.7591 0.57136E-07 -7.2431 0.32811E+00 -0.4840 10 Mg++ 0.70328E-10 -10.1529 0.22801E-10 -10.6420 0.32421E+00 -0.4892 11 Fe++ 0.27313E-07 -7.5636 0.88804E-08 -8.0516 0.32514E+00 -0.4879 12 K+ 0.12300E-03 -3.9101 0.91694E-04 -4.0377 0.74546E+00 -0.1276 13 Na+ 0.17217E-01 -1.7640 0.12771E-01 -1.8938 0.74176E+00 -0.1297 14 Mn++ 0.16994E-08 -8.7697 0.55374E-09 -9.2567 0.32584E+00 -0.4870 15 F- 0.22977E-04 -4.6387 0.16970E-04 -4.7703 0.73855E+00 -0.1316 16 HPO4-- 0.69769E-14 -14.1563 0.23362E-14 -14.6315 0.33485E+00 -0.4752 17 SiF6-2 0.10100E-11 -11.9957 0.33621E-12 -12.4734 0.33288E+00 -0.4777 18 HSiO3- 0.28146E-10 -10.5506 0.20892E-10 -10.6800 0.74228E+00 -0.1294 19 Ca(HSiO3)+ 0.36447E-16 -16.4383 0.27185E-16 -16.5657 0.74589E+00 -0.1273 20 Mg(HSiO3)+ 0.18101E-19 -19.7423 0.13501E-19 -19.8696 0.74589E+00 -0.1273 21 NaHSiO3,aq 0.43153E-11 -11.3650 0.43153E-11 -11.3650 0.10000E+01 0.0000 22 AlO+ 0.30903E-10 -10.5100 0.23050E-10 -10.6373 0.74589E+00 -0.1273 23 AlOH+2 0.15958E-07 -7.7970 0.52130E-08 -8.2829 0.32667E+00 -0.4859 24 HAlO2,aq 0.10024E-12 -12.9990 0.10024E-12 -12.9990 0.10000E+01 0.0000 25 AlO2- 0.66111E-17 -17.1797 0.48855E-17 -17.3111 0.73897E+00 -0.1314 26 CH4,aq 0.42907E-07 -7.3675 0.40409E-07 -7.3935 0.94178E+00 -0.0260 27 C2H6,aq 0.35589E-16 -16.4487 0.33517E-16 -16.4747 0.94178E+00 -0.0260 31 CO,aq 0.80818E-10 -10.0925 0.80818E-10 -10.0925 0.10000E+01 0.0000 32 CO2,aq 0.40680E+00 -0.3906 0.38312E+00 -0.4167 0.94178E+00 -0.0260 33 CO3-2 0.22620E-13 -13.6455 0.75296E-14 -14.1232 0.33288E+00 -0.4777 34 CaCO3,aq 0.53944E-17 -17.2681 0.53944E-17 -17.2681 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.76558E-11 -11.1160 0.57103E-11 -11.2433 0.74589E+00 -0.1273 36 CaCl+ 0.71372E-08 -8.1465 0.53235E-08 -8.2738 0.74589E+00 -0.1273 37 CaCl2,aq 0.72818E-10 -10.1378 0.72818E-10 -10.1378 0.10000E+01 0.0000 38 CaF+ 0.18978E-10 -10.7217 0.14156E-10 -10.8491 0.74589E+00 -0.1273 39 CaOH+ 0.11922E-15 -15.9237 0.88922E-16 -16.0510 0.74589E+00 -0.1273 40 CaSO4,aq 0.57392E-15 -15.2412 0.57392E-15 -15.2412 0.10000E+01 0.0000 41 HCl,aq 0.47919E-03 -3.3195 0.47919E-03 -3.3195 0.10000E+01 0.0000 45 HF,aq 0.52763E-02 -2.2777 0.52763E-02 -2.2777 0.10000E+01 0.0000 46 HF2- 0.40725E-07 -7.3901 0.30230E-07 -7.5196 0.74228E+00 -0.1294 47 Fe+3 0.41886E-17 -17.3779 0.35890E-18 -18.4450 0.85685E-01 -1.0671 48 FeCl+ 0.10850E-08 -8.9646 0.80928E-09 -9.0919 0.74589E+00 -0.1273 49 FeCl2,aq 0.14752E-14 -14.8312 0.14752E-14 -14.8312 0.10000E+01 0.0000 50 FeCl+2 0.45195E-17 -17.3449 0.14764E-17 -17.8308 0.32667E+00 -0.4859 51 FeF+ 0.10324E-10 -10.9861 0.77008E-11 -11.1135 0.74589E+00 -0.1273 52 FeF+2 0.16616E-15 -15.7795 0.54280E-16 -16.2654 0.32667E+00 -0.4859 54 FeOH+ 0.84630E-14 -14.0725 0.63124E-14 -14.1998 0.74589E+00 -0.1273 56 FeO+ 0.22119E-18 -18.6552 0.16498E-18 -18.7826 0.74589E+00 -0.1273 57 FeOH+2 0.43805E-17 -17.3585 0.14310E-17 -17.8444 0.32667E+00 -0.4859 60 H2,aq 0.88436E-08 -8.0534 0.83288E-08 -8.0794 0.94178E+00 -0.0260 61 KCl,aq 0.95682E-07 -7.0192 0.95682E-07 -7.0192 0.10000E+01 0.0000 62 KHSO4,aq 0.37248E-15 -15.4289 0.37248E-15 -15.4289 0.10000E+01 0.0000 63 KOH,aq 0.85511E-15 -15.0680 0.85511E-15 -15.0680 0.10000E+01 0.0000 64 KSO4- 0.60636E-13 -13.2173 0.45009E-13 -13.3467 0.74228E+00 -0.1294 66 Mg(HCO3)+ 0.31218E-14 -14.5056 0.23285E-14 -14.6329 0.74589E+00 -0.1273 67 MgCl+ 0.25815E-11 -11.5881 0.19255E-11 -11.7155 0.74589E+00 -0.1273 68 MgF+ 0.28056E-13 -13.5520 0.20926E-13 -13.6793 0.74589E+00 -0.1273 69 MgOH+ 0.26326E-18 -18.5796 0.19636E-18 -18.7069 0.74589E+00 -0.1273 71 MnF+ 0.21220E-12 -12.6733 0.15827E-12 -12.8006 0.74589E+00 -0.1273 73 MnOH+ 0.49022E-16 -16.3096 0.36565E-16 -16.4369 0.74589E+00 -0.1273 78 MnCl+ 0.26321E-09 -9.5797 0.19632E-09 -9.7070 0.74589E+00 -0.1273 79 MnSO4,aq 0.50568E-17 -17.2961 0.50568E-17 -17.2961 0.10000E+01 0.0000 80 NaCl,aq 0.24367E-03 -3.6132 0.24367E-03 -3.6132 0.10000E+01 0.0000 81 NaF,aq 0.50737E-07 -7.2947 0.50737E-07 -7.2947 0.10000E+01 0.0000 82 NaOH,aq 0.11982E-12 -12.9215 0.11982E-12 -12.9215 0.10000E+01 0.0000 84 OH- 0.17074E-10 -10.7677 0.12617E-10 -10.8990 0.73897E+00 -0.1314 90 H3PO3,aq 0.27986E-19 -19.5531 0.27986E-19 -19.5531 0.10000E+01 0.0000 92 H3PO4,aq 0.33706E-07 -7.4723 0.33706E-07 -7.4723 0.10000E+01 0.0000 93 H2PO4- 0.26305E-08 -8.5800 0.19574E-08 -8.7083 0.74411E+00 -0.1284 95 H4P2O7,aq 0.15102E-16 -16.8210 0.15102E-16 -16.8210 0.10000E+01 0.0000 96 H3P2O7- 0.57189E-17 -17.2427 0.42450E-17 -17.3721 0.74228E+00 -0.1294 97 H2P2O7-2 0.90992E-18 -18.0410 0.30289E-18 -18.5187 0.33288E+00 -0.4777 100 H2S,aq 0.50507E-01 -1.2966 0.47567E-01 -1.3227 0.94178E+00 -0.0260 101 S2-2 0.91771E-15 -15.0373 0.30549E-15 -15.5150 0.33288E+00 -0.4777 102 S3-2 0.70613E-14 -14.1511 0.23505E-14 -14.6288 0.33288E+00 -0.4777 103 S3- 0.10564E-08 -8.9762 0.78415E-09 -9.1056 0.74228E+00 -0.1294 104 S4-2 0.35890E-13 -13.4450 0.11947E-13 -13.9227 0.33288E+00 -0.4777 105 S5-2 0.12164E-12 -12.9149 0.40491E-13 -13.3926 0.33288E+00 -0.4777 106 SO2,aq 0.24674E-11 -11.6078 0.24674E-11 -11.6078 0.10000E+01 0.0000 107 SO3-2 0.99900E-19 -19.0004 0.34519E-19 -19.4619 0.34553E+00 -0.4615 108 HSO3- 0.13225E-12 -12.8786 0.98164E-13 -13.0080 0.74228E+00 -0.1294 109 HSO4- 0.18513E-08 -8.7325 0.13846E-08 -8.8587 0.74791E+00 -0.1261 111 S2O3-2 0.53535E-13 -13.2714 0.17821E-13 -13.7491 0.33288E+00 -0.4777 112 HS2O3- 0.19497E-12 -12.7100 0.14472E-12 -12.8395 0.74228E+00 -0.1294 113 H2S2O3,aq 0.10538E-12 -12.9773 0.10538E-12 -12.9773 0.10000E+01 0.0000 Charge balance for all species = -.4801E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6024037E-01 0.5233016E+00 0.5155634E+03 0.0000 2 H2O 0.1000000E+01 0.5510145E+02 0.9702862E+06 0.0000 3 Cl- 0.7756429E-01 0.7828725E-01 0.2712935E+04 0.1030 4 SO4-- 0.9450454E-10 -.4252979E-07 -.3993359E-02 -7.8143 5 HCO3- 0.5254699E-05 0.4068036E+00 0.2426232E+05 -4.0645 6 HS- 0.4563376E-06 0.5050792E-01 0.1632733E+04 -5.1272 7 Al+++ 0.4146316E-05 0.4162306E-05 0.1097730E+00 -2.4247 8 H4SiO4 0.1007949E-02 0.1007949E-02 0.9469494E+02 -2.9966 9 Ca++ 0.1741336E-06 0.1813703E-06 0.7105057E-02 -4.5576 10 Mg++ 0.7032758E-10 0.7294025E-10 0.1733338E-05 -7.9565 11 Fe++ 0.2731284E-07 0.2840816E-07 0.1550738E-02 -5.3660 12 K+ 0.1230031E-03 0.1230988E-03 0.4704873E+01 -2.6949 13 Na+ 0.1721676E-01 0.1746048E-01 0.3923617E+03 -0.5510 14 Mn++ 0.1699421E-08 0.1962841E-08 0.1054031E-03 -6.5712 15 F- 0.2297687E-04 0.5299398E-02 0.9840785E+02 -3.4276 16 HPO4-- 0.6976867E-14 0.3633638E-07 0.3408891E-02 -11.9460 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1616632E+01 0.6003763E+00 0.3628291E+00 0.6534270E+00 2 H2O 0.6229064E+02 0.6321709E+02 -.3122565E+00 -.6141900E+00 3 Cl- 0.8981783E-01 0.8981781E-01 0.0000000E+00 0.1135538E-07 4 SO4-- 0.7256497E-01 -.4879381E-07 0.7256582E-01 -.8060896E-06 5 HCO3- 0.1098972E+01 0.4667198E+00 0.0000000E+00 0.6322526E+00 6 HS- 0.2968203E+00 0.5794699E-01 0.2176975E+00 0.2117584E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1156405E-02 0.1099662E-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- 0.6080096E-02 0.6079922E-02 0.0000000E+00 0.1739845E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1002E-15 Mass of aqueous solution: 0.117375E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 15.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1806E-01 -1.743 0.3253 -0.488 1.127 7.175 CO2,gas 0.6323 -0.199 27.83 1.444 96.37 340.5 CH4,gas 0.7699E-06 -6.114 0.1235E-04 -4.908 0.4277E-04 0.4971E-03 H2,gas 0.1430E-06 -6.845 0.2888E-06 -6.539 0.1000E-05 0.9109E-04 H2S,gas 0.2118E-01 -1.674 0.7216 -0.142 2.499 10.78 S2,gas 0.7208E-11 -11.142 0.4622E-09 -9.335 0.1601E-08 0.4473E-08 CO,gas 0.1617E-08 -8.791 0.4530E-07 -7.344 0.1569E-06 0.1004E-05 SO3,gas 0.3341E-30 -30.476 0.2675E-28 -28.573 0.9264E-28 0.2073E-27 SO2,gas 0.1433E-12 -12.844 0.9179E-11 -11.037 0.3179E-10 0.8891E-10 HF,gas 0.1740E-06 -6.759 0.3480E-05 -5.458 0.1205E-04 0.1080E-03 HCl,gas 0.1136E-07 -7.945 0.4140E-06 -6.383 0.1434E-05 0.7046E-05 quartz 0.1100E-01 -1.959 0.6607 -0.180 6.629 0.2495 sulfur 0.2903 -0.537 9.306 0.969 93.37 4.502 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 0.9416E+00 0.4708E+02 0.8707 1.613 CH4,gas 0.1147E-05 0.5733E-04 1.0375 -4.226 H2,gas 0.2129E-06 0.1065E-04 1.0270 -4.961 H2S,gas 0.3153E-01 0.1577E+01 0.8293 0.116 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2409E-08 0.1204E-06 1.0000 -6.919 SO3,gas 0.4975E-30 0.2488E-28 1.0000 -28.604 SO2,gas 0.2134E-12 0.1067E-10 1.0000 -10.972 HF,gas 0.2591E-06 0.1296E-04 1.0000 -4.888 HCl,gas 0.1691E-07 0.8455E-06 1.0000 -6.073 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: 2.381047 % Solid products produced: Mass = 9.966518 g Volume = 4.751600 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: 15.1999900 moles log = 1.1818 Original solution: 1000.0103000 g Original solution / Rock added: 65.79 (Water/Rock Ratio), log = 1.8182 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 -0.11374E-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 0.60662E-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 -0.34122E-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 69 diamond -3.10 -4.06 -0.96 -0.274 0.16353E+04 89 graphite -3.55 -4.06 -0.51 -0.147 0.87752E+03 92 halite 1.57 -3.13 -4.71 -2.354 0.80390E+04 145 pyrite -21.25 -22.33 -1.08 -0.255 0.18512E+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 -20.07 -3.53 -0.392 0.60203E+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: 0.4000000 MOLES Current total amount of reactant added: 15.1999900 MOLES New total amount of reactant added: 15.5999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 15.5999900 Water: Moles liquid = 0.6405E+02 kg liquid = 0.1154E+01 Moles total = 0.6262E+02 kg total = 0.1128E+01 Activity = 0.9918 Stoichiometric ionic strength = .2823616E+00 Osmotic coef. = 0.9148 True ionic strength = .7918260E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9218E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.61920E-01 -1.2082 0.46606E-01 -1.3316 0.75268E+00 -0.1234 2 H2O 0.99182E+00 -0.0036 0.99182E+00 -0.0036 3 Cl- 0.79141E-01 -1.1016 0.58634E-01 -1.2318 0.74088E+00 -0.1303 4 SO4-- 0.87619E-10 -10.0574 0.29107E-10 -10.5360 0.33221E+00 -0.4786 5 HCO3- 0.51285E-05 -5.2900 0.38143E-05 -5.4186 0.74374E+00 -0.1286 6 HS- 0.45027E-06 -6.3465 0.33373E-06 -6.4766 0.74116E+00 -0.1301 7 Al+++ 0.41234E-05 -5.3847 0.34440E-06 -6.4629 0.83524E-01 -1.0782 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.17306E-06 -6.7618 0.56342E-07 -7.2492 0.32556E+00 -0.4874 10 Mg++ 0.69899E-10 -10.1555 0.22483E-10 -10.6482 0.32164E+00 -0.4926 11 Fe++ 0.27145E-07 -7.5663 0.87563E-08 -8.0577 0.32257E+00 -0.4914 12 K+ 0.12230E-03 -3.9126 0.91005E-04 -4.0409 0.74409E+00 -0.1284 13 Na+ 0.17115E-01 -1.7666 0.12671E-01 -1.8972 0.74035E+00 -0.1306 14 Mn++ 0.16870E-08 -8.7729 0.54537E-09 -9.2633 0.32328E+00 -0.4904 15 F- 0.22897E-04 -4.6402 0.16878E-04 -4.7727 0.73712E+00 -0.1325 16 HPO4-- 0.66497E-14 -14.1772 0.22099E-14 -14.6556 0.33233E+00 -0.4784 17 SiF6-2 0.10923E-11 -11.9616 0.36086E-12 -12.4427 0.33035E+00 -0.4810 18 HSiO3- 0.27481E-10 -10.5610 0.20360E-10 -10.6912 0.74088E+00 -0.1303 19 Ca(HSiO3)+ 0.35089E-16 -16.4548 0.26125E-16 -16.5830 0.74452E+00 -0.1281 20 Mg(HSiO3)+ 0.17426E-19 -19.7588 0.12974E-19 -19.8869 0.74452E+00 -0.1281 21 NaHSiO3,aq 0.41726E-11 -11.3796 0.41726E-11 -11.3796 0.10000E+01 0.0000 22 AlO+ 0.28735E-10 -10.5416 0.21394E-10 -10.6697 0.74452E+00 -0.1281 23 AlOH+2 0.15319E-07 -7.8148 0.49649E-08 -8.3041 0.32411E+00 -0.4893 24 HAlO2,aq 0.90669E-13 -13.0425 0.90669E-13 -13.0425 0.10000E+01 0.0000 25 AlO2- 0.58389E-17 -17.2337 0.43064E-17 -17.3659 0.73754E+00 -0.1322 26 CH4,aq 0.44744E-07 -7.3493 0.42133E-07 -7.3754 0.94165E+00 -0.0261 27 C2H6,aq 0.38290E-16 -16.4169 0.36056E-16 -16.4430 0.94165E+00 -0.0261 31 CO,aq 0.81645E-10 -10.0881 0.81645E-10 -10.0881 0.10000E+01 0.0000 32 CO2,aq 0.40671E+00 -0.3907 0.38298E+00 -0.4168 0.94165E+00 -0.0261 33 CO3-2 0.21639E-13 -13.6648 0.71485E-14 -14.1458 0.33035E+00 -0.4810 34 CaCO3,aq 0.50501E-17 -17.2967 0.50501E-17 -17.2967 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.73680E-11 -11.1326 0.54856E-11 -11.2608 0.74452E+00 -0.1281 36 CaCl+ 0.71808E-08 -8.1438 0.53462E-08 -8.2720 0.74452E+00 -0.1281 37 CaCl2,aq 0.74474E-10 -10.1280 0.74474E-10 -10.1280 0.10000E+01 0.0000 38 CaF+ 0.18648E-10 -10.7294 0.13884E-10 -10.8575 0.74452E+00 -0.1281 39 CaOH+ 0.11478E-15 -15.9401 0.85453E-16 -16.0683 0.74452E+00 -0.1281 40 CaSO4,aq 0.52076E-15 -15.2834 0.52076E-15 -15.2834 0.10000E+01 0.0000 41 HCl,aq 0.50076E-03 -3.3004 0.50076E-03 -3.3004 0.10000E+01 0.0000 45 HF,aq 0.53850E-02 -2.2688 0.53850E-02 -2.2688 0.10000E+01 0.0000 46 HF2- 0.41418E-07 -7.3828 0.30686E-07 -7.5131 0.74088E+00 -0.1303 47 Fe+3 0.42893E-17 -17.3676 0.36122E-18 -18.4422 0.84214E-01 -1.0746 48 FeCl+ 0.10915E-08 -8.9620 0.81266E-09 -9.0901 0.74452E+00 -0.1281 49 FeCl2,aq 0.15086E-14 -14.8214 0.15086E-14 -14.8214 0.10000E+01 0.0000 50 FeCl+2 0.46691E-17 -17.3308 0.15133E-17 -17.8201 0.32411E+00 -0.4893 51 FeF+ 0.10144E-10 -10.9938 0.75523E-11 -11.1219 0.74452E+00 -0.1281 52 FeF+2 0.16765E-15 -15.7756 0.54337E-16 -16.2649 0.32411E+00 -0.4893 54 FeOH+ 0.81471E-14 -14.0890 0.60657E-14 -14.2171 0.74452E+00 -0.1281 56 FeO+ 0.21181E-18 -18.6740 0.15770E-18 -18.8022 0.74452E+00 -0.1281 57 FeOH+2 0.43305E-17 -17.3635 0.14036E-17 -17.8528 0.32411E+00 -0.4893 60 H2,aq 0.89385E-08 -8.0487 0.84169E-08 -8.0748 0.94165E+00 -0.0261 61 KCl,aq 0.96711E-07 -7.0145 0.96711E-07 -7.0145 0.10000E+01 0.0000 62 KHSO4,aq 0.34905E-15 -15.4571 0.34905E-15 -15.4571 0.10000E+01 0.0000 63 KOH,aq 0.82707E-15 -15.0825 0.82707E-15 -15.0825 0.10000E+01 0.0000 64 KSO4- 0.55481E-13 -13.2559 0.41105E-13 -13.3861 0.74088E+00 -0.1303 66 Mg(HCO3)+ 0.30043E-14 -14.5223 0.22367E-14 -14.6504 0.74452E+00 -0.1281 67 MgCl+ 0.25970E-11 -11.5855 0.19335E-11 -11.7136 0.74452E+00 -0.1281 68 MgF+ 0.27565E-13 -13.5596 0.20523E-13 -13.6878 0.74452E+00 -0.1281 69 MgOH+ 0.25344E-18 -18.5961 0.18869E-18 -18.7243 0.74452E+00 -0.1281 71 MnF+ 0.20825E-12 -12.6814 0.15504E-12 -12.8095 0.74452E+00 -0.1281 73 MnOH+ 0.47138E-16 -16.3266 0.35095E-16 -16.4548 0.74452E+00 -0.1281 78 MnCl+ 0.26449E-09 -9.5776 0.19692E-09 -9.7057 0.74452E+00 -0.1281 79 MnSO4,aq 0.45828E-17 -17.3389 0.45828E-17 -17.3389 0.10000E+01 0.0000 80 NaCl,aq 0.24622E-03 -3.6087 0.24622E-03 -3.6087 0.10000E+01 0.0000 81 NaF,aq 0.50070E-07 -7.3004 0.50070E-07 -7.3004 0.10000E+01 0.0000 82 NaOH,aq 0.11586E-12 -12.9361 0.11586E-12 -12.9361 0.10000E+01 0.0000 84 OH- 0.16671E-10 -10.7780 0.12296E-10 -10.9102 0.73754E+00 -0.1322 90 H3PO3,aq 0.28170E-19 -19.5502 0.28170E-19 -19.5502 0.10000E+01 0.0000 92 H3PO4,aq 0.33572E-07 -7.4740 0.33572E-07 -7.4740 0.10000E+01 0.0000 93 H2PO4- 0.25581E-08 -8.5921 0.19000E-08 -8.7213 0.74273E+00 -0.1292 95 H4P2O7,aq 0.14982E-16 -16.8244 0.14982E-16 -16.8244 0.10000E+01 0.0000 96 H3P2O7- 0.55397E-17 -17.2565 0.41042E-17 -17.3868 0.74088E+00 -0.1303 97 H2P2O7-2 0.86389E-18 -18.0635 0.28539E-18 -18.5446 0.33035E+00 -0.4810 100 H2S,aq 0.51049E-01 -1.2920 0.48070E-01 -1.3181 0.94165E+00 -0.0261 101 S2-2 0.88752E-15 -15.0518 0.29320E-15 -15.5328 0.33035E+00 -0.4810 102 S3-2 0.68290E-14 -14.1656 0.22560E-14 -14.6467 0.33035E+00 -0.4810 103 S3- 0.10369E-08 -8.9843 0.76821E-09 -9.1145 0.74088E+00 -0.1303 104 S4-2 0.34710E-13 -13.4595 0.11467E-13 -13.9406 0.33035E+00 -0.4810 105 S5-2 0.11764E-12 -12.9295 0.38862E-13 -13.4105 0.33035E+00 -0.4810 106 SO2,aq 0.24159E-11 -11.6169 0.24159E-11 -11.6169 0.10000E+01 0.0000 107 SO3-2 0.93565E-19 -19.0289 0.32099E-19 -19.4935 0.34307E+00 -0.4646 108 HSO3- 0.12643E-12 -12.8982 0.93670E-13 -13.0284 0.74088E+00 -0.1303 109 HSO4- 0.17511E-08 -8.7567 0.13074E-08 -8.8836 0.74657E+00 -0.1269 111 S2O3-2 0.50164E-13 -13.2996 0.16572E-13 -13.7806 0.33035E+00 -0.4810 112 HS2O3- 0.18639E-12 -12.7296 0.13810E-12 -12.8598 0.74088E+00 -0.1303 113 H2S2O3,aq 0.10318E-12 -12.9864 0.10318E-12 -12.9864 0.10000E+01 0.0000 Charge balance for all species = -.4773E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6191972E-01 0.5255669E+00 0.5177582E+03 0.0000 2 H2O 0.1000000E+01 0.5510154E+02 0.9702184E+06 0.0000 3 Cl- 0.7914149E-01 0.7988858E-01 0.2768229E+04 0.0997 4 SO4-- 0.8761853E-10 -.4450955E-07 -.4178951E-02 -7.8729 5 HCO3- 0.5128498E-05 0.4067173E+00 0.2425545E+05 -4.0870 6 HS- 0.4502729E-06 0.5104969E-01 0.1650129E+04 -5.1451 7 Al+++ 0.4123350E-05 0.4138697E-05 0.1091425E+00 -2.4683 8 H4SiO4 0.1007932E-02 0.1007932E-02 0.9468664E+02 -2.9966 9 Ca++ 0.1730603E-06 0.1803416E-06 0.7064253E-02 -4.5861 10 Mg++ 0.6989892E-10 0.7252654E-10 0.1723384E-05 -7.9850 11 Fe++ 0.2714536E-07 0.2824704E-07 0.1541832E-02 -5.3946 12 K+ 0.1223038E-03 0.1224006E-03 0.4677854E+01 -2.7094 13 Na+ 0.1711517E-01 0.1736144E-01 0.3901084E+03 -0.5656 14 Mn++ 0.1687012E-08 0.1951708E-08 0.1047978E-03 -6.6002 15 F- 0.2289749E-04 0.5408000E-02 0.1004174E+03 -3.4411 16 HPO4-- 0.6649746E-14 0.3613028E-07 0.3389314E-02 -11.9925 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1659702E+01 0.6064147E+00 0.3723795E+00 0.6809082E+00 2 H2O 0.6261812E+02 0.6357779E+02 -.3198836E+00 -.6397876E+00 3 Cl- 0.9217783E-01 0.9217781E-01 0.0000000E+00 0.1236562E-07 4 SO4-- 0.7447497E-01 -.5135644E-07 0.7447589E-01 -.8746104E-06 5 HCO3- 0.1127892E+01 0.4692825E+00 0.0000000E+00 0.6586098E+00 6 HS- 0.3046303E+00 0.5890264E-01 0.2234277E+00 0.2229997E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1162982E-02 0.1099004E-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- 0.6240096E-02 0.6239911E-02 0.0000000E+00 0.1850362E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8668E-16 Mass of aqueous solution: 0.118053E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 15.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1882E-01 -1.725 0.3390 -0.470 1.127 7.477 CO2,gas 0.6586 -0.181 28.99 1.462 96.35 354.7 CH4,gas 0.8365E-06 -6.078 0.1342E-04 -4.872 0.4460E-04 0.5401E-03 H2,gas 0.1506E-06 -6.822 0.3042E-06 -6.517 0.1011E-05 0.9592E-04 H2S,gas 0.2230E-01 -1.652 0.7600 -0.119 2.526 11.35 S2,gas 0.7512E-11 -11.124 0.4816E-09 -9.317 0.1601E-08 0.4661E-08 CO,gas 0.1703E-08 -8.769 0.4769E-07 -7.322 0.1585E-06 0.1057E-05 SO3,gas 0.3373E-30 -30.472 0.2701E-28 -28.569 0.8977E-28 0.2093E-27 SO2,gas 0.1462E-12 -12.835 0.9366E-11 -11.028 0.3113E-10 0.9072E-10 HF,gas 0.1850E-06 -6.733 0.3701E-05 -5.432 0.1230E-04 0.1148E-03 HCl,gas 0.1237E-07 -7.908 0.4509E-06 -6.346 0.1499E-05 0.7673E-05 quartz 0.1099E-01 -1.959 0.6603 -0.180 6.466 0.2494 sulfur 0.2979 -0.526 9.551 0.980 93.53 4.621 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 0.9412E+00 0.4706E+02 0.8707 1.613 CH4,gas 0.1196E-05 0.5978E-04 1.0375 -4.207 H2,gas 0.2152E-06 0.1076E-04 1.0270 -4.957 H2S,gas 0.3187E-01 0.1593E+01 0.8293 0.121 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2433E-08 0.1217E-06 1.0000 -6.915 SO3,gas 0.4821E-30 0.2410E-28 1.0000 -28.618 SO2,gas 0.2089E-12 0.1045E-10 1.0000 -10.981 HF,gas 0.2644E-06 0.1322E-04 1.0000 -4.879 HCl,gas 0.1767E-07 0.8836E-06 1.0000 -6.054 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: 2.464257 % Solid products produced: Mass = 10.211070 g Volume = 4.869955 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: 15.5999900 moles log = 1.1931 Original solution: 1000.0103000 g Original solution / Rock added: 64.10 (Water/Rock Ratio), log = 1.8069 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 0.45496E-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 -0.37914E-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 0.00000E+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 69 diamond -3.10 -4.05 -0.95 -0.271 0.16199E+04 89 graphite -3.55 -4.05 -0.50 -0.144 0.86216E+03 92 halite 1.57 -3.13 -4.70 -2.352 0.80313E+04 145 pyrite -21.25 -22.36 -1.11 -0.261 0.18921E+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 -20.14 -3.60 -0.399 0.61389E+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: 0.4000000 MOLES Current total amount of reactant added: 15.5999900 MOLES New total amount of reactant added: 15.9999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 15.9999900 Water: Moles liquid = 0.6441E+02 kg liquid = 0.1160E+01 Moles total = 0.6295E+02 kg total = 0.1134E+01 Activity = 0.9918 Stoichiometric ionic strength = .2833859E+00 Osmotic coef. = 0.9148 True ionic strength = .8074141E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9454E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.63580E-01 -1.1967 0.47776E-01 -1.3208 0.75144E+00 -0.1241 2 H2O 0.99181E+00 -0.0036 0.99181E+00 -0.0036 3 Cl- 0.80701E-01 -1.0931 0.59680E-01 -1.2242 0.73952E+00 -0.1310 4 SO4-- 0.81483E-10 -10.0889 0.26871E-10 -10.5707 0.32978E+00 -0.4818 5 HCO3- 0.50101E-05 -5.3002 0.37195E-05 -5.4295 0.74241E+00 -0.1294 6 HS- 0.44452E-06 -6.3521 0.32886E-06 -6.4830 0.73981E+00 -0.1309 7 Al+++ 0.41006E-05 -5.3872 0.33675E-06 -6.4727 0.82121E-01 -1.0855 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.17200E-06 -6.7645 0.55573E-07 -7.2551 0.32310E+00 -0.4907 10 Mg++ 0.69476E-10 -10.1582 0.22174E-10 -10.6542 0.31916E+00 -0.4960 11 Fe++ 0.26980E-07 -7.5690 0.86361E-08 -8.0637 0.32009E+00 -0.4947 12 K+ 0.12161E-03 -3.9150 0.90328E-04 -4.0442 0.74275E+00 -0.1292 13 Na+ 0.17015E-01 -1.7692 0.12574E-01 -1.9005 0.73898E+00 -0.1314 14 Mn++ 0.16748E-08 -8.7760 0.53728E-09 -9.2698 0.32080E+00 -0.4938 15 F- 0.22825E-04 -4.6416 0.16793E-04 -4.7749 0.73573E+00 -0.1333 16 HPO4-- 0.63488E-14 -14.1973 0.20945E-14 -14.6789 0.32990E+00 -0.4816 17 SiF6-2 0.11790E-11 -11.9285 0.38662E-12 -12.4127 0.32792E+00 -0.4842 18 HSiO3- 0.26857E-10 -10.5709 0.19861E-10 -10.7020 0.73952E+00 -0.1310 19 Ca(HSiO3)+ 0.33823E-16 -16.4708 0.25137E-16 -16.5997 0.74319E+00 -0.1289 20 Mg(HSiO3)+ 0.16795E-19 -19.7748 0.12482E-19 -19.9037 0.74319E+00 -0.1289 21 NaHSiO3,aq 0.40390E-11 -11.3937 0.40390E-11 -11.3937 0.10000E+01 0.0000 22 AlO+ 0.26785E-10 -10.5721 0.19906E-10 -10.7010 0.74319E+00 -0.1289 23 AlOH+2 0.14723E-07 -7.8320 0.47356E-08 -8.3246 0.32164E+00 -0.4926 24 HAlO2,aq 0.82296E-13 -13.0846 0.82296E-13 -13.0846 0.10000E+01 0.0000 25 AlO2- 0.51796E-17 -17.2857 0.38130E-17 -17.4187 0.73615E+00 -0.1330 26 CH4,aq 0.46580E-07 -7.3318 0.43856E-07 -7.3580 0.94152E+00 -0.0262 27 C2H6,aq 0.41074E-16 -16.3864 0.38672E-16 -16.4126 0.94152E+00 -0.0262 31 CO,aq 0.82446E-10 -10.0838 0.82446E-10 -10.0838 0.10000E+01 0.0000 32 CO2,aq 0.40663E+00 -0.3908 0.38285E+00 -0.4170 0.94152E+00 -0.0262 33 CO3-2 0.20738E-13 -13.6832 0.68001E-14 -14.1675 0.32792E+00 -0.4842 34 CaCO3,aq 0.47385E-17 -17.3244 0.47385E-17 -17.3244 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.70996E-11 -11.1488 0.52763E-11 -11.2777 0.74319E+00 -0.1289 36 CaCl+ 0.72219E-08 -8.1413 0.53673E-08 -8.2702 0.74319E+00 -0.1289 37 CaCl2,aq 0.76100E-10 -10.1186 0.76100E-10 -10.1186 0.10000E+01 0.0000 38 CaF+ 0.18334E-10 -10.7367 0.13625E-10 -10.8656 0.74319E+00 -0.1289 39 CaOH+ 0.11063E-15 -15.9561 0.82221E-16 -16.0850 0.74319E+00 -0.1289 40 CaSO4,aq 0.47419E-15 -15.3240 0.47419E-15 -15.3240 0.10000E+01 0.0000 41 HCl,aq 0.52248E-03 -3.2819 0.52248E-03 -3.2819 0.10000E+01 0.0000 45 HF,aq 0.54924E-02 -2.2602 0.54924E-02 -2.2602 0.10000E+01 0.0000 46 HF2- 0.42110E-07 -7.3756 0.31141E-07 -7.5067 0.73952E+00 -0.1310 47 Fe+3 0.43881E-17 -17.3577 0.36337E-18 -18.4397 0.82807E-01 -1.0819 48 FeCl+ 0.10977E-08 -8.9595 0.81580E-09 -9.0884 0.74319E+00 -0.1289 49 FeCl2,aq 0.15414E-14 -14.8121 0.15414E-14 -14.8121 0.10000E+01 0.0000 50 FeCl+2 0.48174E-17 -17.3172 0.15494E-17 -17.8098 0.32164E+00 -0.4926 51 FeF+ 0.99722E-11 -11.0012 0.74112E-11 -11.1301 0.74319E+00 -0.1289 52 FeF+2 0.16909E-15 -15.7719 0.54385E-16 -16.2645 0.32164E+00 -0.4926 54 FeOH+ 0.78524E-14 -14.1050 0.58358E-14 -14.2339 0.74319E+00 -0.1289 56 FeO+ 0.20312E-18 -18.6922 0.15096E-18 -18.8211 0.74319E+00 -0.1289 57 FeOH+2 0.42822E-17 -17.3683 0.13773E-17 -17.8610 0.32164E+00 -0.4926 60 H2,aq 0.90305E-08 -8.0443 0.85024E-08 -8.0705 0.94152E+00 -0.0262 61 KCl,aq 0.97703E-07 -7.0101 0.97703E-07 -7.0101 0.10000E+01 0.0000 62 KHSO4,aq 0.32787E-15 -15.4843 0.32787E-15 -15.4843 0.10000E+01 0.0000 63 KOH,aq 0.80080E-15 -15.0965 0.80080E-15 -15.0965 0.10000E+01 0.0000 64 KSO4- 0.50931E-13 -13.2930 0.37665E-13 -13.4241 0.73952E+00 -0.1310 66 Mg(HCO3)+ 0.28946E-14 -14.5384 0.21512E-14 -14.6673 0.74319E+00 -0.1289 67 MgCl+ 0.26117E-11 -11.5831 0.19410E-11 -11.7120 0.74319E+00 -0.1289 68 MgF+ 0.27098E-13 -13.5671 0.20139E-13 -13.6960 0.74319E+00 -0.1289 69 MgOH+ 0.24427E-18 -18.6121 0.18154E-18 -18.7410 0.74319E+00 -0.1289 71 MnF+ 0.20449E-12 -12.6893 0.15197E-12 -12.8182 0.74319E+00 -0.1289 73 MnOH+ 0.45382E-16 -16.3431 0.33728E-16 -16.4720 0.74319E+00 -0.1289 78 MnCl+ 0.26568E-09 -9.5756 0.19745E-09 -9.7045 0.74319E+00 -0.1289 79 MnSO4,aq 0.41680E-17 -17.3801 0.41680E-17 -17.3801 0.10000E+01 0.0000 80 NaCl,aq 0.24868E-03 -3.6044 0.24868E-03 -3.6044 0.10000E+01 0.0000 81 NaF,aq 0.49434E-07 -7.3060 0.49434E-07 -7.3060 0.10000E+01 0.0000 82 NaOH,aq 0.11215E-12 -12.9502 0.11215E-12 -12.9502 0.10000E+01 0.0000 84 OH- 0.16293E-10 -10.7880 0.11994E-10 -10.9210 0.73615E+00 -0.1330 90 H3PO3,aq 0.28341E-19 -19.5476 0.28341E-19 -19.5476 0.10000E+01 0.0000 92 H3PO4,aq 0.33437E-07 -7.4758 0.33437E-07 -7.4758 0.10000E+01 0.0000 93 H2PO4- 0.24899E-08 -8.6038 0.18459E-08 -8.7338 0.74138E+00 -0.1300 95 H4P2O7,aq 0.14862E-16 -16.8279 0.14862E-16 -16.8279 0.10000E+01 0.0000 96 H3P2O7- 0.53703E-17 -17.2700 0.39715E-17 -17.4010 0.73952E+00 -0.1310 97 H2P2O7-2 0.82153E-18 -18.0854 0.26939E-18 -18.5696 0.32792E+00 -0.4842 100 H2S,aq 0.51575E-01 -1.2876 0.48558E-01 -1.3137 0.94152E+00 -0.0262 101 S2-2 0.85949E-15 -15.0658 0.28184E-15 -15.5500 0.32792E+00 -0.4842 102 S3-2 0.66133E-14 -14.1796 0.21686E-14 -14.6638 0.32792E+00 -0.4842 103 S3- 0.10185E-08 -8.9920 0.75319E-09 -9.1231 0.73952E+00 -0.1310 104 S4-2 0.33614E-13 -13.4735 0.11022E-13 -13.9577 0.32792E+00 -0.4842 105 S5-2 0.11392E-12 -12.9434 0.37357E-13 -13.4276 0.32792E+00 -0.4842 106 SO2,aq 0.23676E-11 -11.6257 0.23676E-11 -11.6257 0.10000E+01 0.0000 107 SO3-2 0.87863E-19 -19.0562 0.29934E-19 -19.5238 0.34069E+00 -0.4676 108 HSO3- 0.12109E-12 -12.9169 0.89545E-13 -13.0480 0.73952E+00 -0.1310 109 HSO4- 0.16601E-08 -8.7799 0.12372E-08 -8.9076 0.74526E+00 -0.1277 111 S2O3-2 0.47128E-13 -13.3267 0.15454E-13 -13.8110 0.32792E+00 -0.4842 112 HS2O3- 0.17851E-12 -12.7483 0.13202E-12 -12.8794 0.73952E+00 -0.1310 113 H2S2O3,aq 0.10111E-12 -12.9952 0.10111E-12 -12.9952 0.10000E+01 0.0000 Charge balance for all species = -.4746E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6357974E-01 0.5277988E+00 0.5199204E+03 0.0000 2 H2O 0.1000000E+01 0.5510162E+02 0.9701517E+06 0.0000 3 Cl- 0.8070057E-01 0.8147184E-01 0.2822892E+04 0.0966 4 SO4-- 0.8148288E-10 -.4647774E-07 -.4363436E-02 -7.9291 5 HCO3- 0.5010087E-05 0.4066344E+00 0.2424879E+05 -4.1087 6 HS- 0.4445170E-06 0.5157520E-01 0.1666998E+04 -5.1622 7 Al+++ 0.4100605E-05 0.4115356E-05 0.1085194E+00 -2.5103 8 H4SiO4 0.1007917E-02 0.1007917E-02 0.9467849E+02 -2.9966 9 Ca++ 0.1720010E-06 0.1793245E-06 0.7023918E-02 -4.6136 10 Mg++ 0.6947577E-10 0.7211750E-10 0.1713543E-05 -8.0126 11 Fe++ 0.2698005E-07 0.2808773E-07 0.1533028E-02 -5.4221 12 K+ 0.1216125E-03 0.1217102E-03 0.4651144E+01 -2.7234 13 Na+ 0.1701480E-01 0.1726353E-01 0.3878810E+03 -0.5798 14 Mn++ 0.1674812E-08 0.1940701E-08 0.1041994E-03 -6.6282 15 F- 0.2282533E-04 0.5515376E-02 0.1024040E+03 -3.4541 16 HPO4-- 0.6348804E-14 0.3592651E-07 0.3369962E-02 -12.0373 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1702772E+01 0.6124440E+00 0.3819298E+00 0.7083985E+00 2 H2O 0.6294560E+02 0.6393849E+02 -.3275108E+00 -.6653823E+00 3 Cl- 0.9453783E-01 0.9453781E-01 0.0000000E+00 0.1342301E-07 4 SO4-- 0.7638497E-01 -.5393157E-07 0.7638597E-01 -.9459112E-06 5 HCO3- 0.1156812E+01 0.4718480E+00 0.0000000E+00 0.6849643E+00 6 HS- 0.3124403E+00 0.5984653E-01 0.2291579E+00 0.2343586E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1169560E-02 0.1098346E-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- 0.6400096E-02 0.6399900E-02 0.0000000E+00 0.1963478E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1811E-15 Mass of aqueous solution: 0.118731E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 15.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.1958E-01 -1.708 0.3526 -0.453 1.127 7.779 CO2,gas 0.6850 -0.164 30.15 1.479 96.32 368.9 CH4,gas 0.9059E-06 -6.043 0.1453E-04 -4.838 0.4643E-04 0.5848E-03 H2,gas 0.1583E-06 -6.801 0.3197E-06 -6.495 0.1021E-05 0.1008E-03 H2S,gas 0.2343E-01 -1.630 0.7987 -0.098 2.552 11.93 S2,gas 0.7815E-11 -11.107 0.5011E-09 -9.300 0.1601E-08 0.4849E-08 CO,gas 0.1789E-08 -8.747 0.5010E-07 -7.300 0.1601E-06 0.1110E-05 SO3,gas 0.3404E-30 -30.468 0.2726E-28 -28.565 0.8709E-28 0.2112E-27 SO2,gas 0.1491E-12 -12.827 0.9549E-11 -11.020 0.3051E-10 0.9250E-10 HF,gas 0.1963E-06 -6.707 0.3927E-05 -5.406 0.1255E-04 0.1218E-03 HCl,gas 0.1342E-07 -7.872 0.4894E-06 -6.310 0.1564E-05 0.8329E-05 quartz 0.1098E-01 -1.959 0.6599 -0.181 6.311 0.2492 sulfur 0.3055 -0.515 9.796 0.991 93.69 4.739 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 0.9409E+00 0.4705E+02 0.8707 1.612 CH4,gas 0.1244E-05 0.6222E-04 1.0375 -4.190 H2,gas 0.2174E-06 0.1087E-04 1.0270 -4.952 H2S,gas 0.3219E-01 0.1610E+01 0.8293 0.125 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2457E-08 0.1229E-06 1.0000 -6.911 SO3,gas 0.4676E-30 0.2338E-28 1.0000 -28.631 SO2,gas 0.2048E-12 0.1024E-10 1.0000 -10.990 HF,gas 0.2697E-06 0.1349E-04 1.0000 -4.870 HCl,gas 0.1844E-07 0.9219E-06 1.0000 -6.035 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: 2.546376 % Solid products produced: Mass = 10.455623 g Volume = 4.988310 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: 15.9999900 moles log = 1.2041 Original solution: 1000.0103000 g Original solution / Rock added: 62.50 (Water/Rock Ratio), log = 1.7959 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 0.00000E+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 -0.15165E-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 0.60662E-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 -0.37914E-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 69 diamond -3.10 -4.04 -0.94 -0.269 0.16052E+04 89 graphite -3.55 -4.04 -0.50 -0.142 0.84742E+03 92 halite 1.57 -3.12 -4.70 -2.350 0.80239E+04 145 pyrite -21.25 -22.38 -1.13 -0.266 0.19317E+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 -20.21 -3.66 -0.407 0.62533E+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: 0.4000000 MOLES Current total amount of reactant added: 15.9999900 MOLES New total amount of reactant added: 16.3999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 16.3999900 Water: Moles liquid = 0.6477E+02 kg liquid = 0.1167E+01 Moles total = 0.6327E+02 kg total = 0.1140E+01 Activity = 0.9918 Stoichiometric ionic strength = .2843950E+00 Osmotic coef. = 0.9148 True ionic strength = .8228242E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9690E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.65221E-01 -1.1856 0.48931E-01 -1.3104 0.75023E+00 -0.1248 2 H2O 0.99181E+00 -0.0036 0.99181E+00 -0.0036 3 Cl- 0.82242E-01 -1.0849 0.60711E-01 -1.2167 0.73820E+00 -0.1318 4 SO4-- 0.75994E-10 -10.1192 0.24882E-10 -10.6041 0.32743E+00 -0.4849 5 HCO3- 0.48988E-05 -5.3099 0.36305E-05 -5.4400 0.74111E+00 -0.1301 6 HS- 0.43904E-06 -6.3575 0.32423E-06 -6.4891 0.73849E+00 -0.1317 7 Al+++ 0.40781E-05 -5.3895 0.32942E-06 -6.4823 0.80777E-01 -1.0927 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.17096E-06 -6.7671 0.54828E-07 -7.2610 0.32071E+00 -0.4939 10 Mg++ 0.69058E-10 -10.1608 0.21875E-10 -10.6600 0.31677E+00 -0.4993 11 Fe++ 0.26817E-07 -7.5716 0.85197E-08 -8.0696 0.31770E+00 -0.4980 12 K+ 0.12093E-03 -3.9175 0.89664E-04 -4.0474 0.74146E+00 -0.1299 13 Na+ 0.16916E-01 -1.7717 0.12478E-01 -1.9039 0.73765E+00 -0.1322 14 Mn++ 0.16628E-08 -8.7792 0.52946E-09 -9.2762 0.31841E+00 -0.4970 15 F- 0.22760E-04 -4.6428 0.16714E-04 -4.7769 0.73438E+00 -0.1341 16 HPO4-- 0.60712E-14 -14.2167 0.19886E-14 -14.7014 0.32755E+00 -0.4847 17 SiF6-2 0.12701E-11 -11.8962 0.41350E-12 -12.3835 0.32556E+00 -0.4874 18 HSiO3- 0.26270E-10 -10.5805 0.19393E-10 -10.7124 0.73820E+00 -0.1318 19 Ca(HSiO3)+ 0.32638E-16 -16.4863 0.24214E-16 -16.6159 0.74190E+00 -0.1297 20 Mg(HSiO3)+ 0.16206E-19 -19.7903 0.12023E-19 -19.9200 0.74190E+00 -0.1297 21 NaHSiO3,aq 0.39136E-11 -11.4074 0.39136E-11 -11.4074 0.10000E+01 0.0000 22 AlO+ 0.25023E-10 -10.6017 0.18565E-10 -10.7313 0.74190E+00 -0.1297 23 AlOH+2 0.14168E-07 -7.8487 0.45232E-08 -8.3446 0.31925E+00 -0.4959 24 HAlO2,aq 0.74939E-13 -13.1253 0.74939E-13 -13.1253 0.10000E+01 0.0000 25 AlO2- 0.46137E-17 -17.3359 0.33902E-17 -17.4698 0.73480E+00 -0.1338 26 CH4,aq 0.48415E-07 -7.3150 0.45577E-07 -7.3413 0.94139E+00 -0.0262 27 C2H6,aq 0.43939E-16 -16.3572 0.41363E-16 -16.3834 0.94139E+00 -0.0262 31 CO,aq 0.83223E-10 -10.0798 0.83223E-10 -10.0798 0.10000E+01 0.0000 32 CO2,aq 0.40655E+00 -0.3909 0.38272E+00 -0.4171 0.94139E+00 -0.0262 33 CO3-2 0.19907E-13 -13.7010 0.64809E-14 -14.1884 0.32556E+00 -0.4874 34 CaCO3,aq 0.44555E-17 -17.3511 0.44555E-17 -17.3511 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.68487E-11 -11.1644 0.50811E-11 -11.2940 0.74190E+00 -0.1297 36 CaCl+ 0.72608E-08 -8.1390 0.53868E-08 -8.2687 0.74190E+00 -0.1297 37 CaCl2,aq 0.77697E-10 -10.1096 0.77697E-10 -10.1096 0.10000E+01 0.0000 38 CaF+ 0.18034E-10 -10.7439 0.13380E-10 -10.8736 0.74190E+00 -0.1297 39 CaOH+ 0.10676E-15 -15.9716 0.79205E-16 -16.1012 0.74190E+00 -0.1297 40 CaSO4,aq 0.43321E-15 -15.3633 0.43321E-15 -15.3633 0.10000E+01 0.0000 41 HCl,aq 0.54435E-03 -3.2641 0.54435E-03 -3.2641 0.10000E+01 0.0000 45 HF,aq 0.55987E-02 -2.2519 0.55987E-02 -2.2519 0.10000E+01 0.0000 46 HF2- 0.42799E-07 -7.3686 0.31594E-07 -7.5004 0.73820E+00 -0.1318 47 Fe+3 0.44851E-17 -17.3482 0.36536E-18 -18.4373 0.81460E-01 -1.0891 48 FeCl+ 0.11035E-08 -8.9572 0.81870E-09 -9.0869 0.74190E+00 -0.1297 49 FeCl2,aq 0.15736E-14 -14.8031 0.15736E-14 -14.8031 0.10000E+01 0.0000 50 FeCl+2 0.49642E-17 -17.3041 0.15848E-17 -17.8000 0.31925E+00 -0.4959 51 FeF+ 0.98084E-11 -11.0084 0.72769E-11 -11.1381 0.74190E+00 -0.1297 52 FeF+2 0.17048E-15 -15.7683 0.54425E-16 -16.2642 0.31925E+00 -0.4959 54 FeOH+ 0.75769E-14 -14.1205 0.56213E-14 -14.2502 0.74190E+00 -0.1297 56 FeO+ 0.19505E-18 -18.7099 0.14471E-18 -18.8395 0.74190E+00 -0.1297 57 FeOH+2 0.42354E-17 -17.3731 0.13522E-17 -17.8690 0.31925E+00 -0.4959 60 H2,aq 0.91198E-08 -8.0400 0.85853E-08 -8.0662 0.94139E+00 -0.0262 61 KCl,aq 0.98661E-07 -7.0059 0.98661E-07 -7.0059 0.10000E+01 0.0000 62 KHSO4,aq 0.30866E-15 -15.5105 0.30866E-15 -15.5105 0.10000E+01 0.0000 63 KOH,aq 0.77616E-15 -15.1101 0.77616E-15 -15.1101 0.10000E+01 0.0000 64 KSO4- 0.46899E-13 -13.3288 0.34621E-13 -13.4607 0.73820E+00 -0.1318 66 Mg(HCO3)+ 0.27921E-14 -14.5541 0.20715E-14 -14.6837 0.74190E+00 -0.1297 67 MgCl+ 0.26256E-11 -11.5808 0.19479E-11 -11.7104 0.74190E+00 -0.1297 68 MgF+ 0.26654E-13 -13.5742 0.19774E-13 -13.7039 0.74190E+00 -0.1297 69 MgOH+ 0.23570E-18 -18.6276 0.17486E-18 -18.7573 0.74190E+00 -0.1297 71 MnF+ 0.20091E-12 -12.6970 0.14906E-12 -12.8266 0.74190E+00 -0.1297 73 MnOH+ 0.43742E-16 -16.3591 0.32452E-16 -16.4888 0.74190E+00 -0.1297 78 MnCl+ 0.26680E-09 -9.5738 0.19794E-09 -9.7035 0.74190E+00 -0.1297 79 MnSO4,aq 0.38033E-17 -17.4198 0.38033E-17 -17.4198 0.10000E+01 0.0000 80 NaCl,aq 0.25105E-03 -3.6002 0.25105E-03 -3.6002 0.10000E+01 0.0000 81 NaF,aq 0.48827E-07 -7.3113 0.48827E-07 -7.3113 0.10000E+01 0.0000 82 NaOH,aq 0.10867E-12 -12.9639 0.10867E-12 -12.9639 0.10000E+01 0.0000 84 OH- 0.15938E-10 -10.7976 0.11711E-10 -10.9314 0.73480E+00 -0.1338 90 H3PO3,aq 0.28500E-19 -19.5451 0.28500E-19 -19.5451 0.10000E+01 0.0000 92 H3PO4,aq 0.33300E-07 -7.4776 0.33300E-07 -7.4776 0.10000E+01 0.0000 93 H2PO4- 0.24254E-08 -8.6152 0.17950E-08 -8.7459 0.74008E+00 -0.1307 95 H4P2O7,aq 0.14740E-16 -16.8315 0.14740E-16 -16.8315 0.10000E+01 0.0000 96 H3P2O7- 0.52101E-17 -17.2832 0.38461E-17 -17.4150 0.73820E+00 -0.1318 97 H2P2O7-2 0.78244E-18 -18.1065 0.25473E-18 -18.5939 0.32556E+00 -0.4874 100 H2S,aq 0.52085E-01 -1.2833 0.49032E-01 -1.3095 0.94139E+00 -0.0262 101 S2-2 0.83339E-15 -15.0791 0.27132E-15 -15.5665 0.32556E+00 -0.4874 102 S3-2 0.64125E-14 -14.1930 0.20876E-14 -14.6803 0.32556E+00 -0.4874 103 S3- 0.10011E-08 -8.9995 0.73900E-09 -9.1314 0.73820E+00 -0.1318 104 S4-2 0.32593E-13 -13.4869 0.10611E-13 -13.9742 0.32556E+00 -0.4874 105 S5-2 0.11046E-12 -12.9568 0.35962E-13 -13.4442 0.32556E+00 -0.4874 106 SO2,aq 0.23221E-11 -11.6341 0.23221E-11 -11.6341 0.10000E+01 0.0000 107 SO3-2 0.82713E-19 -19.0824 0.27990E-19 -19.5530 0.33839E+00 -0.4706 108 HSO3- 0.11616E-12 -12.9349 0.85750E-13 -13.0668 0.73820E+00 -0.1318 109 HSO4- 0.15771E-08 -8.8021 0.11733E-08 -8.9306 0.74400E+00 -0.1284 111 S2O3-2 0.44385E-13 -13.3528 0.14450E-13 -13.8401 0.32556E+00 -0.4874 112 HS2O3- 0.17126E-12 -12.7664 0.12642E-12 -12.8982 0.73820E+00 -0.1318 113 H2S2O3,aq 0.99167E-13 -13.0036 0.99167E-13 -13.0036 0.10000E+01 0.0000 Charge balance for all species = -.4720E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6522076E-01 0.5299982E+00 0.5220508E+03 0.0000 2 H2O 0.1000000E+01 0.5510170E+02 0.9700858E+06 0.0000 3 Cl- 0.8224183E-01 0.8303734E-01 0.2876935E+04 0.0937 4 SO4-- 0.7599385E-10 -.4843426E-07 -.4546803E-02 -7.9833 5 HCO3- 0.4898758E-05 0.4065546E+00 0.2424236E+05 -4.1296 6 HS- 0.4390440E-06 0.5208519E-01 0.1683365E+04 -5.1787 7 Al+++ 0.4078082E-05 0.4092276E-05 0.1079033E+00 -2.5510 8 H4SiO4 0.1007901E-02 0.1007901E-02 0.9467047E+02 -2.9966 9 Ca++ 0.1709554E-06 0.1783188E-06 0.6984042E-02 -4.6402 10 Mg++ 0.6905799E-10 0.7171305E-10 0.1703815E-05 -8.0392 11 Fe++ 0.2681686E-07 0.2793020E-07 0.1524325E-02 -5.4487 12 K+ 0.1209290E-03 0.1210276E-03 0.4624739E+01 -2.7370 13 Na+ 0.1691561E-01 0.1716671E-01 0.3856789E+03 -0.5934 14 Mn++ 0.1662814E-08 0.1929817E-08 0.1036078E-03 -6.6553 15 F- 0.2275968E-04 0.5621548E-02 0.1043680E+03 -3.4665 16 HPO4-- 0.6071176E-14 0.3572502E-07 0.3350830E-02 -12.0806 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1745842E+01 0.6184647E+00 0.3914802E+00 0.7358974E+00 2 H2O 0.6327308E+02 0.6429919E+02 -.3351379E+00 -.6909742E+00 3 Cl- 0.9689783E-01 0.9689781E-01 0.0000000E+00 0.1452773E-07 4 SO4-- 0.7829497E-01 -.5651883E-07 0.7829604E-01 -.1019962E-05 5 HCO3- 0.1185732E+01 0.4744161E+00 0.0000000E+00 0.7113163E+00 6 HS- 0.3202503E+00 0.6077917E-01 0.2348881E+00 0.2458299E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1176138E-02 0.1097688E-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- 0.6560096E-02 0.6559888E-02 0.0000000E+00 0.2079150E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1163E-15 Mass of aqueous solution: 0.119409E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 16.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2034E-01 -1.692 0.3663 -0.436 1.127 8.081 CO2,gas 0.7113 -0.148 31.30 1.496 96.30 383.1 CH4,gas 0.9780E-06 -6.010 0.1569E-04 -4.804 0.4825E-04 0.6314E-03 H2,gas 0.1660E-06 -6.780 0.3353E-06 -6.475 0.1031E-05 0.1057E-03 H2S,gas 0.2458E-01 -1.609 0.8378 -0.077 2.577 12.51 S2,gas 0.8118E-11 -11.091 0.5205E-09 -9.284 0.1601E-08 0.5037E-08 CO,gas 0.1876E-08 -8.727 0.5254E-07 -7.280 0.1616E-06 0.1164E-05 SO3,gas 0.3435E-30 -30.464 0.2750E-28 -28.561 0.8460E-28 0.2131E-27 SO2,gas 0.1519E-12 -12.819 0.9729E-11 -11.012 0.2993E-10 0.9424E-10 HF,gas 0.2079E-06 -6.682 0.4158E-05 -5.381 0.1279E-04 0.1290E-03 HCl,gas 0.1453E-07 -7.838 0.5297E-06 -6.276 0.1629E-05 0.9014E-05 quartz 0.1098E-01 -1.960 0.6595 -0.181 6.163 0.2491 sulfur 0.3132 -0.504 10.04 1.002 93.84 4.858 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 0.9406E+00 0.4703E+02 0.8707 1.612 CH4,gas 0.1293E-05 0.6466E-04 1.0375 -4.173 H2,gas 0.2195E-06 0.1098E-04 1.0270 -4.948 H2S,gas 0.3251E-01 0.1625E+01 0.8293 0.130 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2480E-08 0.1240E-06 1.0000 -6.907 SO3,gas 0.4542E-30 0.2271E-28 1.0000 -28.644 SO2,gas 0.2008E-12 0.1004E-10 1.0000 -10.998 HF,gas 0.2749E-06 0.1375E-04 1.0000 -4.862 HCl,gas 0.1921E-07 0.9605E-06 1.0000 -6.017 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: 2.627424 % Solid products produced: Mass = 10.700176 g Volume = 5.106665 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: 16.3999900 moles log = 1.2148 Original solution: 1000.0103000 g Original solution / Rock added: 60.98 (Water/Rock Ratio), log = 1.7852 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 0.00000E+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 0.00000E+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 69 diamond -3.10 -4.03 -0.93 -0.266 0.15910E+04 89 graphite -3.55 -4.03 -0.49 -0.139 0.83327E+03 92 halite 1.57 -3.12 -4.70 -2.348 0.80169E+04 145 pyrite -21.25 -22.40 -1.15 -0.271 0.19699E+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 -20.27 -3.73 -0.414 0.63637E+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: 0.4000000 MOLES Current total amount of reactant added: 16.3999900 MOLES New total amount of reactant added: 16.7999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 16.7999900 Water: Moles liquid = 0.6514E+02 kg liquid = 0.1173E+01 Moles total = 0.6360E+02 kg total = 0.1146E+01 Activity = 0.9918 Stoichiometric ionic strength = .2853892E+00 Osmotic coef. = 0.9148 True ionic strength = .8380594E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.9926E-05 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.66843E-01 -1.1749 0.50069E-01 -1.3004 0.74906E+00 -0.1255 2 H2O 0.99180E+00 -0.0036 0.99180E+00 -0.0036 3 Cl- 0.83766E-01 -1.0769 0.61728E-01 -1.2095 0.73692E+00 -0.1326 4 SO4-- 0.71065E-10 -10.1483 0.23107E-10 -10.6363 0.32516E+00 -0.4879 5 HCO3- 0.47939E-05 -5.3193 0.35468E-05 -5.4502 0.73986E+00 -0.1309 6 HS- 0.43383E-06 -6.3627 0.31982E-06 -6.4951 0.73721E+00 -0.1324 7 Al+++ 0.40558E-05 -5.3919 0.32239E-06 -6.4916 0.79489E-01 -1.0997 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16992E-06 -6.7697 0.54105E-07 -7.2668 0.31841E+00 -0.4970 10 Mg++ 0.68645E-10 -10.1634 0.21585E-10 -10.6658 0.31445E+00 -0.5025 11 Fe++ 0.26656E-07 -7.5742 0.84068E-08 -8.0754 0.31539E+00 -0.5012 12 K+ 0.12025E-03 -3.9199 0.89012E-04 -4.0506 0.74020E+00 -0.1306 13 Na+ 0.16818E-01 -1.7742 0.12384E-01 -1.9071 0.73636E+00 -0.1329 14 Mn++ 0.16510E-08 -8.7822 0.52188E-09 -9.2824 0.31610E+00 -0.5002 15 F- 0.22700E-04 -4.6440 0.16640E-04 -4.7788 0.73307E+00 -0.1349 16 HPO4-- 0.58144E-14 -14.2355 0.18913E-14 -14.7232 0.32528E+00 -0.4877 17 SiF6-2 0.13657E-11 -11.8646 0.44151E-12 -12.3551 0.32328E+00 -0.4904 18 HSiO3- 0.25717E-10 -10.5898 0.18951E-10 -10.7224 0.73692E+00 -0.1326 19 Ca(HSiO3)+ 0.31529E-16 -16.5013 0.23352E-16 -16.6317 0.74065E+00 -0.1304 20 Mg(HSiO3)+ 0.15654E-19 -19.8054 0.11594E-19 -19.9358 0.74065E+00 -0.1304 21 NaHSiO3,aq 0.37958E-11 -11.4207 0.37958E-11 -11.4207 0.10000E+01 0.0000 22 AlO+ 0.23428E-10 -10.6303 0.17352E-10 -10.7607 0.74065E+00 -0.1304 23 AlOH+2 0.13649E-07 -7.8649 0.43260E-08 -8.3639 0.31694E+00 -0.4990 24 HAlO2,aq 0.68449E-13 -13.1646 0.68449E-13 -13.1646 0.10000E+01 0.0000 25 AlO2- 0.41257E-17 -17.3845 0.30261E-17 -17.5191 0.73350E+00 -0.1346 26 CH4,aq 0.50246E-07 -7.2989 0.47295E-07 -7.3252 0.94126E+00 -0.0263 27 C2H6,aq 0.46881E-16 -16.3290 0.44127E-16 -16.3553 0.94126E+00 -0.0263 31 CO,aq 0.83976E-10 -10.0758 0.83976E-10 -10.0758 0.10000E+01 0.0000 32 CO2,aq 0.40647E+00 -0.3910 0.38260E+00 -0.4173 0.94126E+00 -0.0263 33 CO3-2 0.19139E-13 -13.7181 0.61874E-14 -14.2085 0.32328E+00 -0.4904 34 CaCO3,aq 0.41976E-17 -17.3770 0.41976E-17 -17.3770 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.66137E-11 -11.1796 0.48985E-11 -11.3099 0.74065E+00 -0.1304 36 CaCl+ 0.72975E-08 -8.1368 0.54049E-08 -8.2672 0.74065E+00 -0.1304 37 CaCl2,aq 0.79265E-10 -10.1009 0.79265E-10 -10.1009 0.10000E+01 0.0000 38 CaF+ 0.17748E-10 -10.7508 0.13145E-10 -10.8812 0.74065E+00 -0.1304 39 CaOH+ 0.10313E-15 -15.9866 0.76383E-16 -16.1170 0.74065E+00 -0.1304 40 CaSO4,aq 0.39700E-15 -15.4012 0.39700E-15 -15.4012 0.10000E+01 0.0000 41 HCl,aq 0.56636E-03 -3.2469 0.56636E-03 -3.2469 0.10000E+01 0.0000 45 HF,aq 0.57037E-02 -2.2438 0.57037E-02 -2.2438 0.10000E+01 0.0000 46 HF2- 0.43485E-07 -7.3617 0.32045E-07 -7.4942 0.73692E+00 -0.1326 47 Fe+3 0.45802E-17 -17.3391 0.36719E-18 -18.4351 0.80169E-01 -1.0960 48 FeCl+ 0.11090E-08 -8.9551 0.82139E-09 -9.0854 0.74065E+00 -0.1304 49 FeCl2,aq 0.16053E-14 -14.7945 0.16053E-14 -14.7945 0.10000E+01 0.0000 50 FeCl+2 0.51097E-17 -17.2916 0.16195E-17 -17.7906 0.31694E+00 -0.4990 51 FeF+ 0.96521E-11 -11.0154 0.71488E-11 -11.1458 0.74065E+00 -0.1304 52 FeF+2 0.17182E-15 -15.7649 0.54457E-16 -16.2639 0.31694E+00 -0.4990 54 FeOH+ 0.73187E-14 -14.1356 0.54206E-14 -14.2660 0.74065E+00 -0.1304 56 FeO+ 0.18753E-18 -18.7269 0.13889E-18 -18.8573 0.74065E+00 -0.1304 57 FeOH+2 0.41902E-17 -17.3778 0.13280E-17 -17.8768 0.31694E+00 -0.4990 60 H2,aq 0.92065E-08 -8.0359 0.86657E-08 -8.0622 0.94126E+00 -0.0263 61 KCl,aq 0.99584E-07 -7.0018 0.99584E-07 -7.0018 0.10000E+01 0.0000 62 KHSO4,aq 0.29117E-15 -15.5358 0.29117E-15 -15.5358 0.10000E+01 0.0000 63 KOH,aq 0.75298E-15 -15.1232 0.75298E-15 -15.1232 0.10000E+01 0.0000 64 KSO4- 0.43311E-13 -13.3634 0.31917E-13 -13.4960 0.73692E+00 -0.1326 66 Mg(HCO3)+ 0.26961E-14 -14.5693 0.19969E-14 -14.6996 0.74065E+00 -0.1304 67 MgCl+ 0.26387E-11 -11.5786 0.19543E-11 -11.7090 0.74065E+00 -0.1304 68 MgF+ 0.26229E-13 -13.5812 0.19426E-13 -13.7116 0.74065E+00 -0.1304 69 MgOH+ 0.22767E-18 -18.6427 0.16862E-18 -18.7731 0.74065E+00 -0.1304 71 MnF+ 0.19750E-12 -12.7044 0.14628E-12 -12.8348 0.74065E+00 -0.1304 73 MnOH+ 0.42206E-16 -16.3746 0.31260E-16 -16.5050 0.74065E+00 -0.1304 78 MnCl+ 0.26784E-09 -9.5721 0.19838E-09 -9.7025 0.74065E+00 -0.1304 79 MnSO4,aq 0.34814E-17 -17.4582 0.34814E-17 -17.4582 0.10000E+01 0.0000 80 NaCl,aq 0.25333E-03 -3.5963 0.25333E-03 -3.5963 0.10000E+01 0.0000 81 NaF,aq 0.48245E-07 -7.3165 0.48245E-07 -7.3165 0.10000E+01 0.0000 82 NaOH,aq 0.10539E-12 -12.9772 0.10539E-12 -12.9772 0.10000E+01 0.0000 84 OH- 0.15603E-10 -10.8068 0.11445E-10 -10.9414 0.73350E+00 -0.1346 90 H3PO3,aq 0.28648E-19 -19.5429 0.28648E-19 -19.5429 0.10000E+01 0.0000 92 H3PO4,aq 0.33161E-07 -7.4794 0.33161E-07 -7.4794 0.10000E+01 0.0000 93 H2PO4- 0.23645E-08 -8.6263 0.17469E-08 -8.7577 0.73881E+00 -0.1315 95 H4P2O7,aq 0.14618E-16 -16.8351 0.14618E-16 -16.8351 0.10000E+01 0.0000 96 H3P2O7- 0.50582E-17 -17.2960 0.37275E-17 -17.4286 0.73692E+00 -0.1326 97 H2P2O7-2 0.74629E-18 -18.1271 0.24126E-18 -18.6175 0.32328E+00 -0.4904 100 H2S,aq 0.52580E-01 -1.2792 0.49491E-01 -1.3055 0.94126E+00 -0.0263 101 S2-2 0.80904E-15 -15.0920 0.26155E-15 -15.5825 0.32328E+00 -0.4904 102 S3-2 0.62251E-14 -14.2059 0.20124E-14 -14.6963 0.32328E+00 -0.4904 103 S3- 0.98459E-09 -9.0067 0.72556E-09 -9.1393 0.73692E+00 -0.1326 104 S4-2 0.31640E-13 -13.4998 0.10229E-13 -13.9902 0.32328E+00 -0.4904 105 S5-2 0.10724E-12 -12.9697 0.34667E-13 -13.4601 0.32328E+00 -0.4904 106 SO2,aq 0.22791E-11 -11.6422 0.22791E-11 -11.6422 0.10000E+01 0.0000 107 SO3-2 0.78045E-19 -19.1077 0.26236E-19 -19.5811 0.33617E+00 -0.4734 108 HSO3- 0.11161E-12 -12.9523 0.82250E-13 -13.0849 0.73692E+00 -0.1326 109 HSO4- 0.15011E-08 -8.8236 0.11150E-08 -8.9527 0.74277E+00 -0.1291 111 S2O3-2 0.41898E-13 -13.3778 0.13545E-13 -13.8682 0.32328E+00 -0.4904 112 HS2O3- 0.16455E-12 -12.7837 0.12126E-12 -12.9163 0.73692E+00 -0.1326 113 H2S2O3,aq 0.97332E-13 -13.0117 0.97332E-13 -13.0117 0.10000E+01 0.0000 Charge balance for all species = -.4693E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6684312E-01 0.5321661E+00 0.5241503E+03 0.0000 2 H2O 0.1000000E+01 0.5510178E+02 0.9700209E+06 0.0000 3 Cl- 0.8376559E-01 0.8458539E-01 0.2930369E+04 0.0909 4 SO4-- 0.7106477E-10 -.5037890E-07 -.4729035E-02 -8.0354 5 HCO3- 0.4793885E-05 0.4064778E+00 0.2423612E+05 -4.1497 6 HS- 0.4338311E-06 0.5258033E-01 0.1699252E+04 -5.1947 7 Al+++ 0.4055780E-05 0.4069453E-05 0.1072942E+00 -2.5903 8 H4SiO4 0.1007886E-02 0.1007886E-02 0.9466259E+02 -2.9966 9 Ca++ 0.1699232E-06 0.1773243E-06 0.6944618E-02 -4.6659 10 Mg++ 0.6864548E-10 0.7131311E-10 0.1694197E-05 -8.0650 11 Fe++ 0.2665575E-07 0.2777444E-07 0.1515720E-02 -5.4745 12 K+ 0.1202531E-03 0.1203527E-03 0.4598633E+01 -2.7501 13 Na+ 0.1681759E-01 0.1707097E-01 0.3835018E+03 -0.6067 14 Mn++ 0.1651013E-08 0.1919054E-08 0.1030230E-03 -6.6816 15 F- 0.2269988E-04 0.5726535E-02 0.1063099E+03 -3.4784 16 HPO4-- 0.5814389E-14 0.3552579E-07 0.3331915E-02 -12.1224 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1788912E+01 0.6244771E+00 0.4010306E+00 0.7634047E+00 2 H2O 0.6360056E+02 0.6465989E+02 -.3427651E+00 -.7165633E+00 3 Cl- 0.9925783E-01 0.9925781E-01 0.0000000E+00 0.1567993E-07 4 SO4-- 0.8020497E-01 -.5911777E-07 0.8020612E-01 -.1096732E-05 5 HCO3- 0.1214652E+01 0.4769866E+00 0.0000000E+00 0.7376657E+00 6 HS- 0.3280603E+00 0.6170106E-01 0.2406184E+00 0.2574086E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1182717E-02 0.1097030E-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- 0.6720096E-02 0.6719876E-02 0.0000000E+00 0.2197335E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.7518E-16 Mass of aqueous solution: 0.120087E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 16.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2110E-01 -1.676 0.3800 -0.420 1.127 8.383 CO2,gas 0.7377 -0.132 32.46 1.511 96.27 397.3 CH4,gas 0.1053E-05 -5.978 0.1689E-04 -4.772 0.5008E-04 0.6797E-03 H2,gas 0.1738E-06 -6.760 0.3511E-06 -6.455 0.1041E-05 0.1107E-03 H2S,gas 0.2574E-01 -1.589 0.8772 -0.057 2.601 13.10 S2,gas 0.8422E-11 -11.075 0.5400E-09 -9.268 0.1601E-08 0.5226E-08 CO,gas 0.1963E-08 -8.707 0.5500E-07 -7.260 0.1631E-06 0.1218E-05 SO3,gas 0.3465E-30 -30.460 0.2774E-28 -28.557 0.8227E-28 0.2150E-27 SO2,gas 0.1546E-12 -12.811 0.9906E-11 -11.004 0.2938E-10 0.9595E-10 HF,gas 0.2197E-06 -6.658 0.4395E-05 -5.357 0.1303E-04 0.1363E-03 HCl,gas 0.1568E-07 -7.805 0.5717E-06 -6.243 0.1695E-05 0.9729E-05 quartz 0.1097E-01 -1.960 0.6591 -0.181 6.022 0.2489 sulfur 0.3208 -0.494 10.29 1.012 93.98 4.976 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 0.9403E+00 0.4701E+02 0.8707 1.612 CH4,gas 0.1342E-05 0.6710E-04 1.0375 -4.157 H2,gas 0.2216E-06 0.1108E-04 1.0270 -4.944 H2S,gas 0.3281E-01 0.1641E+01 0.8293 0.134 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2503E-08 0.1251E-06 1.0000 -6.903 SO3,gas 0.4417E-30 0.2208E-28 1.0000 -28.656 SO2,gas 0.1971E-12 0.9856E-11 1.0000 -11.006 HF,gas 0.2801E-06 0.1400E-04 1.0000 -4.854 HCl,gas 0.1999E-07 0.9994E-06 1.0000 -6.000 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: 2.707421 % Solid products produced: Mass = 10.944729 g Volume = 5.225020 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: 16.7999900 moles log = 1.2253 Original solution: 1000.0103000 g Original solution / Rock added: 59.52 (Water/Rock Ratio), log = 1.7747 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 -0.37914E-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 0.00000E+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 69 diamond -3.10 -4.03 -0.92 -0.264 0.15774E+04 89 graphite -3.55 -4.03 -0.48 -0.137 0.81966E+03 92 halite 1.57 -3.12 -4.69 -2.346 0.80101E+04 145 pyrite -21.25 -22.42 -1.18 -0.277 0.20070E+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 -20.34 -3.79 -0.421 0.64705E+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: 0.4000000 MOLES Current total amount of reactant added: 16.7999900 MOLES New total amount of reactant added: 17.1999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 17.1999900 Water: Moles liquid = 0.6550E+02 kg liquid = 0.1180E+01 Moles total = 0.6393E+02 kg total = 0.1152E+01 Activity = 0.9918 Stoichiometric ionic strength = .2863691E+00 Osmotic coef. = 0.9148 True ionic strength = .8531226E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1016E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.68447E-01 -1.1646 0.51193E-01 -1.2908 0.74792E+00 -0.1261 2 H2O 0.99179E+00 -0.0036 0.99179E+00 -0.0036 3 Cl- 0.85272E-01 -1.0692 0.62732E-01 -1.2025 0.73567E+00 -0.1333 4 SO4-- 0.66623E-10 -10.1764 0.21516E-10 -10.6672 0.32296E+00 -0.4909 5 HCO3- 0.46949E-05 -5.3284 0.34678E-05 -5.4599 0.73864E+00 -0.1316 6 HS- 0.42886E-06 -6.3677 0.31562E-06 -6.5008 0.73596E+00 -0.1331 7 Al+++ 0.40337E-05 -5.3943 0.31565E-06 -6.5008 0.78254E-01 -1.1065 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16890E-06 -6.7724 0.53404E-07 -7.2724 0.31618E+00 -0.5001 10 Mg++ 0.68238E-10 -10.1660 0.21304E-10 -10.6715 0.31221E+00 -0.5056 11 Fe++ 0.26497E-07 -7.5768 0.82973E-08 -8.0811 0.31315E+00 -0.5043 12 K+ 0.11958E-03 -3.9223 0.88371E-04 -4.0537 0.73898E+00 -0.1314 13 Na+ 0.16721E-01 -1.7767 0.12291E-01 -1.9104 0.73510E+00 -0.1337 14 Mn++ 0.16394E-08 -8.7853 0.51455E-09 -9.2886 0.31386E+00 -0.5033 15 F- 0.22645E-04 -4.6450 0.16572E-04 -4.7806 0.73179E+00 -0.1356 16 HPO4-- 0.55763E-14 -14.2537 0.18016E-14 -14.7443 0.32308E+00 -0.4907 17 SiF6-2 0.14659E-11 -11.8339 0.47065E-12 -12.3273 0.32107E+00 -0.4934 18 HSiO3- 0.25195E-10 -10.5987 0.18535E-10 -10.7320 0.73567E+00 -0.1333 19 Ca(HSiO3)+ 0.30487E-16 -16.5159 0.22543E-16 -16.6470 0.73943E+00 -0.1311 20 Mg(HSiO3)+ 0.15136E-19 -19.8200 0.11192E-19 -19.9511 0.73943E+00 -0.1311 21 NaHSiO3,aq 0.36848E-11 -11.4336 0.36848E-11 -11.4336 0.10000E+01 0.0000 22 AlO+ 0.21978E-10 -10.6580 0.16251E-10 -10.7891 0.73943E+00 -0.1311 23 AlOH+2 0.13163E-07 -7.8806 0.41426E-08 -8.3827 0.31471E+00 -0.5021 24 HAlO2,aq 0.62701E-13 -13.2027 0.62701E-13 -13.2027 0.10000E+01 0.0000 25 AlO2- 0.37027E-17 -17.4315 0.27112E-17 -17.5668 0.73222E+00 -0.1354 26 CH4,aq 0.52073E-07 -7.2834 0.49008E-07 -7.3097 0.94113E+00 -0.0263 27 C2H6,aq 0.49896E-16 -16.3019 0.46959E-16 -16.3283 0.94113E+00 -0.0263 31 CO,aq 0.84707E-10 -10.0721 0.84707E-10 -10.0721 0.10000E+01 0.0000 32 CO2,aq 0.40640E+00 -0.3910 0.38248E+00 -0.4174 0.94113E+00 -0.0263 33 CO3-2 0.18428E-13 -13.7345 0.59169E-14 -14.2279 0.32107E+00 -0.4934 34 CaCO3,aq 0.39621E-17 -17.4021 0.39621E-17 -17.4021 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.63932E-11 -11.1943 0.47274E-11 -11.3254 0.73943E+00 -0.1311 36 CaCl+ 0.73322E-08 -8.1348 0.54216E-08 -8.2659 0.73943E+00 -0.1311 37 CaCl2,aq 0.80803E-10 -10.0926 0.80803E-10 -10.0926 0.10000E+01 0.0000 38 CaF+ 0.17474E-10 -10.7576 0.12921E-10 -10.8887 0.73943E+00 -0.1311 39 CaOH+ 0.99723E-16 -16.0012 0.73738E-16 -16.1323 0.73943E+00 -0.1311 40 CaSO4,aq 0.36488E-15 -15.4378 0.36488E-15 -15.4378 0.10000E+01 0.0000 41 HCl,aq 0.58848E-03 -3.2303 0.58848E-03 -3.2303 0.10000E+01 0.0000 45 HF,aq 0.58076E-02 -2.2360 0.58076E-02 -2.2360 0.10000E+01 0.0000 46 HF2- 0.44169E-07 -7.3549 0.32494E-07 -7.4882 0.73567E+00 -0.1333 47 Fe+3 0.46735E-17 -17.3304 0.36888E-18 -18.4331 0.78930E-01 -1.1028 48 FeCl+ 0.11142E-08 -8.9530 0.82388E-09 -9.0841 0.73943E+00 -0.1311 49 FeCl2,aq 0.16363E-14 -14.7861 0.16363E-14 -14.7861 0.10000E+01 0.0000 50 FeCl+2 0.52537E-17 -17.2795 0.16534E-17 -17.7816 0.31471E+00 -0.5021 51 FeF+ 0.95026E-11 -11.0222 0.70265E-11 -11.1533 0.73943E+00 -0.1311 52 FeF+2 0.17312E-15 -15.7617 0.54482E-16 -16.2637 0.31471E+00 -0.5021 54 FeOH+ 0.70765E-14 -14.1502 0.52325E-14 -14.2813 0.73943E+00 -0.1311 56 FeO+ 0.18051E-18 -18.7435 0.13347E-18 -18.8746 0.73943E+00 -0.1311 57 FeOH+2 0.41463E-17 -17.3823 0.13049E-17 -17.8844 0.31471E+00 -0.5021 60 H2,aq 0.92907E-08 -8.0320 0.87438E-08 -8.0583 0.94113E+00 -0.0263 61 KCl,aq 0.10048E-06 -6.9979 0.10048E-06 -6.9979 0.10000E+01 0.0000 62 KHSO4,aq 0.27522E-15 -15.5603 0.27522E-15 -15.5603 0.10000E+01 0.0000 63 KOH,aq 0.73115E-15 -15.1360 0.73115E-15 -15.1360 0.10000E+01 0.0000 64 KSO4- 0.40107E-13 -13.3968 0.29506E-13 -13.5301 0.73567E+00 -0.1333 66 Mg(HCO3)+ 0.26061E-14 -14.5840 0.19270E-14 -14.7151 0.73943E+00 -0.1311 67 MgCl+ 0.26510E-11 -11.5766 0.19603E-11 -11.7077 0.73943E+00 -0.1311 68 MgF+ 0.25823E-13 -13.5880 0.19094E-13 -13.7191 0.73943E+00 -0.1311 69 MgOH+ 0.22013E-18 -18.6573 0.16277E-18 -18.7884 0.73943E+00 -0.1311 71 MnF+ 0.19424E-12 -12.7117 0.14362E-12 -12.8428 0.73943E+00 -0.1311 73 MnOH+ 0.40766E-16 -16.3897 0.30144E-16 -16.5208 0.73943E+00 -0.1311 78 MnCl+ 0.26881E-09 -9.5705 0.19877E-09 -9.7017 0.73943E+00 -0.1311 79 MnSO4,aq 0.31962E-17 -17.4954 0.31962E-17 -17.4954 0.10000E+01 0.0000 80 NaCl,aq 0.25553E-03 -3.5926 0.25553E-03 -3.5926 0.10000E+01 0.0000 81 NaF,aq 0.47687E-07 -7.3216 0.47687E-07 -7.3216 0.10000E+01 0.0000 82 NaOH,aq 0.10231E-12 -12.9901 0.10231E-12 -12.9901 0.10000E+01 0.0000 84 OH- 0.15287E-10 -10.8157 0.11194E-10 -10.9510 0.73222E+00 -0.1354 90 H3PO3,aq 0.28785E-19 -19.5408 0.28785E-19 -19.5408 0.10000E+01 0.0000 92 H3PO4,aq 0.33022E-07 -7.4812 0.33022E-07 -7.4812 0.10000E+01 0.0000 93 H2PO4- 0.23067E-08 -8.6370 0.17014E-08 -8.7692 0.73758E+00 -0.1322 95 H4P2O7,aq 0.14496E-16 -16.8388 0.14496E-16 -16.8388 0.10000E+01 0.0000 96 H3P2O7- 0.49141E-17 -17.3086 0.36151E-17 -17.4419 0.73567E+00 -0.1333 97 H2P2O7-2 0.71278E-18 -18.1470 0.22885E-18 -18.6404 0.32107E+00 -0.4934 100 H2S,aq 0.53061E-01 -1.2752 0.49937E-01 -1.3016 0.94113E+00 -0.0263 101 S2-2 0.78625E-15 -15.1044 0.25245E-15 -15.5978 0.32107E+00 -0.4934 102 S3-2 0.60498E-14 -14.2183 0.19424E-14 -14.7117 0.32107E+00 -0.4934 103 S3- 0.96895E-09 -9.0137 0.71283E-09 -9.1470 0.73567E+00 -0.1333 104 S4-2 0.30749E-13 -13.5122 0.98728E-14 -14.0056 0.32107E+00 -0.4934 105 S5-2 0.10422E-12 -12.9821 0.33461E-13 -13.4755 0.32107E+00 -0.4934 106 SO2,aq 0.22385E-11 -11.6500 0.22385E-11 -11.6500 0.10000E+01 0.0000 107 SO3-2 0.73800E-19 -19.1319 0.24650E-19 -19.6082 0.33402E+00 -0.4762 108 HSO3- 0.10740E-12 -12.9690 0.79012E-13 -13.1023 0.73567E+00 -0.1333 109 HSO4- 0.14314E-08 -8.8442 0.10615E-08 -8.9741 0.74158E+00 -0.1298 111 S2O3-2 0.39636E-13 -13.4019 0.12726E-13 -13.8953 0.32107E+00 -0.4934 112 HS2O3- 0.15834E-12 -12.8004 0.11649E-12 -12.9337 0.73567E+00 -0.1333 113 H2S2O3,aq 0.95599E-13 -13.0195 0.95599E-13 -13.0195 0.10000E+01 0.0000 Charge balance for all species = -.4667E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6844712E-01 0.5343032E+00 0.5262198E+03 0.0000 2 H2O 0.1000000E+01 0.5510185E+02 0.9699569E+06 0.0000 3 Cl- 0.8527213E-01 0.8611626E-01 0.2983204E+04 0.0883 4 SO4-- 0.6662281E-10 -.5231144E-07 -.4910110E-02 -8.0857 5 HCO3- 0.4694916E-05 0.4064039E+00 0.2423008E+05 -4.1692 6 HS- 0.4288580E-06 0.5306126E-01 0.1714679E+04 -5.2100 7 Al+++ 0.4033698E-05 0.4046884E-05 0.1066919E+00 -2.6284 8 H4SiO4 0.1007871E-02 0.1007871E-02 0.9465484E+02 -2.9966 9 Ca++ 0.1689040E-06 0.1763409E-06 0.6905637E-02 -4.6908 10 Mg++ 0.6823813E-10 0.7091760E-10 0.1684688E-05 -8.0900 11 Fe++ 0.2649668E-07 0.2762040E-07 0.1507213E-02 -5.4995 12 K+ 0.1195847E-03 0.1196852E-03 0.4572821E+01 -2.7629 13 Na+ 0.1672071E-01 0.1697629E-01 0.3813492E+03 -0.6196 14 Mn++ 0.1639403E-08 0.1908411E-08 0.1024447E-03 -6.7070 15 F- 0.2264537E-04 0.5830358E-02 0.1082300E+03 -3.4898 16 HPO4-- 0.5576295E-14 0.3532876E-07 0.3313213E-02 -12.1628 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1831982E+01 0.6304816E+00 0.4105810E+00 0.7909198E+00 2 H2O 0.6392804E+02 0.6502058E+02 -.3503923E+00 -.7421499E+00 3 Cl- 0.1016178E+00 0.1016178E+00 0.0000000E+00 0.1687972E-07 4 SO4-- 0.8211497E-01 -.6172787E-07 0.8211621E-01 -.1176187E-05 5 HCO3- 0.1243572E+01 0.4795595E+00 0.0000000E+00 0.7640129E+00 6 HS- 0.3358703E+00 0.6261267E-01 0.2463486E+00 0.2690901E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1189295E-02 0.1096372E-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- 0.6880096E-02 0.6879864E-02 0.0000000E+00 0.2317993E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1801E-15 Mass of aqueous solution: 0.120765E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 17.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2186E-01 -1.660 0.3937 -0.405 1.127 8.685 CO2,gas 0.7640 -0.117 33.62 1.527 96.25 411.5 CH4,gas 0.1130E-05 -5.947 0.1813E-04 -4.742 0.5189E-04 0.7297E-03 H2,gas 0.1817E-06 -6.741 0.3670E-06 -6.435 0.1051E-05 0.1157E-03 H2S,gas 0.2691E-01 -1.570 0.9170 -0.038 2.625 13.70 S2,gas 0.8725E-11 -11.059 0.5595E-09 -9.252 0.1601E-08 0.5414E-08 CO,gas 0.2052E-08 -8.688 0.5748E-07 -7.241 0.1645E-06 0.1273E-05 SO3,gas 0.3494E-30 -30.457 0.2798E-28 -28.553 0.8009E-28 0.2168E-27 SO2,gas 0.1574E-12 -12.803 0.1008E-10 -10.997 0.2886E-10 0.9764E-10 HF,gas 0.2318E-06 -6.635 0.4636E-05 -5.334 0.1327E-04 0.1438E-03 HCl,gas 0.1688E-07 -7.773 0.6154E-06 -6.211 0.1762E-05 0.1047E-04 quartz 0.1096E-01 -1.960 0.6587 -0.181 5.887 0.2488 sulfur 0.3285 -0.484 10.53 1.022 94.11 5.095 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 0.9400E+00 0.4700E+02 0.8707 1.612 CH4,gas 0.1391E-05 0.6953E-04 1.0375 -4.142 H2,gas 0.2236E-06 0.1118E-04 1.0270 -4.940 H2S,gas 0.3311E-01 0.1655E+01 0.8293 0.138 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2525E-08 0.1262E-06 1.0000 -6.899 SO3,gas 0.4299E-30 0.2150E-28 1.0000 -28.668 SO2,gas 0.1936E-12 0.9680E-11 1.0000 -11.014 HF,gas 0.2852E-06 0.1426E-04 1.0000 -4.846 HCl,gas 0.2077E-07 0.1038E-05 1.0000 -5.984 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: 2.786387 % Solid products produced: Mass = 11.189283 g Volume = 5.343375 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: 17.1999900 moles log = 1.2355 Original solution: 1000.0103000 g Original solution / Rock added: 58.14 (Water/Rock Ratio), log = 1.7645 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 0.60662E-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 0.00000E+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 -0.12132E-10 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 69 diamond -3.10 -4.02 -0.92 -0.262 0.15643E+04 89 graphite -3.55 -4.02 -0.47 -0.135 0.80658E+03 92 halite 1.57 -3.11 -4.69 -2.344 0.80037E+04 145 pyrite -21.25 -22.44 -1.20 -0.282 0.20430E+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 -20.40 -3.85 -0.428 0.65738E+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: 0.4000000 MOLES Current total amount of reactant added: 17.1999900 MOLES New total amount of reactant added: 17.5999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 17.5999900 Water: Moles liquid = 0.6586E+02 kg liquid = 0.1187E+01 Moles total = 0.6426E+02 kg total = 0.1158E+01 Activity = 0.9918 Stoichiometric ionic strength = .2873349E+00 Osmotic coef. = 0.9148 True ionic strength = .8680167E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1040E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.70033E-01 -1.1547 0.52302E-01 -1.2815 0.74681E+00 -0.1268 2 H2O 0.99178E+00 -0.0036 0.99178E+00 -0.0036 3 Cl- 0.86762E-01 -1.0617 0.63723E-01 -1.1957 0.73446E+00 -0.1340 4 SO4-- 0.62606E-10 -10.2034 0.20086E-10 -10.6971 0.32083E+00 -0.4937 5 HCO3- 0.46014E-05 -5.3371 0.33933E-05 -5.4694 0.73745E+00 -0.1323 6 HS- 0.42411E-06 -6.3725 0.31161E-06 -6.5064 0.73475E+00 -0.1339 7 Al+++ 0.40118E-05 -5.3967 0.30919E-06 -6.5098 0.77068E-01 -1.1131 8 H4SiO4 0.10079E-02 -2.9966 0.10079E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16790E-06 -6.7750 0.52724E-07 -7.2780 0.31402E+00 -0.5030 10 Mg++ 0.67836E-10 -10.1685 0.21031E-10 -10.6771 0.31003E+00 -0.5086 11 Fe++ 0.26340E-07 -7.5794 0.81910E-08 -8.0867 0.31098E+00 -0.5073 12 K+ 0.11892E-03 -3.9247 0.87742E-04 -4.0568 0.73780E+00 -0.1321 13 Na+ 0.16625E-01 -1.7792 0.12201E-01 -1.9136 0.73388E+00 -0.1344 14 Mn++ 0.16280E-08 -8.7884 0.50743E-09 -9.2946 0.31170E+00 -0.5063 15 F- 0.22596E-04 -4.6460 0.16507E-04 -4.7823 0.73055E+00 -0.1363 16 HPO4-- 0.53550E-14 -14.2712 0.17187E-14 -14.7648 0.32096E+00 -0.4936 17 SiF6-2 0.15706E-11 -11.8039 0.50094E-12 -12.3002 0.31894E+00 -0.4963 18 HSiO3- 0.24702E-10 -10.6073 0.18142E-10 -10.7413 0.73446E+00 -0.1340 19 Ca(HSiO3)+ 0.29508E-16 -16.5301 0.21784E-16 -16.6619 0.73825E+00 -0.1318 20 Mg(HSiO3)+ 0.14649E-19 -19.8342 0.10814E-19 -19.9660 0.73825E+00 -0.1318 21 NaHSiO3,aq 0.35800E-11 -11.4461 0.35800E-11 -11.4461 0.10000E+01 0.0000 22 AlO+ 0.20658E-10 -10.6849 0.15251E-10 -10.8167 0.73825E+00 -0.1318 23 AlOH+2 0.12708E-07 -7.8959 0.39717E-08 -8.4010 0.31254E+00 -0.5051 24 HAlO2,aq 0.57592E-13 -13.2396 0.57592E-13 -13.2396 0.10000E+01 0.0000 25 AlO2- 0.33345E-17 -17.4770 0.24375E-17 -17.6131 0.73099E+00 -0.1361 26 CH4,aq 0.53896E-07 -7.2684 0.50716E-07 -7.2949 0.94101E+00 -0.0264 27 C2H6,aq 0.52982E-16 -16.2759 0.49857E-16 -16.3023 0.94101E+00 -0.0264 31 CO,aq 0.85416E-10 -10.0685 0.85416E-10 -10.0685 0.10000E+01 0.0000 32 CO2,aq 0.40633E+00 -0.3911 0.38236E+00 -0.4175 0.94101E+00 -0.0264 33 CO3-2 0.17768E-13 -13.7504 0.56669E-14 -14.2467 0.31894E+00 -0.4963 34 CaCO3,aq 0.37464E-17 -17.4264 0.37464E-17 -17.4264 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.61859E-11 -11.2086 0.45668E-11 -11.3404 0.73825E+00 -0.1318 36 CaCl+ 0.73648E-08 -8.1328 0.54371E-08 -8.2646 0.73825E+00 -0.1318 37 CaCl2,aq 0.82313E-10 -10.0845 0.82313E-10 -10.0845 0.10000E+01 0.0000 38 CaF+ 0.17212E-10 -10.7642 0.12707E-10 -10.8960 0.73825E+00 -0.1318 39 CaOH+ 0.96519E-16 -16.0154 0.71255E-16 -16.1472 0.73825E+00 -0.1318 40 CaSO4,aq 0.33628E-15 -15.4733 0.33628E-15 -15.4733 0.10000E+01 0.0000 41 HCl,aq 0.61072E-03 -3.2142 0.61072E-03 -3.2142 0.10000E+01 0.0000 45 HF,aq 0.59103E-02 -2.2284 0.59103E-02 -2.2284 0.10000E+01 0.0000 46 HF2- 0.44849E-07 -7.3482 0.32940E-07 -7.4823 0.73446E+00 -0.1340 47 Fe+3 0.47650E-17 -17.3219 0.37044E-18 -18.4313 0.77741E-01 -1.1093 48 FeCl+ 0.11191E-08 -8.9511 0.82617E-09 -9.0829 0.73825E+00 -0.1318 49 FeCl2,aq 0.16668E-14 -14.7781 0.16668E-14 -14.7781 0.10000E+01 0.0000 50 FeCl+2 0.53963E-17 -17.2679 0.16866E-17 -17.7730 0.31254E+00 -0.5051 51 FeF+ 0.93594E-11 -11.0288 0.69096E-11 -11.1605 0.73825E+00 -0.1318 52 FeF+2 0.17437E-15 -15.7585 0.54499E-16 -16.2636 0.31254E+00 -0.5051 54 FeOH+ 0.68486E-14 -14.1644 0.50560E-14 -14.2962 0.73825E+00 -0.1318 56 FeO+ 0.17394E-18 -18.7596 0.12841E-18 -18.8914 0.73825E+00 -0.1318 57 FeOH+2 0.41037E-17 -17.3868 0.12826E-17 -17.8919 0.31254E+00 -0.5051 60 H2,aq 0.93725E-08 -8.0281 0.88197E-08 -8.0545 0.94101E+00 -0.0264 61 KCl,aq 0.10134E-06 -6.9942 0.10134E-06 -6.9942 0.10000E+01 0.0000 62 KHSO4,aq 0.26061E-15 -15.5840 0.26061E-15 -15.5840 0.10000E+01 0.0000 63 KOH,aq 0.71055E-15 -15.1484 0.71055E-15 -15.1484 0.10000E+01 0.0000 64 KSO4- 0.37235E-13 -13.4290 0.27348E-13 -13.5631 0.73446E+00 -0.1340 66 Mg(HCO3)+ 0.25214E-14 -14.5984 0.18614E-14 -14.7302 0.73825E+00 -0.1318 67 MgCl+ 0.26627E-11 -11.5747 0.19657E-11 -11.7065 0.73825E+00 -0.1318 68 MgF+ 0.25434E-13 -13.5946 0.18776E-13 -13.7264 0.73825E+00 -0.1318 69 MgOH+ 0.21305E-18 -18.6715 0.15728E-18 -18.8033 0.73825E+00 -0.1318 71 MnF+ 0.19111E-12 -12.7187 0.14109E-12 -12.8505 0.73825E+00 -0.1318 73 MnOH+ 0.39413E-16 -16.4044 0.29097E-16 -16.5362 0.73825E+00 -0.1318 78 MnCl+ 0.26972E-09 -9.5691 0.19912E-09 -9.7009 0.73825E+00 -0.1318 79 MnSO4,aq 0.29424E-17 -17.5313 0.29424E-17 -17.5313 0.10000E+01 0.0000 80 NaCl,aq 0.25765E-03 -3.5890 0.25765E-03 -3.5890 0.10000E+01 0.0000 81 NaF,aq 0.47152E-07 -7.3265 0.47152E-07 -7.3265 0.10000E+01 0.0000 82 NaOH,aq 0.99404E-13 -13.0026 0.99404E-13 -13.0026 0.10000E+01 0.0000 84 OH- 0.14988E-10 -10.8242 0.10956E-10 -10.9603 0.73099E+00 -0.1361 90 H3PO3,aq 0.28912E-19 -19.5389 0.28912E-19 -19.5389 0.10000E+01 0.0000 92 H3PO4,aq 0.32882E-07 -7.4830 0.32882E-07 -7.4830 0.10000E+01 0.0000 93 H2PO4- 0.22519E-08 -8.6475 0.16583E-08 -8.7803 0.73639E+00 -0.1329 95 H4P2O7,aq 0.14373E-16 -16.8424 0.14373E-16 -16.8424 0.10000E+01 0.0000 96 H3P2O7- 0.47771E-17 -17.3208 0.35086E-17 -17.4549 0.73446E+00 -0.1340 97 H2P2O7-2 0.68164E-18 -18.1664 0.21740E-18 -18.6627 0.31894E+00 -0.4963 100 H2S,aq 0.53528E-01 -1.2714 0.50371E-01 -1.2978 0.94101E+00 -0.0264 101 S2-2 0.76490E-15 -15.1164 0.24396E-15 -15.6127 0.31894E+00 -0.4963 102 S3-2 0.58855E-14 -14.2302 0.18771E-14 -14.7265 0.31894E+00 -0.4963 103 S3- 0.95409E-09 -9.0204 0.70074E-09 -9.1544 0.73446E+00 -0.1340 104 S4-2 0.29914E-13 -13.5241 0.95408E-14 -14.0204 0.31894E+00 -0.4963 105 S5-2 0.10138E-12 -12.9940 0.32336E-13 -13.4903 0.31894E+00 -0.4963 106 SO2,aq 0.22002E-11 -11.6575 0.22002E-11 -11.6575 0.10000E+01 0.0000 107 SO3-2 0.69929E-19 -19.1553 0.23211E-19 -19.6343 0.33193E+00 -0.4790 108 HSO3- 0.10349E-12 -12.9851 0.76011E-13 -13.1191 0.73446E+00 -0.1340 109 HSO4- 0.13674E-08 -8.8641 0.10124E-08 -8.9946 0.74041E+00 -0.1305 111 S2O3-2 0.37572E-13 -13.4251 0.11983E-13 -13.9214 0.31894E+00 -0.4963 112 HS2O3- 0.15258E-12 -12.8165 0.11206E-12 -12.9505 0.73446E+00 -0.1340 113 H2S2O3,aq 0.93959E-13 -13.0271 0.93959E-13 -13.0271 0.10000E+01 0.0000 Charge balance for all species = -.4642E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7003308E-01 0.5364103E+00 0.5282599E+03 0.0000 2 H2O 0.1000000E+01 0.5510192E+02 0.9698937E+06 0.0000 3 Cl- 0.8676176E-01 0.8763024E-01 0.3035449E+04 0.0858 4 SO4-- 0.6260645E-10 -.5423159E-07 -.5090003E-02 -8.1341 5 HCO3- 0.4601360E-05 0.4063326E+00 0.2422422E+05 -4.1879 6 HS- 0.4241066E-06 0.5352857E-01 0.1729665E+04 -5.2249 7 Al+++ 0.4011835E-05 0.4024563E-05 0.1060964E+00 -2.6653 8 H4SiO4 0.1007857E-02 0.1007857E-02 0.9464721E+02 -2.9966 9 Ca++ 0.1678977E-06 0.1753683E-06 0.6867094E-02 -4.7150 10 Mg++ 0.6783583E-10 0.7052646E-10 0.1675285E-05 -8.1142 11 Fe++ 0.2633960E-07 0.2746806E-07 0.1498800E-02 -5.5237 12 K+ 0.1189237E-03 0.1190251E-03 0.4547297E+01 -2.7753 13 Na+ 0.1662496E-01 0.1688266E-01 0.3792207E+03 -0.6321 14 Mn++ 0.1627978E-08 0.1897885E-08 0.1018729E-03 -6.7316 15 F- 0.2259565E-04 0.5933035E-02 0.1101287E+03 -3.5008 16 HPO4-- 0.5355025E-14 0.3513390E-07 0.3294720E-02 -12.2018 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1875052E+01 0.6364785E+00 0.4201314E+00 0.8184425E+00 2 H2O 0.6425552E+02 0.6538127E+02 -.3580195E+00 -.7677341E+00 3 Cl- 0.1039778E+00 0.1039778E+00 0.0000000E+00 0.1812719E-07 4 SO4-- 0.8402497E-01 -.6434858E-07 0.8402629E-01 -.1258293E-05 5 HCO3- 0.1272492E+01 0.4821346E+00 0.0000000E+00 0.7903577E+00 6 HS- 0.3436803E+00 0.6351441E-01 0.2520789E+00 0.2808701E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1195874E-02 0.1095715E-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- 0.7040096E-02 0.7039852E-02 0.0000000E+00 0.2441083E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.3661E-16 Mass of aqueous solution: 0.121443E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 17.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2262E-01 -1.645 0.4074 -0.390 1.127 8.987 CO2,gas 0.7904 -0.102 34.78 1.541 96.23 425.7 CH4,gas 0.1210E-05 -5.917 0.1941E-04 -4.712 0.5371E-04 0.7814E-03 H2,gas 0.1897E-06 -6.722 0.3831E-06 -6.417 0.1060E-05 0.1208E-03 H2S,gas 0.2809E-01 -1.552 0.9572 -0.019 2.648 14.30 S2,gas 0.9029E-11 -11.044 0.5789E-09 -9.237 0.1602E-08 0.5602E-08 CO,gas 0.2141E-08 -8.669 0.5997E-07 -7.222 0.1659E-06 0.1329E-05 SO3,gas 0.3524E-30 -30.453 0.2821E-28 -28.550 0.7804E-28 0.2186E-27 SO2,gas 0.1600E-12 -12.796 0.1025E-10 -10.989 0.2836E-10 0.9931E-10 HF,gas 0.2441E-06 -6.612 0.4882E-05 -5.311 0.1351E-04 0.1515E-03 HCl,gas 0.1813E-07 -7.742 0.6609E-06 -6.180 0.1828E-05 0.1125E-04 quartz 0.1096E-01 -1.960 0.6583 -0.182 5.758 0.2486 sulfur 0.3361 -0.474 10.78 1.032 94.24 5.213 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 0.9397E+00 0.4699E+02 0.8707 1.612 CH4,gas 0.1439E-05 0.7195E-04 1.0375 -4.127 H2,gas 0.2255E-06 0.1127E-04 1.0270 -4.936 H2S,gas 0.3339E-01 0.1670E+01 0.8293 0.141 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2546E-08 0.1273E-06 1.0000 -6.895 SO3,gas 0.4189E-30 0.2095E-28 1.0000 -28.679 SO2,gas 0.1903E-12 0.9514E-11 1.0000 -11.022 HF,gas 0.2902E-06 0.1451E-04 1.0000 -4.838 HCl,gas 0.2155E-07 0.1078E-05 1.0000 -5.968 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: 2.864341 % Solid products produced: Mass = 11.433837 g Volume = 5.461731 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: 17.5999900 moles log = 1.2455 Original solution: 1000.0103000 g Original solution / Rock added: 56.82 (Water/Rock Ratio), log = 1.7545 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 0.00000E+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 0.22748E-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 -0.34122E-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 0.30331E-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 69 diamond -3.10 -4.01 -0.91 -0.260 0.15517E+04 89 graphite -3.55 -4.01 -0.47 -0.133 0.79398E+03 92 halite 1.57 -3.11 -4.68 -2.342 0.79976E+04 145 pyrite -21.25 -22.46 -1.22 -0.286 0.20779E+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 -20.45 -3.91 -0.434 0.66738E+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: 0.4000000 MOLES Current total amount of reactant added: 17.5999900 MOLES New total amount of reactant added: 17.9999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 17.9999900 Water: Moles liquid = 0.6623E+02 kg liquid = 0.1193E+01 Moles total = 0.6458E+02 kg total = 0.1163E+01 Activity = 0.9918 Stoichiometric ionic strength = .2882871E+00 Osmotic coef. = 0.9148 True ionic strength = .8827446E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1063E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.71601E-01 -1.1451 0.53396E-01 -1.2725 0.74573E+00 -0.1274 2 H2O 0.99178E+00 -0.0036 0.99178E+00 -0.0036 3 Cl- 0.88235E-01 -1.0544 0.64701E-01 -1.1891 0.73328E+00 -0.1347 4 SO4-- 0.58963E-10 -10.2294 0.18796E-10 -10.7259 0.31877E+00 -0.4965 5 HCO3- 0.45128E-05 -5.3456 0.33227E-05 -5.4785 0.73629E+00 -0.1329 6 HS- 0.41956E-06 -6.3772 0.30778E-06 -6.5118 0.73358E+00 -0.1346 7 Al+++ 0.39902E-05 -5.3990 0.30297E-06 -6.5186 0.75929E-01 -1.1196 8 H4SiO4 0.10078E-02 -2.9966 0.10078E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16690E-06 -6.7775 0.52063E-07 -7.2835 0.31193E+00 -0.5059 10 Mg++ 0.67438E-10 -10.1711 0.20766E-10 -10.6826 0.30793E+00 -0.5115 11 Fe++ 0.26184E-07 -7.5820 0.80878E-08 -8.0922 0.30888E+00 -0.5102 12 K+ 0.11827E-03 -3.9271 0.87123E-04 -4.0599 0.73664E+00 -0.1327 13 Na+ 0.16530E-01 -1.7817 0.12112E-01 -1.9168 0.73269E+00 -0.1351 14 Mn++ 0.16167E-08 -8.7914 0.50054E-09 -9.3006 0.30960E+00 -0.5092 15 F- 0.22550E-04 -4.6468 0.16447E-04 -4.7839 0.72935E+00 -0.1371 16 HPO4-- 0.51489E-14 -14.2883 0.16420E-14 -14.7846 0.31889E+00 -0.4964 17 SiF6-2 0.16801E-11 -11.7747 0.53238E-12 -12.2738 0.31687E+00 -0.4991 18 HSiO3- 0.24234E-10 -10.6156 0.17771E-10 -10.7503 0.73328E+00 -0.1347 19 Ca(HSiO3)+ 0.28585E-16 -16.5439 0.21070E-16 -16.6763 0.73710E+00 -0.1325 20 Mg(HSiO3)+ 0.14190E-19 -19.8480 0.10459E-19 -19.9805 0.73710E+00 -0.1325 21 NaHSiO3,aq 0.34811E-11 -11.4583 0.34811E-11 -11.4583 0.10000E+01 0.0000 22 AlO+ 0.19452E-10 -10.7110 0.14338E-10 -10.8435 0.73710E+00 -0.1325 23 AlOH+2 0.12279E-07 -7.9108 0.38121E-08 -8.4188 0.31045E+00 -0.5080 24 HAlO2,aq 0.53036E-13 -13.2754 0.53036E-13 -13.2754 0.10000E+01 0.0000 25 AlO2- 0.30127E-17 -17.5210 0.21987E-17 -17.6578 0.72979E+00 -0.1368 26 CH4,aq 0.55711E-07 -7.2541 0.52418E-07 -7.2805 0.94089E+00 -0.0265 27 C2H6,aq 0.56136E-16 -16.2508 0.52818E-16 -16.2772 0.94089E+00 -0.0265 31 CO,aq 0.86105E-10 -10.0650 0.86105E-10 -10.0650 0.10000E+01 0.0000 32 CO2,aq 0.40626E+00 -0.3912 0.38225E+00 -0.4177 0.94089E+00 -0.0265 33 CO3-2 0.17153E-13 -13.7656 0.54354E-14 -14.2648 0.31687E+00 -0.4991 34 CaCO3,aq 0.35483E-17 -17.4500 0.35483E-17 -17.4500 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.59907E-11 -11.2225 0.44158E-11 -11.3550 0.73710E+00 -0.1325 36 CaCl+ 0.73956E-08 -8.1310 0.54513E-08 -8.2635 0.73710E+00 -0.1325 37 CaCl2,aq 0.83795E-10 -10.0768 0.83795E-10 -10.0768 0.10000E+01 0.0000 38 CaF+ 0.16961E-10 -10.7706 0.12502E-10 -10.9030 0.73710E+00 -0.1325 39 CaOH+ 0.93501E-16 -16.0292 0.68919E-16 -16.1617 0.73710E+00 -0.1325 40 CaSO4,aq 0.31074E-15 -15.5076 0.31074E-15 -15.5076 0.10000E+01 0.0000 41 HCl,aq 0.63306E-03 -3.1986 0.63306E-03 -3.1986 0.10000E+01 0.0000 45 HF,aq 0.60119E-02 -2.2210 0.60119E-02 -2.2210 0.10000E+01 0.0000 46 HF2- 0.45527E-07 -7.3417 0.33384E-07 -7.4765 0.73328E+00 -0.1347 47 Fe+3 0.48548E-17 -17.3138 0.37187E-18 -18.4296 0.76598E-01 -1.1158 48 FeCl+ 0.11237E-08 -8.9494 0.82827E-09 -9.0818 0.73710E+00 -0.1325 49 FeCl2,aq 0.16967E-14 -14.7704 0.16967E-14 -14.7704 0.10000E+01 0.0000 50 FeCl+2 0.55374E-17 -17.2567 0.17191E-17 -17.7647 0.31045E+00 -0.5080 51 FeF+ 0.92220E-11 -11.0352 0.67975E-11 -11.1676 0.73710E+00 -0.1325 52 FeF+2 0.17558E-15 -15.7555 0.54510E-16 -16.2635 0.31045E+00 -0.5080 54 FeOH+ 0.66340E-14 -14.1782 0.48899E-14 -14.3107 0.73710E+00 -0.1325 56 FeO+ 0.16779E-18 -18.7752 0.12368E-18 -18.9077 0.73710E+00 -0.1325 57 FeOH+2 0.40623E-17 -17.3912 0.12611E-17 -17.8992 0.31045E+00 -0.5080 60 H2,aq 0.94521E-08 -8.0245 0.88934E-08 -8.0509 0.94089E+00 -0.0265 61 KCl,aq 0.10216E-06 -6.9907 0.10216E-06 -6.9907 0.10000E+01 0.0000 62 KHSO4,aq 0.24722E-15 -15.6069 0.24722E-15 -15.6069 0.10000E+01 0.0000 63 KOH,aq 0.69108E-15 -15.1605 0.69108E-15 -15.1605 0.10000E+01 0.0000 64 KSO4- 0.34653E-13 -13.4603 0.25410E-13 -13.5950 0.73328E+00 -0.1347 66 Mg(HCO3)+ 0.24417E-14 -14.6123 0.17997E-14 -14.7448 0.73710E+00 -0.1325 67 MgCl+ 0.26736E-11 -11.5729 0.19707E-11 -11.7054 0.73710E+00 -0.1325 68 MgF+ 0.25060E-13 -13.6010 0.18472E-13 -13.7335 0.73710E+00 -0.1325 69 MgOH+ 0.20637E-18 -18.6854 0.15212E-18 -18.8178 0.73710E+00 -0.1325 71 MnF+ 0.18812E-12 -12.7256 0.13866E-12 -12.8580 0.73710E+00 -0.1325 73 MnOH+ 0.38140E-16 -16.4186 0.28113E-16 -16.5511 0.73710E+00 -0.1325 78 MnCl+ 0.27055E-09 -9.5677 0.19942E-09 -9.7002 0.73710E+00 -0.1325 79 MnSO4,aq 0.27160E-17 -17.5661 0.27160E-17 -17.5661 0.10000E+01 0.0000 80 NaCl,aq 0.25970E-03 -3.5855 0.25970E-03 -3.5855 0.10000E+01 0.0000 81 NaF,aq 0.46637E-07 -7.3313 0.46637E-07 -7.3313 0.10000E+01 0.0000 82 NaOH,aq 0.96655E-13 -13.0148 0.96655E-13 -13.0148 0.10000E+01 0.0000 84 OH- 0.14705E-10 -10.8325 0.10732E-10 -10.9693 0.72979E+00 -0.1368 90 H3PO3,aq 0.29029E-19 -19.5372 0.29029E-19 -19.5372 0.10000E+01 0.0000 92 H3PO4,aq 0.32741E-07 -7.4849 0.32741E-07 -7.4849 0.10000E+01 0.0000 93 H2PO4- 0.21998E-08 -8.6576 0.16173E-08 -8.7912 0.73522E+00 -0.1336 95 H4P2O7,aq 0.14251E-16 -16.8462 0.14251E-16 -16.8462 0.10000E+01 0.0000 96 H3P2O7- 0.46468E-17 -17.3328 0.34074E-17 -17.4676 0.73328E+00 -0.1347 97 H2P2O7-2 0.65265E-18 -18.1853 0.20681E-18 -18.6844 0.31687E+00 -0.4991 100 H2S,aq 0.53982E-01 -1.2677 0.50792E-01 -1.2942 0.94089E+00 -0.0265 101 S2-2 0.74484E-15 -15.1279 0.23602E-15 -15.6271 0.31687E+00 -0.4991 102 S3-2 0.57311E-14 -14.2418 0.18160E-14 -14.7409 0.31687E+00 -0.4991 103 S3- 0.93995E-09 -9.0269 0.68925E-09 -9.1616 0.73328E+00 -0.1347 104 S4-2 0.29130E-13 -13.5357 0.92303E-14 -14.0348 0.31687E+00 -0.4991 105 S5-2 0.98726E-13 -13.0056 0.31283E-13 -13.5047 0.31687E+00 -0.4991 106 SO2,aq 0.21638E-11 -11.6648 0.21638E-11 -11.6648 0.10000E+01 0.0000 107 SO3-2 0.66388E-19 -19.1779 0.21902E-19 -19.6595 0.32991E+00 -0.4816 108 HSO3- 0.99857E-13 -13.0006 0.73223E-13 -13.1354 0.73328E+00 -0.1347 109 HSO4- 0.13083E-08 -8.8833 0.96719E-09 -9.0145 0.73929E+00 -0.1312 111 S2O3-2 0.35684E-13 -13.4475 0.11307E-13 -13.9466 0.31687E+00 -0.4991 112 HS2O3- 0.14722E-12 -12.8320 0.10795E-12 -12.9668 0.73328E+00 -0.1347 113 H2S2O3,aq 0.92406E-13 -13.0343 0.92406E-13 -13.0343 0.10000E+01 0.0000 Charge balance for all species = -.4616E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7160130E-01 0.5384882E+00 0.5302715E+03 0.0000 2 H2O 0.1000000E+01 0.5510199E+02 0.9698314E+06 0.0000 3 Cl- 0.8823475E-01 0.8912762E-01 0.3087115E+04 0.0834 4 SO4-- 0.5896347E-10 -.5613908E-07 -.5268689E-02 -8.1810 5 HCO3- 0.4512777E-05 0.4062640E+00 0.2421855E+05 -4.2060 6 HS- 0.4195606E-06 0.5398285E-01 0.1744230E+04 -5.2393 7 Al+++ 0.3990189E-05 0.4002488E-05 0.1055076E+00 -2.7011 8 H4SiO4 0.1007843E-02 0.1007843E-02 0.9463971E+02 -2.9966 9 Ca++ 0.1669040E-06 0.1744063E-06 0.6828979E-02 -4.7385 10 Mg++ 0.6743848E-10 0.7013961E-10 0.1665986E-05 -8.1376 11 Fe++ 0.2618447E-07 0.2731739E-07 0.1490481E-02 -5.5472 12 K+ 0.1182700E-03 0.1183722E-03 0.4522059E+01 -2.7874 13 Na+ 0.1653031E-01 0.1679006E-01 0.3771159E+03 -0.6443 14 Mn++ 0.1616733E-08 0.1887475E-08 0.1013075E-03 -6.7556 15 F- 0.2255029E-04 0.6034585E-02 0.1120064E+03 -3.5114 16 HPO4-- 0.5148944E-14 0.3494119E-07 0.3276433E-02 -12.2396 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1918122E+01 0.6424680E+00 0.4296819E+00 0.8459725E+00 2 H2O 0.6458300E+02 0.6574196E+02 -.3656466E+00 -.7933158E+00 3 Cl- 0.1063378E+00 0.1063378E+00 0.0000000E+00 0.1942241E-07 4 SO4-- 0.8593497E-01 -.6697931E-07 0.8593638E-01 -.1343014E-05 5 HCO3- 0.1301412E+01 0.4847119E+00 0.0000000E+00 0.8167004E+00 6 HS- 0.3514903E+00 0.6440673E-01 0.2578091E+00 0.2927444E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1202454E-02 0.1095057E-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- 0.7200096E-02 0.7199839E-02 0.0000000E+00 0.2566566E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4639E-15 Mass of aqueous solution: 0.122120E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 17.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2338E-01 -1.631 0.4211 -0.376 1.127 9.289 CO2,gas 0.8167 -0.088 35.94 1.556 96.20 439.9 CH4,gas 0.1293E-05 -5.888 0.2074E-04 -4.683 0.5551E-04 0.8348E-03 H2,gas 0.1977E-06 -6.704 0.3993E-06 -6.399 0.1069E-05 0.1259E-03 H2S,gas 0.2927E-01 -1.534 0.9976 -0.001 2.670 14.90 S2,gas 0.9333E-11 -11.030 0.5984E-09 -9.223 0.1602E-08 0.5791E-08 CO,gas 0.2231E-08 -8.651 0.6249E-07 -7.204 0.1673E-06 0.1384E-05 SO3,gas 0.3552E-30 -30.450 0.2844E-28 -28.546 0.7612E-28 0.2204E-27 SO2,gas 0.1627E-12 -12.789 0.1042E-10 -10.982 0.2790E-10 0.1010E-09 HF,gas 0.2567E-06 -6.591 0.5133E-05 -5.290 0.1374E-04 0.1593E-03 HCl,gas 0.1942E-07 -7.712 0.7081E-06 -6.150 0.1895E-05 0.1205E-04 quartz 0.1095E-01 -1.961 0.6579 -0.182 5.634 0.2485 sulfur 0.3437 -0.464 11.02 1.042 94.37 5.332 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 0.9394E+00 0.4697E+02 0.8707 1.612 CH4,gas 0.1487E-05 0.7437E-04 1.0375 -4.113 H2,gas 0.2274E-06 0.1137E-04 1.0270 -4.933 H2S,gas 0.3367E-01 0.1684E+01 0.8293 0.145 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2566E-08 0.1283E-06 1.0000 -6.892 SO3,gas 0.4086E-30 0.2043E-28 1.0000 -28.690 SO2,gas 0.1871E-12 0.9357E-11 1.0000 -11.029 HF,gas 0.2952E-06 0.1476E-04 1.0000 -4.831 HCl,gas 0.2234E-07 0.1117E-05 1.0000 -5.952 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: 2.941302 % Solid products produced: Mass = 11.678391 g Volume = 5.580086 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: 17.9999900 moles log = 1.2553 Original solution: 1000.0103000 g Original solution / Rock added: 55.56 (Water/Rock Ratio), log = 1.7447 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 0.00000E+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 -0.22748E-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 -0.11374E-11 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 -0.30331E-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 69 diamond -3.10 -4.00 -0.90 -0.258 0.15396E+04 89 graphite -3.55 -4.00 -0.46 -0.131 0.78185E+03 92 halite 1.57 -3.11 -4.68 -2.340 0.79917E+04 145 pyrite -21.25 -22.48 -1.24 -0.291 0.21119E+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 -20.51 -3.97 -0.441 0.67708E+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: 0.4000000 MOLES Current total amount of reactant added: 17.9999900 MOLES New total amount of reactant added: 18.3999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 18.3999900 Water: Moles liquid = 0.6659E+02 kg liquid = 0.1200E+01 Moles total = 0.6491E+02 kg total = 0.1169E+01 Activity = 0.9918 Stoichiometric ionic strength = .2892259E+00 Osmotic coef. = 0.9148 True ionic strength = .8973089E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1087E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.73152E-01 -1.1358 0.54475E-01 -1.2638 0.74469E+00 -0.1280 2 H2O 0.99177E+00 -0.0036 0.99177E+00 -0.0036 3 Cl- 0.89691E-01 -1.0472 0.65666E-01 -1.1827 0.73213E+00 -0.1354 4 SO4-- 0.55649E-10 -10.2545 0.17628E-10 -10.7538 0.31677E+00 -0.4993 5 HCO3- 0.44288E-05 -5.3537 0.32559E-05 -5.4873 0.73517E+00 -0.1336 6 HS- 0.41521E-06 -6.3817 0.30411E-06 -6.5170 0.73243E+00 -0.1352 7 Al+++ 0.39688E-05 -5.4013 0.29700E-06 -6.5272 0.74833E-01 -1.1259 8 H4SiO4 0.10078E-02 -2.9966 0.10078E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16592E-06 -6.7801 0.51420E-07 -7.2889 0.30991E+00 -0.5088 10 Mg++ 0.67046E-10 -10.1736 0.20509E-10 -10.6881 0.30589E+00 -0.5144 11 Fe++ 0.26031E-07 -7.5845 0.79874E-08 -8.0976 0.30684E+00 -0.5131 12 K+ 0.11762E-03 -3.9295 0.86514E-04 -4.0629 0.73552E+00 -0.1334 13 Na+ 0.16437E-01 -1.7842 0.12024E-01 -1.9199 0.73154E+00 -0.1358 14 Mn++ 0.16057E-08 -8.7943 0.49384E-09 -9.3064 0.30756E+00 -0.5121 15 F- 0.22509E-04 -4.6476 0.16391E-04 -4.7854 0.72818E+00 -0.1378 16 HPO4-- 0.49566E-14 -14.3048 0.15707E-14 -14.8039 0.31689E+00 -0.4991 17 SiF6-2 0.17943E-11 -11.7461 0.56497E-12 -12.2480 0.31486E+00 -0.5019 18 HSiO3- 0.23791E-10 -10.6236 0.17418E-10 -10.7590 0.73213E+00 -0.1354 19 Ca(HSiO3)+ 0.27715E-16 -16.5573 0.20397E-16 -16.6904 0.73598E+00 -0.1331 20 Mg(HSiO3)+ 0.13757E-19 -19.8615 0.10125E-19 -19.9946 0.73598E+00 -0.1331 21 NaHSiO3,aq 0.33874E-11 -11.4701 0.33874E-11 -11.4701 0.10000E+01 0.0000 22 AlO+ 0.18347E-10 -10.7364 0.13503E-10 -10.8696 0.73598E+00 -0.1331 23 AlOH+2 0.11876E-07 -7.9253 0.36628E-08 -8.4362 0.30842E+00 -0.5109 24 HAlO2,aq 0.48958E-13 -13.3102 0.48958E-13 -13.3102 0.10000E+01 0.0000 25 AlO2- 0.27304E-17 -17.5638 0.19894E-17 -17.7013 0.72862E+00 -0.1375 26 CH4,aq 0.57520E-07 -7.2402 0.54113E-07 -7.2667 0.94077E+00 -0.0265 27 C2H6,aq 0.59355E-16 -16.2265 0.55839E-16 -16.2531 0.94077E+00 -0.0265 31 CO,aq 0.86774E-10 -10.0616 0.86774E-10 -10.0616 0.10000E+01 0.0000 32 CO2,aq 0.40619E+00 -0.3913 0.38214E+00 -0.4178 0.94077E+00 -0.0265 33 CO3-2 0.16580E-13 -13.7804 0.52205E-14 -14.2823 0.31486E+00 -0.5019 34 CaCO3,aq 0.33660E-17 -17.4729 0.33660E-17 -17.4729 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.58066E-11 -11.2361 0.42736E-11 -11.3692 0.73598E+00 -0.1331 36 CaCl+ 0.74246E-08 -8.1293 0.54643E-08 -8.2625 0.73598E+00 -0.1331 37 CaCl2,aq 0.85248E-10 -10.0693 0.85248E-10 -10.0693 0.10000E+01 0.0000 38 CaF+ 0.16719E-10 -10.7768 0.12305E-10 -10.9099 0.73598E+00 -0.1331 39 CaOH+ 0.90653E-16 -16.0426 0.66719E-16 -16.1758 0.73598E+00 -0.1331 40 CaSO4,aq 0.28783E-15 -15.5409 0.28783E-15 -15.5409 0.10000E+01 0.0000 41 HCl,aq 0.65550E-03 -3.1834 0.65550E-03 -3.1834 0.10000E+01 0.0000 45 HF,aq 0.61124E-02 -2.2138 0.61124E-02 -2.2138 0.10000E+01 0.0000 46 HF2- 0.46201E-07 -7.3354 0.33825E-07 -7.4708 0.73213E+00 -0.1354 47 Fe+3 0.49428E-17 -17.3060 0.37318E-18 -18.4281 0.75500E-01 -1.1221 48 FeCl+ 0.11280E-08 -8.9477 0.83020E-09 -9.0808 0.73598E+00 -0.1331 49 FeCl2,aq 0.17260E-14 -14.7630 0.17260E-14 -14.7630 0.10000E+01 0.0000 50 FeCl+2 0.56770E-17 -17.2459 0.17509E-17 -17.7567 0.30842E+00 -0.5109 51 FeF+ 0.90901E-11 -11.0414 0.66901E-11 -11.1746 0.73598E+00 -0.1331 52 FeF+2 0.17676E-15 -15.7526 0.54514E-16 -16.2635 0.30842E+00 -0.5109 54 FeOH+ 0.64316E-14 -14.1917 0.47335E-14 -14.3248 0.73598E+00 -0.1331 56 FeO+ 0.16202E-18 -18.7904 0.11924E-18 -18.9236 0.73598E+00 -0.1331 57 FeOH+2 0.40222E-17 -17.3955 0.12405E-17 -17.9064 0.30842E+00 -0.5109 60 H2,aq 0.95294E-08 -8.0209 0.89650E-08 -8.0474 0.94077E+00 -0.0265 61 KCl,aq 0.10296E-06 -6.9873 0.10296E-06 -6.9873 0.10000E+01 0.0000 62 KHSO4,aq 0.23489E-15 -15.6291 0.23489E-15 -15.6291 0.10000E+01 0.0000 63 KOH,aq 0.67264E-15 -15.1722 0.67264E-15 -15.1722 0.10000E+01 0.0000 64 KSO4- 0.32324E-13 -13.4905 0.23665E-13 -13.6259 0.73213E+00 -0.1354 66 Mg(HCO3)+ 0.23665E-14 -14.6259 0.17417E-14 -14.7590 0.73598E+00 -0.1331 67 MgCl+ 0.26839E-11 -11.5712 0.19753E-11 -11.7044 0.73598E+00 -0.1331 68 MgF+ 0.24702E-13 -13.6073 0.18180E-13 -13.7404 0.73598E+00 -0.1331 69 MgOH+ 0.20007E-18 -18.6988 0.14725E-18 -18.8319 0.73598E+00 -0.1331 71 MnF+ 0.18525E-12 -12.7322 0.13634E-12 -12.8654 0.73598E+00 -0.1331 73 MnOH+ 0.36940E-16 -16.4325 0.27187E-16 -16.5656 0.73598E+00 -0.1331 78 MnCl+ 0.27133E-09 -9.5665 0.19969E-09 -9.6996 0.73598E+00 -0.1331 79 MnSO4,aq 0.25132E-17 -17.5998 0.25132E-17 -17.5998 0.10000E+01 0.0000 80 NaCl,aq 0.26167E-03 -3.5823 0.26167E-03 -3.5823 0.10000E+01 0.0000 81 NaF,aq 0.46140E-07 -7.3359 0.46140E-07 -7.3359 0.10000E+01 0.0000 82 NaOH,aq 0.94054E-13 -13.0266 0.94054E-13 -13.0266 0.10000E+01 0.0000 84 OH- 0.14437E-10 -10.8405 0.10519E-10 -10.9780 0.72862E+00 -0.1375 90 H3PO3,aq 0.29137E-19 -19.5356 0.29137E-19 -19.5356 0.10000E+01 0.0000 92 H3PO4,aq 0.32600E-07 -7.4868 0.32600E-07 -7.4868 0.10000E+01 0.0000 93 H2PO4- 0.21502E-08 -8.6675 0.15785E-08 -8.8018 0.73409E+00 -0.1342 95 H4P2O7,aq 0.14128E-16 -16.8499 0.14128E-16 -16.8499 0.10000E+01 0.0000 96 H3P2O7- 0.45226E-17 -17.3446 0.33112E-17 -17.4800 0.73213E+00 -0.1354 97 H2P2O7-2 0.62561E-18 -18.2037 0.19698E-18 -18.7056 0.31486E+00 -0.5019 100 H2S,aq 0.54424E-01 -1.2642 0.51201E-01 -1.2907 0.94077E+00 -0.0265 101 S2-2 0.72597E-15 -15.1391 0.22858E-15 -15.6410 0.31486E+00 -0.5019 102 S3-2 0.55859E-14 -14.2529 0.17588E-14 -14.7548 0.31486E+00 -0.5019 103 S3- 0.92647E-09 -9.0332 0.67830E-09 -9.1686 0.73213E+00 -0.1354 104 S4-2 0.28392E-13 -13.5468 0.89395E-14 -14.0487 0.31486E+00 -0.5019 105 S5-2 0.96225E-13 -13.0167 0.30298E-13 -13.5186 0.31486E+00 -0.5019 106 SO2,aq 0.21293E-11 -11.6718 0.21293E-11 -11.6718 0.10000E+01 0.0000 107 SO3-2 0.63140E-19 -19.1997 0.20707E-19 -19.6839 0.32795E+00 -0.4842 108 HSO3- 0.96468E-13 -13.0156 0.70628E-13 -13.1510 0.73213E+00 -0.1354 109 HSO4- 0.12537E-08 -8.9018 0.92544E-09 -9.0337 0.73819E+00 -0.1318 111 S2O3-2 0.33952E-13 -13.4691 0.10690E-13 -13.9710 0.31486E+00 -0.5019 112 HS2O3- 0.14222E-12 -12.8470 0.10413E-12 -12.9824 0.73213E+00 -0.1354 113 H2S2O3,aq 0.90933E-13 -13.0413 0.90933E-13 -13.0413 0.10000E+01 0.0000 Charge balance for all species = -.4591E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7315208E-01 0.5405376E+00 0.5322553E+03 0.0000 2 H2O 0.1000000E+01 0.5510206E+02 0.9697700E+06 0.0000 3 Cl- 0.8969138E-01 0.9060866E-01 0.3138211E+04 0.0811 4 SO4-- 0.5564931E-10 -.5803363E-07 -.5446142E-02 -8.2262 5 HCO3- 0.4428777E-05 0.4061978E+00 0.2421304E+05 -4.2235 6 HS- 0.4152055E-06 0.5442464E-01 0.1758391E+04 -5.2532 7 Al+++ 0.3968759E-05 0.3980653E-05 0.1049252E+00 -2.7358 8 H4SiO4 0.1007830E-02 0.1007830E-02 0.9463233E+02 -2.9966 9 Ca++ 0.1659225E-06 0.1734549E-06 0.6791286E-02 -4.7613 10 Mg++ 0.6704597E-10 0.6975697E-10 0.1656791E-05 -8.1605 11 Fe++ 0.2603125E-07 0.2716837E-07 0.1482255E-02 -5.5700 12 K+ 0.1176235E-03 0.1177265E-03 0.4497099E+01 -2.7991 13 Na+ 0.1643675E-01 0.1669846E-01 0.3750344E+03 -0.6561 14 Mn++ 0.1605663E-08 0.1877178E-08 0.1007483E-03 -6.7788 15 F- 0.2250888E-04 0.6135028E-02 0.1138633E+03 -3.5216 16 HPO4-- 0.4956615E-14 0.3475057E-07 0.3258349E-02 -12.2763 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.1961192E+01 0.6484507E+00 0.4392323E+00 0.8735094E+00 2 H2O 0.6491048E+02 0.6610265E+02 -.3732738E+00 -.8188954E+00 3 Cl- 0.1086978E+00 0.1086978E+00 0.0000000E+00 0.2076541E-07 4 SO4-- 0.8784497E-01 -.6961949E-07 0.8784647E-01 -.1430314E-05 5 HCO3- 0.1330332E+01 0.4872913E+00 0.0000000E+00 0.8430411E+00 6 HS- 0.3593003E+00 0.6528999E-01 0.2635394E+00 0.3047090E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1209033E-02 0.1094399E-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- 0.7360096E-02 0.7359827E-02 0.0000000E+00 0.2694403E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2147E-15 Mass of aqueous solution: 0.122798E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 18.3999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2414E-01 -1.617 0.4348 -0.362 1.127 9.592 CO2,gas 0.8430 -0.074 37.10 1.569 96.18 454.1 CH4,gas 0.1378E-05 -5.861 0.2211E-04 -4.655 0.5731E-04 0.8898E-03 H2,gas 0.2058E-06 -6.687 0.4156E-06 -6.381 0.1077E-05 0.1311E-03 H2S,gas 0.3047E-01 -1.516 1.038 0.016 2.692 15.51 S2,gas 0.9636E-11 -11.016 0.6179E-09 -9.209 0.1602E-08 0.5979E-08 CO,gas 0.2322E-08 -8.634 0.6503E-07 -7.187 0.1686E-06 0.1441E-05 SO3,gas 0.3580E-30 -30.446 0.2867E-28 -28.543 0.7431E-28 0.2222E-27 SO2,gas 0.1653E-12 -12.782 0.1059E-10 -10.975 0.2745E-10 0.1026E-09 HF,gas 0.2694E-06 -6.570 0.5389E-05 -5.269 0.1397E-04 0.1672E-03 HCl,gas 0.2077E-07 -7.683 0.7571E-06 -6.121 0.1963E-05 0.1288E-04 quartz 0.1094E-01 -1.961 0.6575 -0.182 5.515 0.2483 sulfur 0.3514 -0.454 11.27 1.052 94.49 5.450 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 0.9392E+00 0.4696E+02 0.8707 1.612 CH4,gas 0.1535E-05 0.7677E-04 1.0375 -4.099 H2,gas 0.2292E-06 0.1146E-04 1.0270 -4.929 H2S,gas 0.3394E-01 0.1697E+01 0.8293 0.148 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2586E-08 0.1293E-06 1.0000 -6.888 SO3,gas 0.3989E-30 0.1994E-28 1.0000 -28.700 SO2,gas 0.1842E-12 0.9208E-11 1.0000 -11.036 HF,gas 0.3002E-06 0.1501E-04 1.0000 -4.824 HCl,gas 0.2313E-07 0.1157E-05 1.0000 -5.937 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: 3.017289 % Solid products produced: Mass = 11.922946 g Volume = 5.698442 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: 18.3999900 moles log = 1.2648 Original solution: 1000.0103000 g Original solution / Rock added: 54.35 (Water/Rock Ratio), log = 1.7352 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 0.00000E+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 -0.60662E-11 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 -0.11374E-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 69 diamond -3.10 -4.00 -0.89 -0.256 0.15279E+04 89 graphite -3.55 -4.00 -0.45 -0.129 0.77015E+03 92 halite 1.57 -3.10 -4.68 -2.339 0.79861E+04 145 pyrite -21.25 -22.50 -1.26 -0.296 0.21449E+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 -20.57 -4.02 -0.447 0.68649E+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: 0.4000000 MOLES Current total amount of reactant added: 18.3999900 MOLES New total amount of reactant added: 18.7999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 18.7999900 Water: Moles liquid = 0.6695E+02 kg liquid = 0.1206E+01 Moles total = 0.6524E+02 kg total = 0.1175E+01 Activity = 0.9918 Stoichiometric ionic strength = .2901518E+00 Osmotic coef. = 0.9148 True ionic strength = .9117126E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1111E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.74686E-01 -1.1268 0.55541E-01 -1.2554 0.74367E+00 -0.1286 2 H2O 0.99176E+00 -0.0036 0.99176E+00 -0.0036 3 Cl- 0.91132E-01 -1.0403 0.66619E-01 -1.1764 0.73102E+00 -0.1361 4 SO4-- 0.52626E-10 -10.2788 0.16568E-10 -10.7807 0.31483E+00 -0.5019 5 HCO3- 0.43490E-05 -5.3616 0.31925E-05 -5.4959 0.73408E+00 -0.1343 6 HS- 0.41103E-06 -6.3861 0.30059E-06 -6.5220 0.73132E+00 -0.1359 7 Al+++ 0.39475E-05 -5.4037 0.29125E-06 -6.5357 0.73779E-01 -1.1321 8 H4SiO4 0.10078E-02 -2.9966 0.10078E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16495E-06 -6.7826 0.50796E-07 -7.2942 0.30794E+00 -0.5115 10 Mg++ 0.66658E-10 -10.1761 0.20258E-10 -10.6934 0.30391E+00 -0.5172 11 Fe++ 0.25880E-07 -7.5870 0.78899E-08 -8.1029 0.30486E+00 -0.5159 12 K+ 0.11698E-03 -3.9319 0.85916E-04 -4.0659 0.73443E+00 -0.1341 13 Na+ 0.16344E-01 -1.7866 0.11938E-01 -1.9231 0.73041E+00 -0.1364 14 Mn++ 0.15948E-08 -8.7973 0.48734E-09 -9.3122 0.30559E+00 -0.5149 15 F- 0.22471E-04 -4.6484 0.16337E-04 -4.7868 0.72704E+00 -0.1384 16 HPO4-- 0.47768E-14 -14.3209 0.15045E-14 -14.8226 0.31495E+00 -0.5018 17 SiF6-2 0.19134E-11 -11.7182 0.59873E-12 -12.2228 0.31292E+00 -0.5046 18 HSiO3- 0.23370E-10 -10.6313 0.17084E-10 -10.7674 0.73102E+00 -0.1361 19 Ca(HSiO3)+ 0.26892E-16 -16.5704 0.19763E-16 -16.7042 0.73489E+00 -0.1338 20 Mg(HSiO3)+ 0.13348E-19 -19.8746 0.98090E-20 -20.0084 0.73489E+00 -0.1338 21 NaHSiO3,aq 0.32986E-11 -11.4817 0.32986E-11 -11.4817 0.10000E+01 0.0000 22 AlO+ 0.17334E-10 -10.7611 0.12738E-10 -10.8949 0.73489E+00 -0.1338 23 AlOH+2 0.11496E-07 -7.9394 0.35229E-08 -8.4531 0.30645E+00 -0.5136 24 HAlO2,aq 0.45299E-13 -13.3439 0.45299E-13 -13.3439 0.10000E+01 0.0000 25 AlO2- 0.24817E-17 -17.6053 0.18054E-17 -17.7434 0.72748E+00 -0.1382 26 CH4,aq 0.59321E-07 -7.2268 0.55800E-07 -7.2534 0.94066E+00 -0.0266 27 C2H6,aq 0.62634E-16 -16.2032 0.58917E-16 -16.2298 0.94066E+00 -0.0266 31 CO,aq 0.87425E-10 -10.0584 0.87425E-10 -10.0584 0.10000E+01 0.0000 32 CO2,aq 0.40613E+00 -0.3913 0.38203E+00 -0.4179 0.94066E+00 -0.0266 33 CO3-2 0.16045E-13 -13.7947 0.50206E-14 -14.2992 0.31292E+00 -0.5046 34 CaCO3,aq 0.31977E-17 -17.4952 0.31977E-17 -17.4952 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.56327E-11 -11.2493 0.41394E-11 -11.3831 0.73489E+00 -0.1338 36 CaCl+ 0.74518E-08 -8.1277 0.54763E-08 -8.2615 0.73489E+00 -0.1338 37 CaCl2,aq 0.86674E-10 -10.0621 0.86674E-10 -10.0621 0.10000E+01 0.0000 38 CaF+ 0.16487E-10 -10.7829 0.12116E-10 -10.9166 0.73489E+00 -0.1338 39 CaOH+ 0.87963E-16 -16.0557 0.64643E-16 -16.1895 0.73489E+00 -0.1338 40 CaSO4,aq 0.26724E-15 -15.5731 0.26724E-15 -15.5731 0.10000E+01 0.0000 41 HCl,aq 0.67803E-03 -3.1688 0.67803E-03 -3.1688 0.10000E+01 0.0000 45 HF,aq 0.62118E-02 -2.2068 0.62118E-02 -2.2068 0.10000E+01 0.0000 46 HF2- 0.46871E-07 -7.3291 0.34264E-07 -7.4652 0.73102E+00 -0.1361 47 Fe+3 0.50292E-17 -17.2985 0.37438E-18 -18.4267 0.74442E-01 -1.1282 48 FeCl+ 0.11321E-08 -8.9461 0.83196E-09 -9.0799 0.73489E+00 -0.1338 49 FeCl2,aq 0.17547E-14 -14.7558 0.17547E-14 -14.7558 0.10000E+01 0.0000 50 FeCl+2 0.58151E-17 -17.2354 0.17820E-17 -17.7491 0.30645E+00 -0.5136 51 FeF+ 0.89633E-11 -11.0475 0.65870E-11 -11.1813 0.73489E+00 -0.1338 52 FeF+2 0.17789E-15 -15.7499 0.54513E-16 -16.2635 0.30645E+00 -0.5136 54 FeOH+ 0.62403E-14 -14.2048 0.45859E-14 -14.3386 0.73489E+00 -0.1338 56 FeO+ 0.15659E-18 -18.8052 0.11508E-18 -18.9390 0.73489E+00 -0.1338 57 FeOH+2 0.39831E-17 -17.3998 0.12206E-17 -17.9134 0.30645E+00 -0.5136 60 H2,aq 0.96047E-08 -8.0175 0.90347E-08 -8.0441 0.94066E+00 -0.0266 61 KCl,aq 0.10374E-06 -6.9841 0.10374E-06 -6.9841 0.10000E+01 0.0000 62 KHSO4,aq 0.22353E-15 -15.6507 0.22353E-15 -15.6507 0.10000E+01 0.0000 63 KOH,aq 0.65517E-15 -15.1836 0.65517E-15 -15.1836 0.10000E+01 0.0000 64 KSO4- 0.30216E-13 -13.5198 0.22089E-13 -13.6558 0.73102E+00 -0.1361 66 Mg(HCO3)+ 0.22955E-14 -14.6391 0.16869E-14 -14.7729 0.73489E+00 -0.1338 67 MgCl+ 0.26936E-11 -11.5697 0.19795E-11 -11.7034 0.73489E+00 -0.1338 68 MgF+ 0.24357E-13 -13.6134 0.17900E-13 -13.7472 0.73489E+00 -0.1338 69 MgOH+ 0.19412E-18 -18.7119 0.14266E-18 -18.8457 0.73489E+00 -0.1338 71 MnF+ 0.18249E-12 -12.7388 0.13411E-12 -12.8725 0.73489E+00 -0.1338 73 MnOH+ 0.35807E-16 -16.4460 0.26314E-16 -16.5798 0.73489E+00 -0.1338 78 MnCl+ 0.27205E-09 -9.5654 0.19992E-09 -9.6991 0.73489E+00 -0.1338 79 MnSO4,aq 0.23310E-17 -17.6325 0.23310E-17 -17.6325 0.10000E+01 0.0000 80 NaCl,aq 0.26356E-03 -3.5791 0.26356E-03 -3.5791 0.10000E+01 0.0000 81 NaF,aq 0.45661E-07 -7.3405 0.45661E-07 -7.3405 0.10000E+01 0.0000 82 NaOH,aq 0.91588E-13 -13.0382 0.91588E-13 -13.0382 0.10000E+01 0.0000 84 OH- 0.14182E-10 -10.8483 0.10317E-10 -10.9864 0.72748E+00 -0.1382 90 H3PO3,aq 0.29237E-19 -19.5341 0.29237E-19 -19.5341 0.10000E+01 0.0000 92 H3PO4,aq 0.32459E-07 -7.4887 0.32459E-07 -7.4887 0.10000E+01 0.0000 93 H2PO4- 0.21030E-08 -8.6772 0.15415E-08 -8.8121 0.73299E+00 -0.1349 95 H4P2O7,aq 0.14006E-16 -16.8537 0.14006E-16 -16.8537 0.10000E+01 0.0000 96 H3P2O7- 0.44042E-17 -17.3561 0.32196E-17 -17.4922 0.73102E+00 -0.1361 97 H2P2O7-2 0.60034E-18 -18.2216 0.18786E-18 -18.7262 0.31292E+00 -0.5046 100 H2S,aq 0.54854E-01 -1.2608 0.51599E-01 -1.2874 0.94066E+00 -0.0266 101 S2-2 0.70818E-15 -15.1499 0.22160E-15 -15.6544 0.31292E+00 -0.5046 102 S3-2 0.54490E-14 -14.2637 0.17051E-14 -14.7683 0.31292E+00 -0.5046 103 S3- 0.91361E-09 -9.0392 0.66786E-09 -9.1753 0.73102E+00 -0.1361 104 S4-2 0.27696E-13 -13.5576 0.86665E-14 -14.0622 0.31292E+00 -0.5046 105 S5-2 0.93866E-13 -13.0275 0.29372E-13 -13.5321 0.31292E+00 -0.5046 106 SO2,aq 0.20966E-11 -11.6785 0.20966E-11 -11.6785 0.10000E+01 0.0000 107 SO3-2 0.60155E-19 -19.2207 0.19613E-19 -19.7074 0.32605E+00 -0.4867 108 HSO3- 0.93304E-13 -13.0301 0.68207E-13 -13.1662 0.73102E+00 -0.1361 109 HSO4- 0.12031E-08 -8.9197 0.88682E-09 -9.0522 0.73712E+00 -0.1325 111 S2O3-2 0.32359E-13 -13.4900 0.10126E-13 -13.9946 0.31292E+00 -0.5046 112 HS2O3- 0.13756E-12 -12.8615 0.10056E-12 -12.9976 0.73102E+00 -0.1361 113 H2S2O3,aq 0.89534E-13 -13.0480 0.89534E-13 -13.0480 0.10000E+01 0.0000 Charge balance for all species = -.4566E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7468571E-01 0.5425592E+00 0.5342119E+03 0.0000 2 H2O 0.1000000E+01 0.5510212E+02 0.9697093E+06 0.0000 3 Cl- 0.9113193E-01 0.9207363E-01 0.3188747E+04 0.0790 4 SO4-- 0.5262578E-10 -.5991495E-07 -.5622336E-02 -8.2700 5 HCO3- 0.4349009E-05 0.4061340E+00 0.2420769E+05 -4.2405 6 HS- 0.4110281E-06 0.5485443E-01 0.1772164E+04 -5.2666 7 Al+++ 0.3947542E-05 0.3959055E-05 0.1043493E+00 -2.7696 8 H4SiO4 0.1007816E-02 0.1007816E-02 0.9462506E+02 -2.9966 9 Ca++ 0.1649532E-06 0.1725138E-06 0.6754009E-02 -4.7834 10 Mg++ 0.6665822E-10 0.6937850E-10 0.1647697E-05 -8.1826 11 Fe++ 0.2587990E-07 0.2702096E-07 0.1474118E-02 -5.5922 12 K+ 0.1169840E-03 0.1170877E-03 0.4472414E+01 -2.8105 13 Na+ 0.1634425E-01 0.1660786E-01 0.3729758E+03 -0.6677 14 Mn++ 0.1594763E-08 0.1866994E-08 0.1001953E-03 -6.8014 15 F- 0.2247107E-04 0.6234380E-02 0.1156999E+03 -3.5314 16 HPO4-- 0.4776771E-14 0.3456203E-07 0.3240464E-02 -12.3118 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2004262E+01 0.6544266E+00 0.4487828E+00 0.9010530E+00 2 H2O 0.6523796E+02 0.6646333E+02 -.3809011E+00 -.8444727E+00 3 Cl- 0.1110578E+00 0.1110578E+00 0.0000000E+00 0.2215621E-07 4 SO4-- 0.8975497E-01 -.7226850E-07 0.8975656E-01 -.1520156E-05 5 HCO3- 0.1359252E+01 0.4898726E+00 0.0000000E+00 0.8693797E+00 6 HS- 0.3671103E+00 0.6616457E-01 0.2692697E+00 0.3167604E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1215613E-02 0.1093741E-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- 0.7520096E-02 0.7519814E-02 0.0000000E+00 0.2824556E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.2350E-16 Mass of aqueous solution: 0.123476E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 18.7999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2490E-01 -1.604 0.4485 -0.348 1.127 9.894 CO2,gas 0.8694 -0.061 38.26 1.583 96.16 468.2 CH4,gas 0.1466E-05 -5.834 0.2352E-04 -4.629 0.5910E-04 0.9465E-03 H2,gas 0.2139E-06 -6.670 0.4321E-06 -6.364 0.1086E-05 0.1363E-03 H2S,gas 0.3167E-01 -1.499 1.079 0.033 2.713 16.13 S2,gas 0.9940E-11 -11.003 0.6374E-09 -9.196 0.1602E-08 0.6168E-08 CO,gas 0.2413E-08 -8.617 0.6758E-07 -7.170 0.1698E-06 0.1497E-05 SO3,gas 0.3608E-30 -30.443 0.2889E-28 -28.539 0.7261E-28 0.2239E-27 SO2,gas 0.1679E-12 -12.775 0.1076E-10 -10.968 0.2703E-10 0.1042E-09 HF,gas 0.2825E-06 -6.549 0.5649E-05 -5.248 0.1420E-04 0.1753E-03 HCl,gas 0.2216E-07 -7.655 0.8078E-06 -6.093 0.2030E-05 0.1375E-04 quartz 0.1094E-01 -1.961 0.6571 -0.182 5.401 0.2482 sulfur 0.3590 -0.445 11.51 1.061 94.60 5.569 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 0.9389E+00 0.4694E+02 0.8707 1.611 CH4,gas 0.1583E-05 0.7917E-04 1.0375 -4.085 H2,gas 0.2310E-06 0.1155E-04 1.0270 -4.926 H2S,gas 0.3421E-01 0.1710E+01 0.8293 0.152 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2606E-08 0.1303E-06 1.0000 -6.885 SO3,gas 0.3897E-30 0.1949E-28 1.0000 -28.710 SO2,gas 0.1813E-12 0.9066E-11 1.0000 -11.043 HF,gas 0.3050E-06 0.1525E-04 1.0000 -4.817 HCl,gas 0.2393E-07 0.1196E-05 1.0000 -5.922 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: 3.092320 % Solid products produced: Mass = 12.167501 g Volume = 5.816798 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: 18.7999900 moles log = 1.2742 Original solution: 1000.0103000 g Original solution / Rock added: 53.19 (Water/Rock Ratio), log = 1.7258 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 0.00000E+00 3 CH4,gas 4.54 4.54 0.00 0.000 0.45496E-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 0.00000E+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 0.22748E-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 69 diamond -3.10 -3.99 -0.89 -0.254 0.15166E+04 89 graphite -3.55 -3.99 -0.44 -0.127 0.75887E+03 92 halite 1.57 -3.10 -4.67 -2.337 0.79808E+04 145 pyrite -21.25 -22.52 -1.27 -0.300 0.21770E+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 -20.62 -4.07 -0.453 0.69561E+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: 0.4000000 MOLES Current total amount of reactant added: 18.7999900 MOLES New total amount of reactant added: 19.1999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 19.1999900 Water: Moles liquid = 0.6732E+02 kg liquid = 0.1213E+01 Moles total = 0.6557E+02 kg total = 0.1181E+01 Activity = 0.9918 Stoichiometric ionic strength = .2910650E+00 Osmotic coef. = 0.9147 True ionic strength = .9259580E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1134E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.76202E-01 -1.1180 0.56593E-01 -1.2472 0.74267E+00 -0.1292 2 H2O 0.99176E+00 -0.0036 0.99176E+00 -0.0036 3 Cl- 0.92557E-01 -1.0336 0.67560E-01 -1.1703 0.72993E+00 -0.1367 4 SO4-- 0.49860E-10 -10.3022 0.15603E-10 -10.8068 0.31294E+00 -0.5045 5 HCO3- 0.42732E-05 -5.3693 0.31323E-05 -5.5041 0.73301E+00 -0.1349 6 HS- 0.40702E-06 -6.3904 0.29722E-06 -6.5269 0.73023E+00 -0.1365 7 Al+++ 0.39265E-05 -5.4060 0.28571E-06 -6.5441 0.72764E-01 -1.1381 8 H4SiO4 0.10078E-02 -2.9966 0.10078E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16400E-06 -6.7852 0.50188E-07 -7.2994 0.30603E+00 -0.5142 10 Mg++ 0.66275E-10 -10.1786 0.20015E-10 -10.6986 0.30200E+00 -0.5200 11 Fe++ 0.25730E-07 -7.5896 0.77950E-08 -8.1082 0.30295E+00 -0.5186 12 K+ 0.11635E-03 -3.9342 0.85327E-04 -4.0689 0.73336E+00 -0.1347 13 Na+ 0.16253E-01 -1.7891 0.11853E-01 -1.9262 0.72932E+00 -0.1371 14 Mn++ 0.15840E-08 -8.8002 0.48103E-09 -9.3178 0.30367E+00 -0.5176 15 F- 0.22437E-04 -4.6490 0.16287E-04 -4.7881 0.72593E+00 -0.1391 16 HPO4-- 0.46083E-14 -14.3365 0.14427E-14 -14.8408 0.31307E+00 -0.5044 17 SiF6-2 0.20373E-11 -11.6909 0.63366E-12 -12.1981 0.31103E+00 -0.5072 18 HSiO3- 0.22969E-10 -10.6388 0.16766E-10 -10.7756 0.72993E+00 -0.1367 19 Ca(HSiO3)+ 0.26114E-16 -16.5831 0.19163E-16 -16.7175 0.73383E+00 -0.1344 20 Mg(HSiO3)+ 0.12961E-19 -19.8874 0.95108E-20 -20.0218 0.73383E+00 -0.1344 21 NaHSiO3,aq 0.32143E-11 -11.4929 0.32143E-11 -11.4929 0.10000E+01 0.0000 22 AlO+ 0.16401E-10 -10.7851 0.12036E-10 -10.9195 0.73383E+00 -0.1344 23 AlOH+2 0.11137E-07 -7.9532 0.33917E-08 -8.4696 0.30453E+00 -0.5164 24 HAlO2,aq 0.42004E-13 -13.3767 0.42004E-13 -13.3767 0.10000E+01 0.0000 25 AlO2- 0.22619E-17 -17.6455 0.16429E-17 -17.7844 0.72637E+00 -0.1388 26 CH4,aq 0.61113E-07 -7.2139 0.57479E-07 -7.2405 0.94054E+00 -0.0266 27 C2H6,aq 0.65972E-16 -16.1806 0.62050E-16 -16.2073 0.94054E+00 -0.0266 31 CO,aq 0.88057E-10 -10.0552 0.88057E-10 -10.0552 0.10000E+01 0.0000 32 CO2,aq 0.40607E+00 -0.3914 0.38192E+00 -0.4180 0.94054E+00 -0.0266 33 CO3-2 0.15543E-13 -13.8085 0.48343E-14 -14.3157 0.31103E+00 -0.5072 34 CaCO3,aq 0.30422E-17 -17.5168 0.30422E-17 -17.5168 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.54682E-11 -11.2622 0.40127E-11 -11.3966 0.73383E+00 -0.1344 36 CaCl+ 0.74775E-08 -8.1262 0.54872E-08 -8.2607 0.73383E+00 -0.1344 37 CaCl2,aq 0.88073E-10 -10.0552 0.88073E-10 -10.0552 0.10000E+01 0.0000 38 CaF+ 0.16263E-10 -10.7888 0.11934E-10 -10.9232 0.73383E+00 -0.1344 39 CaOH+ 0.85417E-16 -16.0685 0.62682E-16 -16.2029 0.73383E+00 -0.1344 40 CaSO4,aq 0.24867E-15 -15.6044 0.24867E-15 -15.6044 0.10000E+01 0.0000 41 HCl,aq 0.70063E-03 -3.1545 0.70063E-03 -3.1545 0.10000E+01 0.0000 45 HF,aq 0.63101E-02 -2.2000 0.63101E-02 -2.2000 0.10000E+01 0.0000 46 HF2- 0.47538E-07 -7.3230 0.34699E-07 -7.4597 0.72993E+00 -0.1367 47 Fe+3 0.51139E-17 -17.2912 0.37548E-18 -18.4254 0.73424E-01 -1.1342 48 FeCl+ 0.11359E-08 -8.9447 0.83356E-09 -9.0791 0.73383E+00 -0.1344 49 FeCl2,aq 0.17830E-14 -14.7489 0.17830E-14 -14.7489 0.10000E+01 0.0000 50 FeCl+2 0.59517E-17 -17.2254 0.18125E-17 -17.7417 0.30453E+00 -0.5164 51 FeF+ 0.88411E-11 -11.0535 0.64878E-11 -11.1879 0.73383E+00 -0.1344 52 FeF+2 0.17898E-15 -15.7472 0.54505E-16 -16.2636 0.30453E+00 -0.5164 54 FeOH+ 0.60593E-14 -14.2176 0.44465E-14 -14.3520 0.73383E+00 -0.1344 56 FeO+ 0.15149E-18 -18.8196 0.11116E-18 -18.9540 0.73383E+00 -0.1344 57 FeOH+2 0.39451E-17 -17.4039 0.12014E-17 -17.9203 0.30453E+00 -0.5164 60 H2,aq 0.96779E-08 -8.0142 0.91025E-08 -8.0408 0.94054E+00 -0.0266 61 KCl,aq 0.10448E-06 -6.9810 0.10448E-06 -6.9810 0.10000E+01 0.0000 62 KHSO4,aq 0.21304E-15 -15.6715 0.21304E-15 -15.6715 0.10000E+01 0.0000 63 KOH,aq 0.63858E-15 -15.1948 0.63858E-15 -15.1948 0.10000E+01 0.0000 64 KSO4- 0.28304E-13 -13.5481 0.20660E-13 -13.6849 0.72993E+00 -0.1367 66 Mg(HCO3)+ 0.22283E-14 -14.6520 0.16352E-14 -14.7864 0.73383E+00 -0.1344 67 MgCl+ 0.27027E-11 -11.5682 0.19833E-11 -11.7026 0.73383E+00 -0.1344 68 MgF+ 0.24025E-13 -13.6193 0.17630E-13 -13.7537 0.73383E+00 -0.1344 69 MgOH+ 0.18850E-18 -18.7247 0.13832E-18 -18.8591 0.73383E+00 -0.1344 71 MnF+ 0.17983E-12 -12.7451 0.13196E-12 -12.8795 0.73383E+00 -0.1344 73 MnOH+ 0.34736E-16 -16.4592 0.25490E-16 -16.5936 0.73383E+00 -0.1344 78 MnCl+ 0.27271E-09 -9.5643 0.20012E-09 -9.6987 0.73383E+00 -0.1344 79 MnSO4,aq 0.21668E-17 -17.6642 0.21668E-17 -17.6642 0.10000E+01 0.0000 80 NaCl,aq 0.26539E-03 -3.5761 0.26539E-03 -3.5761 0.10000E+01 0.0000 81 NaF,aq 0.45199E-07 -7.3449 0.45199E-07 -7.3449 0.10000E+01 0.0000 82 NaOH,aq 0.89248E-13 -13.0494 0.89248E-13 -13.0494 0.10000E+01 0.0000 84 OH- 0.13939E-10 -10.8558 0.10125E-10 -10.9946 0.72637E+00 -0.1388 90 H3PO3,aq 0.29328E-19 -19.5327 0.29328E-19 -19.5327 0.10000E+01 0.0000 92 H3PO4,aq 0.32318E-07 -7.4906 0.32318E-07 -7.4906 0.10000E+01 0.0000 93 H2PO4- 0.20579E-08 -8.6866 0.15062E-08 -8.8221 0.73192E+00 -0.1355 95 H4P2O7,aq 0.13884E-16 -16.8575 0.13884E-16 -16.8575 0.10000E+01 0.0000 96 H3P2O7- 0.42912E-17 -17.3674 0.31322E-17 -17.5041 0.72993E+00 -0.1367 97 H2P2O7-2 0.57668E-18 -18.2391 0.17936E-18 -18.7463 0.31103E+00 -0.5072 100 H2S,aq 0.55272E-01 -1.2575 0.51986E-01 -1.2841 0.94054E+00 -0.0266 101 S2-2 0.69138E-15 -15.1603 0.21504E-15 -15.6675 0.31103E+00 -0.5072 102 S3-2 0.53197E-14 -14.2741 0.16546E-14 -14.7813 0.31103E+00 -0.5072 103 S3- 0.90132E-09 -9.0451 0.65790E-09 -9.1818 0.72993E+00 -0.1367 104 S4-2 0.27039E-13 -13.5680 0.84099E-14 -14.0752 0.31103E+00 -0.5072 105 S5-2 0.91640E-13 -13.0379 0.28503E-13 -13.5451 0.31103E+00 -0.5072 106 SO2,aq 0.20655E-11 -11.6850 0.20655E-11 -11.6850 0.10000E+01 0.0000 107 SO3-2 0.57403E-19 -19.2411 0.18610E-19 -19.7303 0.32420E+00 -0.4892 108 HSO3- 0.90343E-13 -13.0441 0.65944E-13 -13.1808 0.72993E+00 -0.1367 109 HSO4- 0.11561E-08 -8.9370 0.85101E-09 -9.0701 0.73607E+00 -0.1331 111 S2O3-2 0.30890E-13 -13.5102 0.96077E-14 -14.0174 0.31103E+00 -0.5072 112 HS2O3- 0.13319E-12 -12.8755 0.97220E-13 -13.0122 0.72993E+00 -0.1367 113 H2S2O3,aq 0.88204E-13 -13.0545 0.88204E-13 -13.0545 0.10000E+01 0.0000 Charge balance for all species = -.4541E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7620247E-01 0.5445537E+00 0.5361420E+03 0.0000 2 H2O 0.1000000E+01 0.5510218E+02 0.9696494E+06 0.0000 3 Cl- 0.9255666E-01 0.9352279E-01 0.3238731E+04 0.0769 4 SO4-- 0.4986003E-10 -.6178278E-07 -.5797245E-02 -8.3123 5 HCO3- 0.4273155E-05 0.4060725E+00 0.2420250E+05 -4.2569 6 HS- 0.4070165E-06 0.5527272E-01 0.1785565E+04 -5.2797 7 Al+++ 0.3926537E-05 0.3937691E-05 0.1037796E+00 -2.8024 8 H4SiO4 0.1007804E-02 0.1007804E-02 0.9461790E+02 -2.9966 9 Ca++ 0.1639956E-06 0.1715828E-06 0.6717139E-02 -4.8049 10 Mg++ 0.6627513E-10 0.6900410E-10 0.1638702E-05 -8.2042 11 Fe++ 0.2573039E-07 0.2687515E-07 0.1466071E-02 -5.6137 12 K+ 0.1163514E-03 0.1164559E-03 0.4448000E+01 -2.8217 13 Na+ 0.1625280E-01 0.1651824E-01 0.3709398E+03 -0.6789 14 Mn++ 0.1584029E-08 0.1856919E-08 0.9964836E-04 -6.8234 15 F- 0.2243655E-04 0.6332660E-02 0.1175164E+03 -3.5409 16 HPO4-- 0.4608293E-14 0.3437552E-07 0.3222775E-02 -12.3463 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2047332E+01 0.6603960E+00 0.4583333E+00 0.9286031E+00 2 H2O 0.6556544E+02 0.6682402E+02 -.3885283E+00 -.8700480E+00 3 Cl- 0.1134178E+00 0.1134178E+00 0.0000000E+00 0.2359481E-07 4 SO4-- 0.9166497E-01 -.7492577E-07 0.9166665E-01 -.1612501E-05 5 HCO3- 0.1388172E+01 0.4924559E+00 0.0000000E+00 0.8957165E+00 6 HS- 0.3749203E+00 0.6703083E-01 0.2750000E+00 0.3288950E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1222193E-02 0.1093083E-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- 0.7680096E-02 0.7679800E-02 0.0000000E+00 0.2956988E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2554E-15 Mass of aqueous solution: 0.124154E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 19.1999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2567E-01 -1.591 0.4622 -0.335 1.127 10.20 CO2,gas 0.8957 -0.048 39.42 1.596 96.14 482.4 CH4,gas 0.1556E-05 -5.808 0.2496E-04 -4.603 0.6088E-04 0.1005E-02 H2,gas 0.2221E-06 -6.653 0.4486E-06 -6.348 0.1094E-05 0.1415E-03 H2S,gas 0.3289E-01 -1.483 1.121 0.050 2.733 16.74 S2,gas 0.1024E-10 -10.990 0.6569E-09 -9.183 0.1602E-08 0.6356E-08 CO,gas 0.2504E-08 -8.601 0.7015E-07 -7.154 0.1711E-06 0.1554E-05 SO3,gas 0.3636E-30 -30.439 0.2911E-28 -28.536 0.7100E-28 0.2256E-27 SO2,gas 0.1705E-12 -12.768 0.1092E-10 -10.962 0.2663E-10 0.1058E-09 HF,gas 0.2957E-06 -6.529 0.5914E-05 -5.228 0.1442E-04 0.1835E-03 HCl,gas 0.2359E-07 -7.627 0.8603E-06 -6.065 0.2098E-05 0.1464E-04 quartz 0.1093E-01 -1.961 0.6567 -0.183 5.291 0.2480 sulfur 0.3667 -0.436 11.76 1.070 94.71 5.687 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 0.9386E+00 0.4693E+02 0.8707 1.611 CH4,gas 0.1631E-05 0.8155E-04 1.0375 -4.073 H2,gas 0.2327E-06 0.1164E-04 1.0270 -4.923 H2S,gas 0.3446E-01 0.1723E+01 0.8293 0.155 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2624E-08 0.1312E-06 1.0000 -6.882 SO3,gas 0.3811E-30 0.1905E-28 1.0000 -28.720 SO2,gas 0.1786E-12 0.8932E-11 1.0000 -11.049 HF,gas 0.3099E-06 0.1549E-04 1.0000 -4.810 HCl,gas 0.2473E-07 0.1236E-05 1.0000 -5.908 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: 3.166411 % Solid products produced: Mass = 12.412056 g Volume = 5.935154 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: 19.1999900 moles log = 1.2833 Original solution: 1000.0103000 g Original solution / Rock added: 52.08 (Water/Rock Ratio), log = 1.7167 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 0.00000E+00 3 CH4,gas 4.54 4.54 0.00 0.000 0.45496E-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 0.00000E+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 69 diamond -3.10 -3.98 -0.88 -0.252 0.15057E+04 89 graphite -3.55 -3.98 -0.44 -0.125 0.74798E+03 92 halite 1.57 -3.10 -4.67 -2.336 0.79757E+04 145 pyrite -21.25 -22.54 -1.29 -0.304 0.22082E+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 -20.67 -4.13 -0.458 0.70448E+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: 0.4000000 MOLES Current total amount of reactant added: 19.1999900 MOLES New total amount of reactant added: 19.5999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 19.5999900 Water: Moles liquid = 0.6768E+02 kg liquid = 0.1219E+01 Moles total = 0.6589E+02 kg total = 0.1187E+01 Activity = 0.9918 Stoichiometric ionic strength = .2919659E+00 Osmotic coef. = 0.9147 True ionic strength = .9400480E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1158E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.77703E-01 -1.1096 0.57632E-01 -1.2393 0.74170E+00 -0.1298 2 H2O 0.99175E+00 -0.0036 0.99175E+00 -0.0036 3 Cl- 0.93966E-01 -1.0270 0.68489E-01 -1.1644 0.72887E+00 -0.1374 4 SO4-- 0.47324E-10 -10.3249 0.14723E-10 -10.8320 0.31111E+00 -0.5071 5 HCO3- 0.42009E-05 -5.3767 0.30750E-05 -5.5122 0.73197E+00 -0.1355 6 HS- 0.40316E-06 -6.3945 0.29397E-06 -6.5317 0.72917E+00 -0.1372 7 Al+++ 0.39057E-05 -5.4083 0.28038E-06 -6.5523 0.71786E-01 -1.1440 8 H4SiO4 0.10078E-02 -2.9966 0.10078E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16305E-06 -6.7877 0.49596E-07 -7.3046 0.30418E+00 -0.5169 10 Mg++ 0.65897E-10 -10.1811 0.19778E-10 -10.7038 0.30013E+00 -0.5227 11 Fe++ 0.25583E-07 -7.5921 0.77026E-08 -8.1134 0.30109E+00 -0.5213 12 K+ 0.11573E-03 -3.9366 0.84748E-04 -4.0719 0.73232E+00 -0.1353 13 Na+ 0.16162E-01 -1.7915 0.11770E-01 -1.9292 0.72825E+00 -0.1377 14 Mn++ 0.15735E-08 -8.8031 0.47489E-09 -9.3234 0.30182E+00 -0.5203 15 F- 0.22405E-04 -4.6497 0.16240E-04 -4.7894 0.72485E+00 -0.1398 16 HPO4-- 0.44502E-14 -14.3516 0.13851E-14 -14.8585 0.31124E+00 -0.5069 17 SiF6-2 0.21661E-11 -11.6643 0.66975E-12 -12.1741 0.30920E+00 -0.5098 18 HSiO3- 0.22588E-10 -10.6461 0.16464E-10 -10.7835 0.72887E+00 -0.1374 19 Ca(HSiO3)+ 0.25376E-16 -16.5956 0.18596E-16 -16.7306 0.73279E+00 -0.1350 20 Mg(HSiO3)+ 0.12594E-19 -19.8998 0.92287E-20 -20.0349 0.73279E+00 -0.1350 21 NaHSiO3,aq 0.31341E-11 -11.5039 0.31341E-11 -11.5039 0.10000E+01 0.0000 22 AlO+ 0.15542E-10 -10.8085 0.11389E-10 -10.9435 0.73279E+00 -0.1350 23 AlOH+2 0.10798E-07 -7.9666 0.32684E-08 -8.4857 0.30268E+00 -0.5190 24 HAlO2,aq 0.39030E-13 -13.4086 0.39030E-13 -13.4086 0.10000E+01 0.0000 25 AlO2- 0.20669E-17 -17.6847 0.14991E-17 -17.8242 0.72529E+00 -0.1395 26 CH4,aq 0.62895E-07 -7.2014 0.59148E-07 -7.2281 0.94043E+00 -0.0267 27 C2H6,aq 0.69366E-16 -16.1589 0.65234E-16 -16.1855 0.94043E+00 -0.0267 31 CO,aq 0.88672E-10 -10.0522 0.88672E-10 -10.0522 0.10000E+01 0.0000 32 CO2,aq 0.40601E+00 -0.3915 0.38182E+00 -0.4181 0.94043E+00 -0.0267 33 CO3-2 0.15072E-13 -13.8218 0.46603E-14 -14.3316 0.30920E+00 -0.5098 34 CaCO3,aq 0.28982E-17 -17.5379 0.28982E-17 -17.5379 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.53124E-11 -11.2747 0.38929E-11 -11.4097 0.73279E+00 -0.1350 36 CaCl+ 0.75015E-08 -8.1249 0.54970E-08 -8.2599 0.73279E+00 -0.1350 37 CaCl2,aq 0.89445E-10 -10.0484 0.89445E-10 -10.0484 0.10000E+01 0.0000 38 CaF+ 0.16048E-10 -10.7946 0.11760E-10 -10.9296 0.73279E+00 -0.1350 39 CaOH+ 0.83005E-16 -16.0809 0.60826E-16 -16.2159 0.73279E+00 -0.1350 40 CaSO4,aq 0.23187E-15 -15.6347 0.23187E-15 -15.6347 0.10000E+01 0.0000 41 HCl,aq 0.72330E-03 -3.1407 0.72330E-03 -3.1407 0.10000E+01 0.0000 45 HF,aq 0.64073E-02 -2.1933 0.64073E-02 -2.1933 0.10000E+01 0.0000 46 HF2- 0.48201E-07 -7.3169 0.35132E-07 -7.4543 0.72887E+00 -0.1374 47 Fe+3 0.51970E-17 -17.2842 0.37648E-18 -18.4243 0.72442E-01 -1.1400 48 FeCl+ 0.11395E-08 -8.9433 0.83501E-09 -9.0783 0.73279E+00 -0.1350 49 FeCl2,aq 0.18106E-14 -14.7422 0.18106E-14 -14.7422 0.10000E+01 0.0000 50 FeCl+2 0.60867E-17 -17.2156 0.18423E-17 -17.7346 0.30268E+00 -0.5190 51 FeF+ 0.87234E-11 -11.0593 0.63924E-11 -11.1943 0.73279E+00 -0.1350 52 FeF+2 0.18004E-15 -15.7446 0.54493E-16 -16.2637 0.30268E+00 -0.5190 54 FeOH+ 0.58879E-14 -14.2300 0.43146E-14 -14.3651 0.73279E+00 -0.1350 56 FeO+ 0.14667E-18 -18.8337 0.10748E-18 -18.9687 0.73279E+00 -0.1350 57 FeOH+2 0.39081E-17 -17.4080 0.11829E-17 -17.9271 0.30268E+00 -0.5190 60 H2,aq 0.97492E-08 -8.0110 0.91685E-08 -8.0377 0.94043E+00 -0.0267 61 KCl,aq 0.10520E-06 -6.9780 0.10520E-06 -6.9780 0.10000E+01 0.0000 62 KHSO4,aq 0.20332E-15 -15.6918 0.20332E-15 -15.6918 0.10000E+01 0.0000 63 KOH,aq 0.62281E-15 -15.2056 0.62281E-15 -15.2056 0.10000E+01 0.0000 64 KSO4- 0.26565E-13 -13.5757 0.19362E-13 -13.7130 0.72887E+00 -0.1374 66 Mg(HCO3)+ 0.21647E-14 -14.6646 0.15862E-14 -14.7996 0.73279E+00 -0.1350 67 MgCl+ 0.27112E-11 -11.5668 0.19868E-11 -11.7019 0.73279E+00 -0.1350 68 MgF+ 0.23706E-13 -13.6251 0.17371E-13 -13.7602 0.73279E+00 -0.1350 69 MgOH+ 0.18316E-18 -18.7372 0.13422E-18 -18.8722 0.73279E+00 -0.1350 71 MnF+ 0.17727E-12 -12.7514 0.12990E-12 -12.8864 0.73279E+00 -0.1350 73 MnOH+ 0.33722E-16 -16.4721 0.24711E-16 -16.6071 0.73279E+00 -0.1350 78 MnCl+ 0.27332E-09 -9.5633 0.20029E-09 -9.6984 0.73279E+00 -0.1350 79 MnSO4,aq 0.20185E-17 -17.6950 0.20185E-17 -17.6950 0.10000E+01 0.0000 80 NaCl,aq 0.26715E-03 -3.5732 0.26715E-03 -3.5732 0.10000E+01 0.0000 81 NaF,aq 0.44752E-07 -7.3492 0.44752E-07 -7.3492 0.10000E+01 0.0000 82 NaOH,aq 0.87023E-13 -13.0604 0.87023E-13 -13.0604 0.10000E+01 0.0000 84 OH- 0.13708E-10 -10.8630 0.99425E-11 -11.0025 0.72529E+00 -0.1395 90 H3PO3,aq 0.29411E-19 -19.5315 0.29411E-19 -19.5315 0.10000E+01 0.0000 92 H3PO4,aq 0.32176E-07 -7.4925 0.32176E-07 -7.4925 0.10000E+01 0.0000 93 H2PO4- 0.20148E-08 -8.6958 0.14726E-08 -8.8319 0.73087E+00 -0.1362 95 H4P2O7,aq 0.13763E-16 -16.8613 0.13763E-16 -16.8613 0.10000E+01 0.0000 96 H3P2O7- 0.41831E-17 -17.3785 0.30489E-17 -17.5159 0.72887E+00 -0.1374 97 H2P2O7-2 0.55449E-18 -18.2561 0.17145E-18 -18.7659 0.30920E+00 -0.5098 100 H2S,aq 0.55679E-01 -1.2543 0.52363E-01 -1.2810 0.94043E+00 -0.0267 101 S2-2 0.67549E-15 -15.1704 0.20886E-15 -15.6801 0.30920E+00 -0.5098 102 S3-2 0.51975E-14 -14.2842 0.16070E-14 -14.7940 0.30920E+00 -0.5098 103 S3- 0.88957E-09 -9.0508 0.64838E-09 -9.1882 0.72887E+00 -0.1374 104 S4-2 0.26417E-13 -13.5781 0.81682E-14 -14.0879 0.30920E+00 -0.5098 105 S5-2 0.89534E-13 -13.0480 0.27683E-13 -13.5578 0.30920E+00 -0.5098 106 SO2,aq 0.20358E-11 -11.6913 0.20358E-11 -11.6913 0.10000E+01 0.0000 107 SO3-2 0.54861E-19 -19.2607 0.17688E-19 -19.7523 0.32241E+00 -0.4916 108 HSO3- 0.87568E-13 -13.0577 0.63826E-13 -13.1950 0.72887E+00 -0.1374 109 HSO4- 0.11125E-08 -8.9537 0.81774E-09 -9.0874 0.73506E+00 -0.1337 111 S2O3-2 0.29533E-13 -13.5297 0.91314E-14 -14.0395 0.30920E+00 -0.5098 112 HS2O3- 0.12910E-12 -12.8891 0.94097E-13 -13.0264 0.72887E+00 -0.1374 113 H2S2O3,aq 0.86938E-13 -13.0608 0.86938E-13 -13.0608 0.10000E+01 0.0000 Charge balance for all species = -.4517E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7770264E-01 0.5465217E+00 0.5380462E+03 0.0000 2 H2O 0.1000000E+01 0.5510224E+02 0.9695903E+06 0.0000 3 Cl- 0.9396582E-01 0.9495639E-01 0.3288173E+04 0.0750 4 SO4-- 0.4732366E-10 -.6363684E-07 -.5970847E-02 -8.3533 5 HCO3- 0.4200932E-05 0.4060131E+00 0.2419746E+05 -4.2728 6 HS- 0.4031599E-06 0.5567995E-01 0.1798609E+04 -5.2924 7 Al+++ 0.3905742E-05 0.3916556E-05 0.1032162E+00 -2.8343 8 H4SiO4 0.1007791E-02 0.1007791E-02 0.9461086E+02 -2.9966 9 Ca++ 0.1630496E-06 0.1706619E-06 0.6680671E-02 -4.8259 10 Mg++ 0.6589661E-10 0.6863373E-10 0.1629806E-05 -8.2252 11 Fe++ 0.2558267E-07 0.2673090E-07 0.1458112E-02 -5.6347 12 K+ 0.1157256E-03 0.1158308E-03 0.4423851E+01 -2.8325 13 Na+ 0.1616238E-01 0.1642958E-01 0.3689259E+03 -0.6899 14 Mn++ 0.1573456E-08 0.1846952E-08 0.9910735E-04 -6.8447 15 F- 0.2240504E-04 0.6429884E-02 0.1193132E+03 -3.5501 16 HPO4-- 0.4450187E-14 0.3419101E-07 0.3205278E-02 -12.3799 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2090402E+01 0.6663593E+00 0.4678838E+00 0.9561593E+00 2 H2O 0.6589292E+02 0.6718470E+02 -.3961555E+00 -.8956213E+00 3 Cl- 0.1157778E+00 0.1157778E+00 0.0000000E+00 0.2508119E-07 4 SO4-- 0.9357497E-01 -.7759070E-07 0.9357675E-01 -.1707313E-05 5 HCO3- 0.1417092E+01 0.4950409E+00 0.0000000E+00 0.9220514E+00 6 HS- 0.3827303E+00 0.6788909E-01 0.2807303E+00 0.3411095E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1228773E-02 0.1092425E-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- 0.7840096E-02 0.7839787E-02 0.0000000E+00 0.3091664E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1589E-15 Mass of aqueous solution: 0.124831E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 19.5999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2643E-01 -1.578 0.4759 -0.322 1.127 10.50 CO2,gas 0.9220 -0.035 40.58 1.608 96.12 496.6 CH4,gas 0.1649E-05 -5.783 0.2645E-04 -4.578 0.6265E-04 0.1065E-02 H2,gas 0.2303E-06 -6.638 0.4653E-06 -6.332 0.1102E-05 0.1467E-03 H2S,gas 0.3411E-01 -1.467 1.162 0.065 2.753 17.36 S2,gas 0.1055E-10 -10.977 0.6763E-09 -9.170 0.1602E-08 0.6545E-08 CO,gas 0.2597E-08 -8.586 0.7274E-07 -7.138 0.1723E-06 0.1611E-05 SO3,gas 0.3664E-30 -30.436 0.2933E-28 -28.533 0.6948E-28 0.2273E-27 SO2,gas 0.1730E-12 -12.762 0.1108E-10 -10.955 0.2625E-10 0.1074E-09 HF,gas 0.3092E-06 -6.510 0.6183E-05 -5.209 0.1465E-04 0.1918E-03 HCl,gas 0.2508E-07 -7.601 0.9145E-06 -6.039 0.2166E-05 0.1556E-04 quartz 0.1092E-01 -1.962 0.6563 -0.183 5.186 0.2479 sulfur 0.3743 -0.427 12.00 1.079 94.81 5.806 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2689E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9384E+00 0.4692E+02 0.8707 1.611 CH4,gas 0.1678E-05 0.8392E-04 1.0375 -4.060 H2,gas 0.2344E-06 0.1172E-04 1.0270 -4.919 H2S,gas 0.3471E-01 0.1736E+01 0.8293 0.158 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2643E-08 0.1321E-06 1.0000 -6.879 SO3,gas 0.3729E-30 0.1864E-28 1.0000 -28.729 SO2,gas 0.1761E-12 0.8804E-11 1.0000 -11.055 HF,gas 0.3146E-06 0.1573E-04 1.0000 -4.803 HCl,gas 0.2553E-07 0.1276E-05 1.0000 -5.894 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: 3.239582 % Solid products produced: Mass = 12.656611 g Volume = 6.053510 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: 19.5999900 moles log = 1.2923 Original solution: 1000.0103000 g Original solution / Rock added: 51.02 (Water/Rock Ratio), log = 1.7077 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 0.00000E+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 -0.15165E-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 0.00000E+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 -0.11374E-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 69 diamond -3.10 -3.98 -0.88 -0.250 0.14952E+04 89 graphite -3.55 -3.98 -0.43 -0.123 0.73745E+03 92 halite 1.57 -3.09 -4.67 -2.334 0.79708E+04 145 pyrite -21.25 -22.56 -1.31 -0.309 0.22387E+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 -20.72 -4.18 -0.464 0.71310E+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: 0.4000000 MOLES Current total amount of reactant added: 19.5999900 MOLES New total amount of reactant added: 19.9999900 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 = 21 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 19.9999900 Water: Moles liquid = 0.6804E+02 kg liquid = 0.1226E+01 Moles total = 0.6622E+02 kg total = 0.1193E+01 Activity = 0.9917 Stoichiometric ionic strength = .2928547E+00 Osmotic coef. = 0.9147 True ionic strength = .9539850E-01 Chg. balance for total moles = -.5508E-08 Max. difference allowed = 0.1181E-04 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.79186E-01 -1.1013 0.58658E-01 -1.2317 0.74076E+00 -0.1303 2 H2O 0.99175E+00 -0.0036 0.99175E+00 -0.0036 3 Cl- 0.95360E-01 -1.0206 0.69406E-01 -1.1586 0.72784E+00 -0.1380 4 SO4-- 0.44992E-10 -10.3469 0.13918E-10 -10.8564 0.30934E+00 -0.5096 5 HCO3- 0.41321E-05 -5.3838 0.30204E-05 -5.5199 0.73096E+00 -0.1361 6 HS- 0.39945E-06 -6.3985 0.29086E-06 -6.5363 0.72814E+00 -0.1378 7 Al+++ 0.38852E-05 -5.4106 0.27523E-06 -6.5603 0.70842E-01 -1.1497 8 H4SiO4 0.10078E-02 -2.9966 0.10078E-02 -2.9966 0.10000E+01 0.0000 9 Ca++ 0.16211E-06 -6.7902 0.49020E-07 -7.3096 0.30238E+00 -0.5195 10 Mg++ 0.65523E-10 -10.1836 0.19547E-10 -10.7089 0.29832E+00 -0.5253 11 Fe++ 0.25437E-07 -7.5945 0.76127E-08 -8.1185 0.29928E+00 -0.5239 12 K+ 0.11511E-03 -3.9389 0.84179E-04 -4.0748 0.73131E+00 -0.1359 13 Na+ 0.16073E-01 -1.7939 0.11688E-01 -1.9322 0.72721E+00 -0.1383 14 Mn++ 0.15630E-08 -8.8060 0.46893E-09 -9.3289 0.30001E+00 -0.5229 15 F- 0.22376E-04 -4.6502 0.16196E-04 -4.7906 0.72380E+00 -0.1404 16 HPO4-- 0.43016E-14 -14.3664 0.13312E-14 -14.8758 0.30947E+00 -0.5094 17 SiF6-2 0.22999E-11 -11.6383 0.70702E-12 -12.1506 0.30741E+00 -0.5123 18 HSiO3- 0.22224E-10 -10.6532 0.16176E-10 -10.7911 0.72784E+00 -0.1380 19 Ca(HSiO3)+ 0.24677E-16 -16.6077 0.18058E-16 -16.7433 0.73178E+00 -0.1356 20 Mg(HSiO3)+ 0.12246E-19 -19.9120 0.89614E-20 -20.0476 0.73178E+00 -0.1356 21 NaHSiO3,aq 0.30579E-11 -11.5146 0.30579E-11 -11.5146 0.10000E+01 0.0000 22 AlO+ 0.14748E-10 -10.8313 0.10792E-10 -10.9669 0.73178E+00 -0.1356 23 AlOH+2 0.10477E-07 -7.9798 0.31523E-08 -8.5014 0.30087E+00 -0.5216 24 HAlO2,aq 0.36339E-13 -13.4396 0.36339E-13 -13.4396 0.10000E+01 0.0000 25 AlO2- 0.18935E-17 -17.7227 0.13713E-17 -17.8629 0.72424E+00 -0.1401 26 CH4,aq 0.64668E-07 -7.1893 0.60808E-07 -7.2160 0.94032E+00 -0.0267 27 C2H6,aq 0.72812E-16 -16.1378 0.68466E-16 -16.1645 0.94032E+00 -0.0267 31 CO,aq 0.89271E-10 -10.0493 0.89271E-10 -10.0493 0.10000E+01 0.0000 32 CO2,aq 0.40595E+00 -0.3915 0.38172E+00 -0.4183 0.94032E+00 -0.0267 33 CO3-2 0.14630E-13 -13.8347 0.44976E-14 -14.3470 0.30741E+00 -0.5123 34 CaCO3,aq 0.27645E-17 -17.5584 0.27645E-17 -17.5584 0.10000E+01 0.0000 35 Ca(HCO3)+ 0.51646E-11 -11.2870 0.37794E-11 -11.4226 0.73178E+00 -0.1356 36 CaCl+ 0.75240E-08 -8.1235 0.55060E-08 -8.2592 0.73178E+00 -0.1356 37 CaCl2,aq 0.90790E-10 -10.0420 0.90790E-10 -10.0420 0.10000E+01 0.0000 38 CaF+ 0.15840E-10 -10.8003 0.11591E-10 -10.9359 0.73178E+00 -0.1356 39 CaOH+ 0.80717E-16 -16.0930 0.59067E-16 -16.2287 0.73178E+00 -0.1356 40 CaSO4,aq 0.21665E-15 -15.6643 0.21665E-15 -15.6643 0.10000E+01 0.0000 41 HCl,aq 0.74604E-03 -3.1272 0.74604E-03 -3.1272 0.10000E+01 0.0000 45 HF,aq 0.65036E-02 -2.1868 0.65036E-02 -2.1868 0.10000E+01 0.0000 46 HF2- 0.48860E-07 -7.3110 0.35562E-07 -7.4490 0.72784E+00 -0.1380 47 Fe+3 0.52785E-17 -17.2775 0.37739E-18 -18.4232 0.71496E-01 -1.1457 48 FeCl+ 0.11428E-08 -8.9420 0.83632E-09 -9.0776 0.73178E+00 -0.1356 49 FeCl2,aq 0.18377E-14 -14.7357 0.18377E-14 -14.7357 0.10000E+01 0.0000 50 FeCl+2 0.62202E-17 -17.2062 0.18715E-17 -17.7278 0.30087E+00 -0.5216 51 FeF+ 0.86098E-11 -11.0650 0.63005E-11 -11.2006 0.73178E+00 -0.1356 52 FeF+2 0.18106E-15 -15.7422 0.54475E-16 -16.2638 0.30087E+00 -0.5216 54 FeOH+ 0.57252E-14 -14.2422 0.41896E-14 -14.3778 0.73178E+00 -0.1356 56 FeO+ 0.14212E-18 -18.8473 0.10400E-18 -18.9830 0.73178E+00 -0.1356 57 FeOH+2 0.38721E-17 -17.4121 0.11650E-17 -17.9337 0.30087E+00 -0.5216 60 H2,aq 0.98187E-08 -8.0079 0.92327E-08 -8.0347 0.94032E+00 -0.0267 61 KCl,aq 0.10589E-06 -6.9751 0.10589E-06 -6.9751 0.10000E+01 0.0000 62 KHSO4,aq 0.19430E-15 -15.7115 0.19430E-15 -15.7115 0.10000E+01 0.0000 63 KOH,aq 0.60780E-15 -15.2162 0.60780E-15 -15.2162 0.10000E+01 0.0000 64 KSO4- 0.24978E-13 -13.6024 0.18180E-13 -13.7404 0.72784E+00 -0.1380 66 Mg(HCO3)+ 0.21043E-14 -14.6769 0.15399E-14 -14.8125 0.73178E+00 -0.1356 67 MgCl+ 0.27192E-11 -11.5656 0.19899E-11 -11.7012 0.73178E+00 -0.1356 68 MgF+ 0.23397E-13 -13.6308 0.17122E-13 -13.7665 0.73178E+00 -0.1356 69 MgOH+ 0.17810E-18 -18.7493 0.13033E-18 -18.8849 0.73178E+00 -0.1356 71 MnF+ 0.17481E-12 -12.7574 0.12792E-12 -12.8931 0.73178E+00 -0.1356 73 MnOH+ 0.32761E-16 -16.4846 0.23974E-16 -16.6203 0.73178E+00 -0.1356 78 MnCl+ 0.27388E-09 -9.5624 0.20042E-09 -9.6981 0.73178E+00 -0.1356 79 MnSO4,aq 0.18841E-17 -17.7249 0.18841E-17 -17.7249 0.10000E+01 0.0000 80 NaCl,aq 0.26885E-03 -3.5705 0.26885E-03 -3.5705 0.10000E+01 0.0000 81 NaF,aq 0.44319E-07 -7.3534 0.44319E-07 -7.3534 0.10000E+01 0.0000 82 NaOH,aq 0.84906E-13 -13.0711 0.84906E-13 -13.0711 0.10000E+01 0.0000 84 OH- 0.13488E-10 -10.8701 0.97685E-11 -11.0102 0.72424E+00 -0.1401 90 H3PO3,aq 0.29487E-19 -19.5304 0.29487E-19 -19.5304 0.10000E+01 0.0000 92 H3PO4,aq 0.32035E-07 -7.4944 0.32035E-07 -7.4944 0.10000E+01 0.0000 93 H2PO4- 0.19736E-08 -8.7047 0.14405E-08 -8.8415 0.72985E+00 -0.1368 95 H4P2O7,aq 0.13643E-16 -16.8651 0.13643E-16 -16.8651 0.10000E+01 0.0000 96 H3P2O7- 0.40797E-17 -17.3894 0.29694E-17 -17.5273 0.72784E+00 -0.1380 97 H2P2O7-2 0.53365E-18 -18.2727 0.16405E-18 -18.7850 0.30741E+00 -0.5123 100 H2S,aq 0.56076E-01 -1.2512 0.52729E-01 -1.2779 0.94032E+00 -0.0267 101 S2-2 0.66044E-15 -15.1802 0.20303E-15 -15.6924 0.30741E+00 -0.5123 102 S3-2 0.50817E-14 -14.2940 0.15622E-14 -14.8063 0.30741E+00 -0.5123 103 S3- 0.87831E-09 -9.0564 0.63927E-09 -9.1943 0.72784E+00 -0.1380 104 S4-2 0.25829E-13 -13.5879 0.79402E-14 -14.1002 0.30741E+00 -0.5123 105 S5-2 0.87540E-13 -13.0578 0.26911E-13 -13.5701 0.30741E+00 -0.5123 106 SO2,aq 0.20076E-11 -11.6973 0.20076E-11 -11.6973 0.10000E+01 0.0000 107 SO3-2 0.52507E-19 -19.2798 0.16837E-19 -19.7737 0.32067E+00 -0.4939 108 HSO3- 0.84963E-13 -13.0708 0.61839E-13 -13.2087 0.72784E+00 -0.1380 109 HSO4- 0.10718E-08 -8.9699 0.78677E-09 -9.1042 0.73407E+00 -0.1343 111 S2O3-2 0.28276E-13 -13.5486 0.86924E-14 -14.0609 0.30741E+00 -0.5123 112 HS2O3- 0.12526E-12 -12.9022 0.91168E-13 -13.0402 0.72784E+00 -0.1380 113 H2S2O3,aq 0.85731E-13 -13.0669 0.85731E-13 -13.0669 0.10000E+01 0.0000 Charge balance for all species = -.4493E-08 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.7918650E-01 0.5484638E+00 0.5399252E+03 0.0000 2 H2O 0.1000000E+01 0.5510230E+02 0.9695320E+06 0.0000 3 Cl- 0.9535968E-01 0.9637468E-01 0.3337082E+04 0.0731 4 SO4-- 0.4499206E-10 -.6547690E-07 -.6143117E-02 -8.3931 5 HCO3- 0.4132081E-05 0.4059557E+00 0.2419256E+05 -4.2883 6 HS- 0.3994484E-06 0.5607657E-01 0.1811310E+04 -5.3047 7 Al+++ 0.3885154E-05 0.3895646E-05 0.1026589E+00 -2.8653 8 H4SiO4 0.1007779E-02 0.1007779E-02 0.9460392E+02 -2.9966 9 Ca++ 0.1621149E-06 0.1697508E-06 0.6644598E-02 -4.8463 10 Mg++ 0.6552257E-10 0.6826731E-10 0.1621005E-05 -8.2456 11 Fe++ 0.2543672E-07 0.2658819E-07 0.1450239E-02 -5.6551 12 K+ 0.1151065E-03 0.1152124E-03 0.4399964E+01 -2.8431 13 Na+ 0.1607297E-01 0.1634187E-01 0.3669338E+03 -0.7006 14 Mn++ 0.1563040E-08 0.1837091E-08 0.9857221E-04 -6.8656 15 F- 0.2237629E-04 0.6526071E-02 0.1210906E+03 -3.5589 16 HPO4-- 0.4301569E-14 0.3400847E-07 0.3187970E-02 -12.4124 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.2133472E+01 0.6723167E+00 0.4774343E+00 0.9837214E+00 2 H2O 0.6622040E+02 0.6754538E+02 -.4037827E+00 -.9211927E+00 3 Cl- 0.1181378E+00 0.1181378E+00 0.0000000E+00 0.2661530E-07 4 SO4-- 0.9548497E-01 -.8026274E-07 0.9548685E-01 -.1804551E-05 5 HCO3- 0.1446012E+01 0.4976277E+00 0.0000000E+00 0.9483846E+00 6 HS- 0.3905403E+00 0.6873966E-01 0.2864606E+00 0.3534008E-01 7 Al+++ 0.4775352E-05 0.4775352E-05 0.0000000E+00 0.0000000E+00 8 H4SiO4 0.1215302E-01 0.1235353E-02 0.1091767E-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- 0.8000096E-02 0.7999773E-02 0.0000000E+00 0.3228547E-06 16 HPO4-- 0.4168819E-07 0.4168819E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1627E-15 Mass of aqueous solution: 0.125509E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 19.9999900 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) H2O,gas 0.2719E-01 -1.566 0.4897 -0.310 1.127 10.80 CO2,gas 0.9484 -0.023 41.74 1.621 96.10 510.8 CH4,gas 0.1744E-05 -5.758 0.2798E-04 -4.553 0.6442E-04 0.1126E-02 H2,gas 0.2386E-06 -6.622 0.4820E-06 -6.317 0.1110E-05 0.1520E-03 H2S,gas 0.3534E-01 -1.452 1.204 0.081 2.773 17.99 S2,gas 0.1085E-10 -10.964 0.6958E-09 -9.157 0.1602E-08 0.6734E-08 CO,gas 0.2690E-08 -8.570 0.7534E-07 -7.123 0.1735E-06 0.1669E-05 SO3,gas 0.3691E-30 -30.433 0.2955E-28 -28.529 0.6805E-28 0.2290E-27 SO2,gas 0.1755E-12 -12.756 0.1124E-10 -10.949 0.2589E-10 0.1089E-09 HF,gas 0.3229E-06 -6.491 0.6457E-05 -5.190 0.1487E-04 0.2003E-03 HCl,gas 0.2662E-07 -7.575 0.9704E-06 -6.013 0.2234E-05 0.1651E-04 quartz 0.1092E-01 -1.962 0.6559 -0.183 5.084 0.2477 sulfur 0.3819 -0.418 12.25 1.088 94.92 5.924 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity H2O,gas 0.2689E-01 0.1345E+01 0.7419 -0.001 CO2,gas 0.9381E+00 0.4691E+02 0.8707 1.611 CH4,gas 0.1725E-05 0.8627E-04 1.0375 -4.048 H2,gas 0.2361E-06 0.1180E-04 1.0270 -4.916 H2S,gas 0.3496E-01 0.1748E+01 0.8293 0.161 S2,gas 0.1074E-10 0.5368E-09 1.0000 -9.270 CO,gas 0.2661E-08 0.1330E-06 1.0000 -6.876 SO3,gas 0.3651E-30 0.1826E-28 1.0000 -28.739 SO2,gas 0.1736E-12 0.8682E-11 1.0000 -11.061 HF,gas 0.3194E-06 0.1597E-04 1.0000 -4.797 HCl,gas 0.2633E-07 0.1316E-05 1.0000 -5.881 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: 3.311847 % Solid products produced: Mass = 12.901167 g Volume = 6.171867 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: 19.9999900 moles log = 1.3010 Original solution: 1000.0103000 g Original solution / Rock added: 50.00 (Water/Rock Ratio), log = 1.6990 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 0.00000E+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 0.00000E+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 -0.22748E-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 -0.34122E-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 0.00000E+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 69 diamond -3.10 -3.97 -0.87 -0.248 0.14850E+04 89 graphite -3.55 -3.97 -0.43 -0.122 0.72728E+03 92 halite 1.57 -3.09 -4.67 -2.333 0.79661E+04 145 pyrite -21.25 -22.58 -1.33 -0.313 0.22684E+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 -20.77 -4.23 -0.469 0.72149E+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: 0.4000000 MOLES Current total amount of reactant added: 19.9999900 MOLES New total amount of reactant added: 20.3999900 MOLES Mixing fraction reached given limit of 0.2000E+02 TOTMIX = 0.2040E+02 Execution stopped.