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. -0.53194E-04 0.68610E-07 0.9614 0.00000000E+00 H2O 2 0. 0.55508E+02 0.10000E+01 1.0000 0.00000000E+00 Cl- 3 -1. 0.13797E-03 0.13796E-03 0.9613 0.00000000E+00 SO4-- 4 -2. 0.25615E-04 0.25143E-04 0.9012 0.00000000E+00 HCO3- 5 -1. 0.13070E-04 0.11488E-04 0.9613 0.00000000E+00 HS- 6 -1. -0.11085E-06 0.19769E-06 0.9613 0.00000000E+00 Al+++ 7 3. 0.13043E-04 0.26527E-18 0.8089 0.00000000E+00 H4SiO4 8 0. 0.41651E-04 0.41045E-04 1.0000 0.00000000E+00 Ca++ 9 2. 0.19072E-04 0.18918E-04 0.9010 0.00000000E+00 Mg++ 10 2. 0.31746E-05 0.31553E-05 0.9010 0.00000000E+00 Fe++ 11 2. 0.28520E-05 0.40273E-07 0.9010 0.00000000E+00 K+ 12 1. 0.84926E-06 0.84895E-06 0.9613 0.00000000E+00 Na+ 13 1. 0.16509E-03 0.16508E-03 0.9613 0.00000000E+00 Mn++ 14 2. 0.69354E-07 0.66062E-07 0.9010 0.00000000E+00 HPO4-- 15 -2. 0.23670E-07 0.11057E-07 0.9012 0.00000000E+00 Chg. balance for total moles = 0.9762E-15 Max. difference allowed = 0.1380E-07 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 50.0000 SLIM = 0.800000E-02 TEMP = 100.0000 SINC = 0.2000E-03 TEMPC = 0.0000 TOTMIX = 0.400000E-02 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 = 1.0016 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 = 1 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) HSiO3- 16 -1. 9.0298 MnO2-2 65 -2. 40.4638 Ca(HSiO3)+ 17 1. 7.6723 HMnO2- 66 -1. 29.1232 Mg(HSiO3)+ 18 1. 7.5773 MnO4- 67 -1. 83.3111 NaHSiO3,aq 19 0. 7.8210 MnO4-2 68 -2. 81.3005 AlO+ 20 1. 6.8663 MnCl+ 69 1. -0.7894 AlOH+2 21 2. 3.1691 MnSO4,aq 70 0. -2.4604 HAlO2,aq 22 0. 10.5671 NaCl,aq 71 0. 0.4796 AlO2- 23 -1. 16.2221 NaOH,aq 72 0. 12.3669 CH4,aq 24 0. 6.0126 O2,aq 73 0. 53.5502 C2H6,aq 25 0. 12.3733 OH- 74 -1. 12.2382 C3H8,aq 26 0. 17.3707 HO2- 75 -1. 50.8010 C4H10,aq 27 0. 22.3757 H2O2,aq 76 0. 40.0166 ethanol,aq 28 0. 15.3258 H3PO2,aq 77 0. 24.3066 CO,aq 29 0. 4.6892 H2PO2- 78 -1. 26.5366 CO2,aq 30 0. -6.3298 HPO3-2 79 -2. 11.9254 CO3-2 31 -2. 10.0588 H3PO3,aq 80 0. 3.5792 CaCO3,aq 32 0. 5.9605 H2PO3- 81 -1. 5.6232 Ca(HCO3)+ 33 1. -1.4070 H3PO4,aq 82 0. -9.8447 CaCl+ 34 1. -0.2091 H2PO4- 83 -1. -7.2659 CaCl2,aq 35 0. 0.4151 PO4-3 84 -3. 12.0884 CaOH+ 36 1. 10.1471 H4P2O7,aq 85 0. -17.8095 CaSO4,aq 37 0. -2.5018 H3P2O7- 86 -1. -15.9156 HCl,aq 38 0. 0.7370 H2P2O7-2 87 -2. -13.4262 HClO,aq 39 0. 32.4260 HP2O7-3 88 -3. -6.7266 ClO- 40 -1. 39.6530 P2O7-4 89 -4. 2.8952 HClO2,aq 41 0. 70.1812 H2S,aq 90 0. -6.4900 Fe+3 42 3. 8.3809 S2-2 91 -2. 1.2355 FeCl+ 43 1. -0.1994 S3-2 92 -2. -8.8031 FeCl2,aq 44 0. 4.3001 S3- 93 -1. -16.3389 FeCl+2 45 2. 6.5269 S4-2 94 -2. -18.6615 FeO,aq 46 0. 16.4104 S5-2 95 -2. -28.3439 FeOH+ 47 1. 7.4874 SO2,aq 96 0. -0.2309 HFeO2- 48 -1. 24.3908 SO3-2 97 -2. 10.3052 FeO+ 49 1. 11.4004 HSO3- 98 -1. 2.5086 FeOH+2 50 2. 9.1194 HSO4- 99 -1. -2.9839 FeO2- 51 -1. 24.0895 HSO5- 100 -1. 38.8366 HFeO2,aq 52 0. 15.9850 S2O3-2 101 -2. -4.5600 H2,aq 53 0. 9.4190 HS2O3- 102 -1. -6.8123 KCl,aq 54 0. 1.7417 H2S2O3,aq 103 0. -8.0173 KHSO4,aq 55 0. -0.4514 S2O4-2 104 -2. 10.5541 KOH,aq 56 0. 12.3695 HS2O4- 105 -1. 7.6551 KSO4- 57 -1. -1.1908 H2S2O4,aq 106 0. 6.6259 MgCO3,aq 58 0. 6.5614 S2O5-2 107 -2. 10.0741 Mg(HCO3)+ 59 1. -1.4164 S2O6-2 108 -2. 11.5521 MgCl+ 60 1. -0.1664 S2O8-2 109 -2. 42.0620 MgOH+ 61 1. 9.4041 S3O6-2 110 -2. 3.7866 Mn+3 62 3. 19.1453 S4O6-2 111 -2. -17.8657 MnO,aq 63 0. 17.9848 S5O6-2 112 -2. -14.1333 MnOH+ 64 1. 8.5194 113 0. 10.3111 For mixed gases (JSOLS=6), log K(hydrol) = log (K*P) Log K Trial Log K Trial Mineral No. hydrol Moles Mineral No. hydrol Moles H2O,gas 1 1.696 0.0000E+00 osumilite(2) 124 20.667 0.0000E+00 CO2,gas 2 -6.660 0.0000E+00 osumilite-Fe 125 14.390 0.0000E+00 CH4,gas 3 4.544 0.0000E+00 pargasite 126 65.092 0.0000E+00 H2,gas 4 8.000 0.0000E+00 periclase 127 16.138 0.0000E+00 H2S,gas 5 -6.230 0.0000E+00 periclase-Fe 128 11.627 0.0000E+00 S2,gas 6 -7.335 0.0000E+00 perovskite-Al 129 12.344 0.0000E+00 CO,gas 7 3.215 0.0000E+00 perovskite-Ca 130 23.807 0.0000E+00 SO3,gas 8 17.121 0.0000E+00 perovskite-Fe 131 21.143 0.0000E+00 SO2,gas 9 0.832 0.0000E+00 perovskite-Mg 132 23.119 0.0000E+00 HCl,gas 10 5.189 0.0000E+00 phase_A 133 80.189 0.0000E+00 acmite 11 7.710 0.0000E+00 phlogopite-Na 134 29.647 0.0000E+00 akermanite 12 36.442 0.0000E+00 piemontite(ordered) 135 33.776 0.0000E+00 akimotoite 13 16.591 0.0000E+00 prehnite 136 19.372 0.0000E+00 akimotoite-Fe 14 13.067 0.0000E+00 prehnite-Fe 137 22.498 0.0000E+00 albite-high 15 0.693 0.0000E+00 pumpellyite-Fe 138 46.269 0.0000E+00 albite 16 -0.384 0.0000E+00 pumpellyite-Mg 139 48.995 0.0000E+00 almandine 17 24.442 0.0000E+00 px-Mg-tschermaks 140 19.616 0.0000E+00 pyrope 18 37.248 0.0000E+00 px-Ca-tschermaks 141 18.610 0.0000E+00 spessartine 19 24.457 0.0000E+00 pyrite 142 -21.247 0.0000E+00 analcite 20 3.322 0.0000E+00 pyrrhotite 143 -4.260 0.0000E+00 andalusite 21 5.002 0.0000E+00 pyrrhotiteFe0.875 144 -6.017 0.0000E+00 andradite 22 39.009 0.0000E+00 pyroxmangite 145 7.399 0.0000E+00 grossular 23 32.731 0.0000E+00 pyrophyllite 146 -6.176 0.0000E+00 anhydrite 24 -5.317 0.0000E+00 quartz 147 -2.989 0.0000E+00 ankerite 25 -2.135 0.0000E+00 rankinite 148 40.713 0.0000E+00 annite 26 20.123 0.0000E+00 ringwoodite-Fe 149 15.456 0.0000E+00 phlogopite 27 27.065 0.0000E+00 ringwoodite-Mg 150 27.575 0.0000E+00 biotite-Mn 28 32.960 0.0000E+00 rhodochrosite 151 -0.976 0.0000E+00 anorthite 29 12.710 0.0000E+00 rhodonite 152 7.446 0.0000E+00 anthophyllite 30 51.852 0.0000E+00 sanidine 153 -1.275 0.0000E+00 anthophyllite-Fe 31 29.306 0.0000E+00 sapphirine(351) 154 78.899 0.0000E+00 apatite-OH 32 -18.153 0.0000E+00 siderite 155 -2.608 0.0000E+00 apatite-OH-zs 33 -12.736 0.0000E+00 sillimanite 156 5.262 0.0000E+00 apatite-Cl-zs 34 -16.674 0.0000E+00 sodalite 157 49.976 0.0000E+00 aragonite 35 0.967 0.0000E+00 spinel 158 20.870 0.0000E+00 brucite 36 12.569 0.0000E+00 spurrite 159 59.482 0.0000E+00 calcite 37 0.812 0.0000E+00 staurolite-Fe 160 73.598 0.0000E+00 carnegieite-low 38 9.023 0.0000E+00 staurolite-Mg 161 89.802 0.0000E+00 carnegieite-high 39 10.093 0.0000E+00 staurolite-Mn 162 83.909 0.0000E+00 carpholite-Mg 40 8.582 0.0000E+00 stilbite 163 -7.522 0.0000E+00 carpholite-Fe 41 6.713 0.0000E+00 stilpnomelane-Fe 164 13.017 0.0000E+00 celadonite 42 5.342 0.0000E+00 stilpnomelane-Mg 165 27.441 0.0000E+00 celadonite-Fe 43 3.877 0.0000E+00 stishovite 166 2.720 0.0000E+00 chrysotile 44 23.892 0.0000E+00 sudoite-Fe 167 18.296 0.0000E+00 chondrodite 45 56.475 0.0000E+00 sudoite 168 21.077 0.0000E+00 clinochlore 46 39.070 0.0000E+00 sulfur 169 -9.152 0.0000E+00 daphnite 47 28.965 0.0000E+00 sylvite 170 1.338 0.0000E+00 chlorite-Mn 48 46.869 0.0000E+00 talc 171 16.491 0.0000E+00 chlorite-Al-free 49 47.173 0.0000E+00 talc-Fe 172 13.448 0.0000E+00 chloritoid-Mg 50 13.198 0.0000E+00 talc-tschermaks 173 19.091 0.0000E+00 chloritoid-Fe 51 9.174 0.0000E+00 tephroite 174 18.086 0.0000E+00 chloritoid-Mn 52 11.401 0.0000E+00 tilleyite 175 41.377 0.0000E+00 clinohumite 53 97.128 0.0000E+00 titanite-CaSi 176 15.479 0.0000E+00 coesite 54 -2.376 0.0000E+00 topaz-H 177 4.618 0.0000E+00 cordierite-H 55 23.715 0.0000E+00 tridymite 178 -2.626 0.0000E+00 cordierite 56 24.049 0.0000E+00 tremolite 179 47.869 0.0000E+00 cordierite-Fe 57 20.450 0.0000E+00 ferroactinolite 180 38.452 0.0000E+00 cordierite-Mn 58 25.066 0.0000E+00 troilite-low 181 -4.411 0.0000E+00 corundum 59 8.383 0.0000E+00 tschermakite 182 48.210 0.0000E+00 corundum-MgSi 60 18.891 0.0000E+00 vesuvianite 183 223.471 0.0000E+00 cristobalite 61 -2.560 0.0000E+00 wadeite-Si 184 20.216 0.0000E+00 cummingtonite 62 52.099 0.0000E+00 wadsleyite-Fe 185 15.680 0.0000E+00 cymrite-K 63 1.685 0.0000E+00 wadsleyite-Mg 186 25.850 0.0000E+00 deerite 64 95.671 0.0000E+00 wairakite 187 3.950 0.0000E+00 diaspore 65 2.874 0.1232E-04 walstromite 188 11.509 0.0000E+00 diamond 66 -3.102 0.0000E+00 wollastonite 189 10.461 0.0000E+00 diopside 67 16.181 0.0000E+00 pseudo-wollastonite 190 11.000 0.0000E+00 hedenbergite 68 14.208 0.0000E+00 zoisite 191 22.849 0.0000E+00 dolomite,ordered 69 0.546 0.0000E+00 akaganeite 192 7.755 0.0000E+00 eastonite 70 28.489 0.0000E+00 beidellite-Ca 193 -1.646 0.0000E+00 enstatite 71 17.265 0.0000E+00 beidellite-H 194 -2.326 0.0000E+00 clinoenstatite-HiP 72 18.354 0.0000E+00 beidellite-K 195 -1.520 0.0000E+00 clinoenstatite 73 17.166 0.0000E+00 beidellite-Mg 196 -1.790 0.0000E+00 protoenstatite 74 17.824 0.0000E+00 beidellite-Na 197 -1.342 0.0000E+00 epidote 75 24.670 0.0000E+00 calcium 198 84.026 0.0000E+00 clinozoisite 76 22.806 0.0000E+00 chalcedony 199 -2.802 0.0000E+00 epidote-Fe 77 29.841 0.0000E+00 dawsonite 200 1.682 0.0000E+00 fayalite 78 14.046 0.0000E+00 montmorillonite-Ca 201 -2.291 0.0000E+00 ferrosilite 79 11.149 0.0000E+00 montmorillonite-K 202 -2.237 0.0000E+00 forsterite 80 21.016 0.0000E+00 montmorillonite-Mg 203 -2.480 0.0000E+00 gedrite 81 50.522 0.0000E+00 montmorillonite-Na 204 -2.038 0.0000E+00 gehlenite 82 36.628 0.0000E+00 nontronite-Ca 205 3.215 0.0000E+00 gibbsite 83 4.079 0.0000E+00 nontronite-H 206 2.533 0.0000E+00 glaucophane 84 22.975 0.0000E+00 nontronite-K 207 3.341 0.0000E+00 glaucophane-Fe 85 17.276 0.0000E+00 nontronite-Mg 208 3.075 0.0000E+00 graphite 86 -3.546 0.0000E+00 nontronite-Na 209 3.520 0.0000E+00 greenalite 87 16.140 0.0000E+00 sepiolite 210 24.118 0.0000E+00 grunerite 88 31.215 0.0000E+00 alite 211 57.999 0.0000E+00 halite 89 1.575 0.0000E+00 belite 212 30.433 0.0000E+00 hematite 90 12.566 0.1396E-05 ettringite 213 43.232 0.0000E+00 heulandite 91 -5.827 0.0000E+00 gypsum 214 -4.955 0.0000E+00 hercynite 92 17.279 0.0000E+00 hemicarboaluminate 215 70.954 0.0000E+00 hollandite 93 25.673 0.0000E+00 hydrogarnet 216 60.662 0.0000E+00 iron 94 19.086 0.0000E+00 hydrogarnet-Si 217 50.586 0.0000E+00 jadeite 95 4.215 0.0000E+00 jennite 218 24.367 0.0000E+00 julgoldite 96 70.427 0.0000E+00 monosulfoaluminate 219 53.400 0.0000E+00 kalsilite 97 7.584 0.0000E+00 monocarboaluminate 220 61.898 0.0000E+00 kaolinite 98 -1.333 0.0000E+00 portlandite 221 18.272 0.0000E+00 kyanite 99 4.876 0.0000E+00 stratlingite 222 36.502 0.0000E+00 larnite-bredigite 100 30.686 0.0000E+00 tricarboaluminate 223 70.370 0.0000E+00 laumontite 101 2.883 0.0000E+00 tobermorite 224 9.823 0.0000E+00 lawsonite 102 9.616 0.0000E+00 C4AH13 225 81.816 0.0000E+00 leucite 103 4.119 0.0000E+00 C2AH8 226 45.203 0.0000E+00 lime 104 25.998 0.0000E+00 C3A 227 86.953 0.0000E+00 lizardite 105 23.244 0.0000E+00 C4AF 228 117.416 0.0000E+00 magnesite 106 0.691 0.0000E+00 CAH10 229 28.335 0.0000E+00 magnetite 107 20.087 0.0000E+00 alabandite 230 -0.978 0.0000E+00 minnesotaite 108 10.388 0.0000E+00 alunite 231 -10.435 0.0000E+00 minnesotaite-Mg 109 20.602 0.0000E+00 artinite 232 15.121 0.0000E+00 magnesioferrite 110 26.212 0.0000E+00 boehmite 233 4.406 0.0000E+00 majorite 111 53.251 0.0000E+00 dolomite,disordered 234 1.247 0.0000E+00 manganosite 112 14.058 0.0000E+00 ferrous-oxide 235 9.812 0.0000E+00 margarite 113 17.324 0.0000E+00 huntite 236 3.770 0.0000E+00 meionite 114 44.874 0.0000E+00 hydromagnesite 237 19.995 0.0000E+00 merwinite 115 55.930 0.0000E+00 nesquehonite 238 4.723 0.0000E+00 microcline 116 -2.486 0.0000E+00 potassium-oxide 239 69.038 0.0000E+00 monticellite 117 24.339 0.0000E+00 silica-amorphous 240 -2.091 0.0000E+00 mullite-Al 118 363.148 0.0000E+00 sodium-oxide 241 55.169 0.0000E+00 mullite-Si 119 7.264 0.0000E+00 an20ab80 242 2.018 0.0000E+00 muscovite 120 2.582 0.0000E+00 an25ab75 243 2.646 0.0000E+00 paragonite 121 4.239 0.0000E+00 an30ab70 244 3.279 0.0000E+00 nepheline 122 8.339 0.0000E+00 tr.625ac.25prg.125 245 45.165 0.0000E+00 osumilite(1) 123 21.717 0.0000E+00 246 0.000 0.0000E+00 Initial composition of reactant (wt%): SiO2 62.56 MgO 3.200 Al2O3 16.62 CaO 6.450 FeO 3.530 Na2O 3.890 Fe2O3 1.770 K2O 1.000 MnO 0.1230 P2O5 0.4200E-01 Sum of wt% of reactants: 99.1850 Reactant consumed: 0.0040000 g log = -2.3979 Original solution: 1000.0103000 g Original solution / Rock added: 250002.58 (Water/Rock Ratio), log = 5.3979 The following minerals and/or gases with identical index are in solid solution: H2O,gas 6 CO2,gas 6 CH4,gas 6 H2,gas 6 H2S,gas 6 S2,gas 6 CO,gas 6 SO3,gas 6 SO2,gas 6 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 greenalite 18 iron 9 lizardite 18 magnetite 14 talc 7 talc-Fe 7 tremolite 2 ferroactinolite 2 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0040000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2572155E-03 Osmotic coef. = 0.9903 True ionic strength = .2577778E-03 Chg. balance for total moles = 0.9762E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.68610E-07 -7.1636 0.65962E-07 -7.1807 0.96141E+00 -0.0171 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13262E-03 -3.8774 0.96130E+00 -0.0171 4 SO4-- 0.25143E-04 -4.5996 0.22658E-04 -4.6448 0.90116E+00 -0.0452 5 HCO3- 0.11488E-04 -4.9398 0.11044E-04 -4.9569 0.96132E+00 -0.0171 6 HS- 0.19769E-06 -6.7040 0.19004E-06 -6.7211 0.96130E+00 -0.0171 7 Al+++ 0.26527E-18 -18.5763 0.21458E-18 -18.6684 0.80889E+00 -0.0921 8 H4SiO4 0.41045E-04 -4.3867 0.41045E-04 -4.3867 0.10000E+01 0.0000 9 Ca++ 0.18918E-04 -4.7231 0.17046E-04 -4.7684 0.90104E+00 -0.0453 10 Mg++ 0.31553E-05 -5.5010 0.28428E-05 -5.5463 0.90096E+00 -0.0453 11 Fe++ 0.40273E-07 -7.3950 0.36285E-07 -7.4403 0.90098E+00 -0.0453 12 K+ 0.84895E-06 -6.0711 0.81612E-06 -6.0882 0.96133E+00 -0.0171 13 Na+ 0.16508E-03 -3.7823 0.15869E-03 -3.7994 0.96129E+00 -0.0171 14 Mn++ 0.66062E-07 -7.1800 0.59521E-07 -7.2253 0.90099E+00 -0.0453 15 HPO4-- 0.11057E-07 -7.9564 0.99643E-08 -8.0016 0.90117E+00 -0.0452 16 HSiO3- 0.60441E-06 -6.2187 0.58102E-06 -6.2358 0.96130E+00 -0.0171 17 Ca(HSiO3)+ 0.23462E-09 -9.6296 0.22555E-09 -9.6468 0.96133E+00 -0.0171 18 Mg(HSiO3)+ 0.48697E-10 -10.3125 0.46814E-10 -10.3296 0.96133E+00 -0.0171 19 NaHSiO3,aq 0.14913E-08 -8.8264 0.14913E-08 -8.8264 0.10000E+01 0.0000 20 AlO+ 0.69790E-11 -11.1562 0.67092E-11 -11.1733 0.96133E+00 -0.0171 21 AlOH+2 0.24457E-14 -14.6116 0.22036E-14 -14.6569 0.90101E+00 -0.0453 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.70714E-06 -6.1505 0.67975E-06 -6.1677 0.96126E+00 -0.0172 24 CH4,aq 0.89984E-13 -13.0458 0.89977E-13 -13.0459 0.99992E+00 0.0000 29 CO,aq 0.28136E-15 -15.5507 0.28136E-15 -15.5507 0.10000E+01 0.0000 30 CO2,aq 0.15567E-05 -5.8078 0.15566E-05 -5.8078 0.99992E+00 0.0000 31 CO3-2 0.16228E-07 -7.7897 0.14624E-07 -7.8349 0.90113E+00 -0.0452 32 CaCO3,aq 0.31256E-08 -8.5051 0.31256E-08 -8.5051 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.49985E-08 -8.3012 0.48052E-08 -8.3183 0.96133E+00 -0.0171 34 CaCl+ 0.38056E-08 -8.4196 0.36584E-08 -8.4367 0.96133E+00 -0.0171 35 CaCl2,aq 0.11527E-12 -12.9383 0.11527E-12 -12.9383 0.10000E+01 0.0000 36 CaOH+ 0.19158E-07 -7.7177 0.18417E-07 -7.7348 0.96133E+00 -0.0171 37 CaSO4,aq 0.12264E-06 -6.9114 0.12264E-06 -6.9114 0.10000E+01 0.0000 38 HCl,aq 0.16031E-11 -11.7951 0.16031E-11 -11.7951 0.10000E+01 0.0000 43 FeCl+ 0.79233E-11 -11.1011 0.76169E-11 -11.1182 0.96133E+00 -0.0171 44 FeCl2,aq 0.31983E-19 -19.4951 0.31983E-19 -19.4951 0.10000E+01 0.0000 46 FeO,aq 0.32411E-09 -9.4893 0.32411E-09 -9.4893 0.10000E+01 0.0000 47 FeOH+ 0.18626E-07 -7.7299 0.17906E-07 -7.7470 0.96133E+00 -0.0171 48 HFeO2- 0.53482E-10 -10.2718 0.51412E-10 -10.2889 0.96130E+00 -0.0171 49 FeO+ 0.52374E-12 -12.2809 0.50348E-12 -12.2980 0.96133E+00 -0.0171 50 FeOH+2 0.70391E-17 -17.1525 0.63423E-17 -17.1978 0.90101E+00 -0.0453 51 FeO2- 0.24631E-10 -10.6085 0.23678E-10 -10.6257 0.96130E+00 -0.0171 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.71962E-08 -8.1429 0.71956E-08 -8.1429 0.99992E+00 0.0000 54 KCl,aq 0.19617E-11 -11.7074 0.19617E-11 -11.7074 0.10000E+01 0.0000 55 KHSO4,aq 0.34487E-17 -17.4623 0.34487E-17 -17.4623 0.10000E+01 0.0000 56 KOH,aq 0.52838E-11 -11.2771 0.52838E-11 -11.2771 0.10000E+01 0.0000 57 KSO4- 0.29850E-09 -9.5251 0.28695E-09 -9.5422 0.96130E+00 -0.0171 58 MgCO3,aq 0.13066E-09 -9.8839 0.13066E-09 -9.8839 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.85181E-09 -9.0697 0.81888E-09 -9.0868 0.96133E+00 -0.0171 60 MgCl+ 0.57524E-09 -9.2401 0.55300E-09 -9.2573 0.96133E+00 -0.0171 61 MgOH+ 0.17680E-07 -7.7525 0.16996E-07 -7.7696 0.96133E+00 -0.0171 63 MnO,aq 0.14167E-10 -10.8487 0.14167E-10 -10.8487 0.10000E+01 0.0000 64 MnOH+ 0.28384E-08 -8.5469 0.27286E-08 -8.5641 0.96133E+00 -0.0171 65 MnO2-2 0.11991E-18 -18.9211 0.10806E-18 -18.9663 0.90113E+00 -0.0452 66 HMnO2- 0.16244E-14 -14.7893 0.15616E-14 -14.8064 0.96130E+00 -0.0171 69 MnCl+ 0.50566E-10 -10.2961 0.48610E-10 -10.3133 0.96133E+00 -0.0171 70 MnSO4,aq 0.38934E-09 -9.4097 0.38934E-09 -9.4097 0.10000E+01 0.0000 71 NaCl,aq 0.69748E-08 -8.1565 0.69748E-08 -8.1565 0.10000E+01 0.0000 72 NaOH,aq 0.10337E-08 -8.9856 0.10337E-08 -8.9856 0.10000E+01 0.0000 74 OH- 0.91121E-05 -5.0404 0.87591E-05 -5.0575 0.96126E+00 -0.0172 79 HPO3-2 0.24795E-18 -18.6056 0.22344E-18 -18.6508 0.90113E+00 -0.0452 81 H2PO3- 0.30745E-19 -19.5122 0.29555E-19 -19.5294 0.96130E+00 -0.0171 82 H3PO4,aq 0.30322E-12 -12.5182 0.30322E-12 -12.5182 0.10000E+01 0.0000 83 H2PO4- 0.12613E-07 -7.8992 0.12125E-07 -7.9163 0.96131E+00 -0.0171 84 PO4-3 0.15222E-12 -12.8175 0.12325E-12 -12.9092 0.80966E+00 -0.0917 87 H2P2O7-2 0.12792E-16 -16.8931 0.11527E-16 -16.9383 0.90113E+00 -0.0452 88 HP2O7-3 0.43138E-16 -16.3651 0.34894E-16 -16.4572 0.80890E+00 -0.0921 89 P2O7-4 0.18162E-18 -18.7408 0.12638E-18 -18.8983 0.69583E+00 -0.1575 90 H2S,aq 0.38746E-07 -7.4118 0.38743E-07 -7.4118 0.99992E+00 0.0000 91 S2-2 0.12342E-15 -15.9086 0.11122E-15 -15.9538 0.90113E+00 -0.0452 96 SO2,aq 0.31681E-17 -17.4992 0.31681E-17 -17.4992 0.10000E+01 0.0000 97 SO3-2 0.23505E-13 -13.6288 0.21187E-13 -13.6739 0.90138E+00 -0.0451 98 HSO3- 0.91026E-13 -13.0408 0.87503E-13 -13.0580 0.96130E+00 -0.0171 99 HSO4- 0.14983E-08 -8.8244 0.14404E-08 -8.8415 0.96135E+00 -0.0171 101 S2O3-2 0.11443E-13 -13.9414 0.10312E-13 -13.9867 0.90113E+00 -0.0452 102 HS2O3- 0.12652E-18 -18.8978 0.12162E-18 -18.9150 0.96130E+00 -0.0171 Charge balance for all species = 0.9762E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6861028E-07 -.1101140E-04 -.1109867E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999832E+06 0.0000 3 Cl- 0.1379630E-03 0.1379744E-03 0.4891534E+01 3.3033 4 SO4-- 0.2514324E-04 0.2526630E-04 0.2427085E+01 9.7166 5 HCO3- 0.1148800E-04 0.1307002E-04 0.7974843E+00 2.2238 6 HS- 0.1976950E-06 0.2382125E-06 0.7878049E-02 0.4596 7 Al+++ 0.2652736E-18 0.7274039E-06 0.1962616E-01 2.8737 8 H4SiO4 0.4104501E-04 0.4165120E-04 0.4003262E+01 -4.3867 9 Ca++ 0.1891769E-04 0.1907166E-04 0.7643427E+00 9.5930 10 Mg++ 0.3155322E-05 0.3174608E-05 0.7717993E-01 8.8152 11 Fe++ 0.4027265E-07 0.5950800E-07 0.3323294E-02 6.9211 12 K+ 0.8489525E-06 0.8492582E-06 0.3320721E-01 1.0925 13 Na+ 0.1650827E-03 0.1650922E-03 0.3795381E+01 3.3813 14 Mn++ 0.6606204E-07 0.6935449E-07 0.3810141E-02 7.1361 15 HPO4-- 0.1105711E-07 0.2367034E-07 0.2271822E-02 6.3599 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.5319406E-04 -.1101138E-04 -.4218268E-04 0.0000000E+00 2 H2O 0.5550820E+02 0.5550817E+02 0.2742365E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2561532E-04 0.2526626E-04 0.3490658E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1108536E-06 0.2382122E-06 -.3490658E-06 0.0000000E+00 7 Al+++ 0.1304297E-04 0.7274028E-06 0.1231556E-04 0.0000000E+00 8 H4SiO4 0.4165113E-04 0.4165113E-04 0.0000000E+00 0.0000000E+00 9 Ca++ 0.1907163E-04 0.1907163E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3174603E-05 0.3174603E-05 0.0000000E+00 0.0000000E+00 11 Fe++ 0.2852034E-05 0.5950791E-07 0.2792526E-05 0.0000000E+00 12 K+ 0.8492569E-06 0.8492569E-06 0.0000000E+00 0.0000000E+00 13 Na+ 0.1650920E-03 0.1650920E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.6935438E-07 0.6935438E-07 0.0000000E+00 0.0000000E+00 15 HPO4-- 0.2367031E-07 0.2367031E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0040000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) diaspore 0.1232E-04 -4.910 0.7388E-03 -3.131 76.82 0.2199E-03 hematite 0.1396E-05 -5.855 0.2230E-03 -3.652 23.18 0.4226E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.000962 g Volume = 0.000262 cm3 Porosity: 99.9738% V(tot) - V(min): 0.10013E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0040000 g log = -2.3979 Original solution: 1000.0103000 g Original solution / Rock added: 250002.58 (Water/Rock Ratio), log = 5.3979 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0205 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9998E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1620E-03 1.0071 0.1665E-03 0.1654E-03 CH4,gas 0.1282E-09 1.0125 0.1324E-09 0.1308E-09 H2,gas 0.9252E-05 1.0005 0.9447E-05 0.9442E-05 H2S,gas 0.1048E-05 0.9960 0.1065E-05 0.1069E-05 S2,gas 0.4675E-21 1.0000 0.4771E-21 0.4771E-21 CO,gas 0.4109E-12 1.0000 0.4193E-12 0.4193E-12 SO3,gas 0.3653E-34 1.0000 0.3728E-34 0.3728E-34 SO2,gas 0.1343E-16 1.0000 0.1370E-16 0.1370E-16 HCl,gas 0.2772E-14 1.0000 0.2829E-14 0.2829E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 -0.60662E-11 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.14 -5.48 -1.826 0.93526E+04 -3.778 3 CH4,gas 4.54 -7.03 -11.58 -2.894 0.19767E+05 -9.878 4 H2,gas 8.00 1.28 -6.72 -3.842 0.11480E+05 -5.025 5 H2S,gas -6.23 -13.90 -7.67 -3.836 0.13099E+05 -5.973 6 S2,gas -7.34 -30.36 -23.02 -3.542 0.39307E+05 -21.321 7 CO,gas 3.21 -10.86 -14.08 -4.331 0.24035E+05 -12.377 8 SO3,gas 17.12 -19.01 -36.13 -9.032 0.61687E+05 -34.429 9 SO2,gas 0.83 -17.73 -18.56 -4.950 0.31695E+05 -16.863 10 HCl,gas 5.19 -11.06 -16.25 -8.124 0.27742E+05 -14.548 21 andalusite 5.00 1.36 -3.64 -0.364 0.62167E+04 24 anhydrite -5.32 -9.41 -4.10 -2.048 0.69944E+04 32 apatite-OH -18.15 -19.12 -0.97 -0.075 0.16568E+04 35 aragonite 0.97 -2.54 -3.51 -1.170 0.59951E+04 36 brucite 12.57 8.82 -3.75 -0.751 0.64088E+04 37 calcite 0.81 -2.54 -3.36 -1.119 0.57309E+04 40 carpholite-Mg 8.58 5.79 -2.79 -0.186 0.47690E+04 41 carpholite-Fe 6.71 3.90 -2.82 -0.188 0.48110E+04 46 clinochlore 39.07 36.66 -2.41 -0.075 0.41091E+04 47 daphnite 28.97 27.19 -1.77 -0.055 0.30263E+04 50 chloritoid-Mg 13.20 10.18 -3.02 -0.201 0.51598E+04 51 chloritoid-Fe 9.17 8.28 -0.89 -0.059 0.15228E+04 52 chloritoid-Mn 11.40 8.50 -2.90 -0.194 0.49591E+04 54 coesite -2.38 -4.39 -2.01 -0.670 0.34332E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.39 -1.83 -0.609 0.31185E+04 78 fayalite 14.05 9.46 -4.59 -0.656 0.78376E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 11.99 -4.15 -0.346 0.70853E+04 92 hercynite 17.28 12.67 -4.61 -0.307 0.78715E+04 98 kaolinite -1.33 -3.03 -1.69 -0.154 0.28913E+04 99 kyanite 4.88 1.36 -3.52 -0.352 0.60026E+04 102 lawsonite 9.62 6.57 -3.05 -0.203 0.52063E+04 106 magnesite 0.69 -3.32 -4.01 -1.338 0.68521E+04 107 magnetite 20.09 19.49 -0.60 -0.049 0.10246E+04 110 magnesioferrite 26.21 21.38 -4.83 -0.394 0.82489E+04 128 periclase-Fe 11.63 6.92 -4.71 -1.176 0.80344E+04 142 pyrite -21.25 -22.16 -0.91 -0.215 0.15567E+04 143 pyrrhotite -4.26 -6.98 -2.72 -0.907 0.46450E+04 144 pyrrhotiteFe0.875 -6.02 -8.00 -1.99 -0.731 0.33930E+04 145 pyroxmangite 7.40 2.75 -4.65 -0.930 0.79386E+04 147 quartz -2.99 -4.39 -1.40 -0.466 0.23859E+04 151 rhodochrosite -0.98 -5.00 -4.03 -1.342 0.68729E+04 152 rhodonite 7.45 2.75 -4.70 -0.939 0.80189E+04 155 siderite -2.61 -5.22 -2.61 -0.869 0.44536E+04 156 sillimanite 5.26 1.36 -3.90 -0.390 0.66606E+04 177 topaz-H 4.62 1.36 -3.26 -0.296 0.55627E+04 178 tridymite -2.63 -4.39 -1.76 -0.587 0.30058E+04 181 troilite-low -4.41 -6.98 -2.57 -0.857 0.43878E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.39 -1.58 -0.528 0.27052E+04 205 nontronite-Ca 3.21 -1.00 -4.22 -0.274 0.71996E+04 208 nontronite-Mg 3.07 -1.13 -4.20 -0.273 0.71798E+04 209 nontronite-Na 3.52 -1.47 -4.99 -0.320 0.85181E+04 214 gypsum -4.96 -9.41 -4.46 -1.115 0.76120E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.92 -2.89 -0.723 0.49354E+04 240 silica-amorphous -2.09 -4.39 -2.30 -0.765 0.39193E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0040000 g New total amount of reactant added: 0.0042000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9761E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0042000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2583963E-03 Osmotic coef. = 0.9903 True ionic strength = .2591971E-03 Chg. balance for total moles = 0.9761E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.63061E-07 -7.2002 0.60624E-07 -7.2174 0.96135E+00 -0.0171 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13262E-03 -3.8774 0.96124E+00 -0.0172 4 SO4-- 0.25129E-04 -4.5998 0.22640E-04 -4.6451 0.90096E+00 -0.0453 5 HCO3- 0.11598E-04 -4.9356 0.11149E-04 -4.9528 0.96127E+00 -0.0172 6 HS- 0.21142E-06 -6.6749 0.20322E-06 -6.6920 0.96124E+00 -0.0172 7 Al+++ 0.20605E-18 -18.6860 0.16658E-18 -18.7784 0.80847E+00 -0.0923 8 H4SiO4 0.43042E-04 -4.3661 0.43042E-04 -4.3661 0.10000E+01 0.0000 9 Ca++ 0.19144E-04 -4.7180 0.17245E-04 -4.7633 0.90083E+00 -0.0454 10 Mg++ 0.33114E-05 -5.4800 0.29828E-05 -5.5254 0.90075E+00 -0.0454 11 Fe++ 0.34679E-07 -7.4599 0.31238E-07 -7.5053 0.90077E+00 -0.0454 12 K+ 0.89140E-06 -6.0499 0.85688E-06 -6.0671 0.96127E+00 -0.0172 13 Na+ 0.16533E-03 -3.7816 0.15892E-03 -3.7988 0.96124E+00 -0.0172 14 Mn++ 0.69114E-07 -7.1604 0.62257E-07 -7.2058 0.90078E+00 -0.0454 15 HPO4-- 0.12134E-07 -7.9160 0.10932E-07 -7.9613 0.90096E+00 -0.0453 16 HSiO3- 0.68967E-06 -6.1614 0.66294E-06 -6.1785 0.96124E+00 -0.0172 17 Ca(HSiO3)+ 0.27085E-09 -9.5673 0.26037E-09 -9.5844 0.96128E+00 -0.0172 18 Mg(HSiO3)+ 0.58302E-10 -10.2343 0.56044E-10 -10.2515 0.96128E+00 -0.0172 19 NaHSiO3,aq 0.17040E-08 -8.7685 0.17040E-08 -8.7685 0.10000E+01 0.0000 20 AlO+ 0.64146E-11 -11.1928 0.61662E-11 -11.2100 0.96128E+00 -0.0172 21 AlOH+2 0.20664E-14 -14.6848 0.18614E-14 -14.7302 0.90080E+00 -0.0454 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.76946E-06 -6.1138 0.73961E-06 -6.1310 0.96121E+00 -0.0172 24 CH4,aq 0.97221E-13 -13.0122 0.97213E-13 -13.0123 0.99992E+00 0.0000 29 CO,aq 0.27119E-15 -15.5667 0.27119E-15 -15.5667 0.10000E+01 0.0000 30 CO2,aq 0.14443E-05 -5.8403 0.14442E-05 -5.8404 0.99992E+00 0.0000 31 CO3-2 0.17830E-07 -7.7489 0.16063E-07 -7.7942 0.90092E+00 -0.0453 32 CaCO3,aq 0.34735E-08 -8.4592 0.34735E-08 -8.4592 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.51056E-08 -8.2920 0.49079E-08 -8.3091 0.96128E+00 -0.0172 34 CaCl+ 0.38502E-08 -8.4145 0.37011E-08 -8.4317 0.96128E+00 -0.0172 35 CaCl2,aq 0.11661E-12 -12.9333 0.11661E-12 -12.9333 0.10000E+01 0.0000 36 CaOH+ 0.21090E-07 -7.6759 0.20274E-07 -7.6931 0.96128E+00 -0.0172 37 CaSO4,aq 0.12398E-06 -6.9066 0.12398E-06 -6.9066 0.10000E+01 0.0000 38 HCl,aq 0.14732E-11 -11.8317 0.14732E-11 -11.8317 0.10000E+01 0.0000 43 FeCl+ 0.68213E-11 -11.1661 0.65571E-11 -11.1833 0.96128E+00 -0.0172 44 FeCl2,aq 0.27531E-19 -19.5602 0.27531E-19 -19.5602 0.10000E+01 0.0000 46 FeO,aq 0.33034E-09 -9.4810 0.33034E-09 -9.4810 0.10000E+01 0.0000 47 FeOH+ 0.17449E-07 -7.7582 0.16773E-07 -7.7754 0.96128E+00 -0.0172 48 HFeO2- 0.59313E-10 -10.2269 0.57014E-10 -10.2440 0.96124E+00 -0.0172 49 FeO+ 0.48138E-12 -12.3175 0.46274E-12 -12.3347 0.96128E+00 -0.0172 50 FeOH+2 0.59472E-17 -17.2257 0.53573E-17 -17.2711 0.90080E+00 -0.0454 51 FeO2- 0.26802E-10 -10.5718 0.25763E-10 -10.5890 0.96124E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.74754E-08 -8.1264 0.74748E-08 -8.1264 0.99992E+00 0.0000 54 KCl,aq 0.20595E-11 -11.6862 0.20595E-11 -11.6862 0.10000E+01 0.0000 55 KHSO4,aq 0.33253E-17 -17.4782 0.33253E-17 -17.4782 0.10000E+01 0.0000 56 KOH,aq 0.60361E-11 -11.2192 0.60361E-11 -11.2192 0.10000E+01 0.0000 57 KSO4- 0.31318E-09 -9.5042 0.30104E-09 -9.5214 0.96124E+00 -0.0172 58 MgCO3,aq 0.15059E-09 -9.8222 0.15059E-09 -9.8222 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.90233E-09 -9.0446 0.86739E-09 -9.0618 0.96128E+00 -0.0172 60 MgCl+ 0.60356E-09 -9.2193 0.58019E-09 -9.2364 0.96128E+00 -0.0172 61 MgOH+ 0.20185E-07 -7.6950 0.19404E-07 -7.7121 0.96128E+00 -0.0172 63 MnO,aq 0.17543E-10 -10.7559 0.17543E-10 -10.7559 0.10000E+01 0.0000 64 MnOH+ 0.32304E-08 -8.4907 0.31053E-08 -8.5079 0.96128E+00 -0.0172 65 MnO2-2 0.17583E-18 -18.7549 0.15841E-18 -18.8002 0.90092E+00 -0.0453 66 HMnO2- 0.21888E-14 -14.6598 0.21039E-14 -14.6770 0.96124E+00 -0.0172 69 MnCl+ 0.52890E-10 -10.2766 0.50842E-10 -10.2938 0.96128E+00 -0.0172 70 MnSO4,aq 0.40691E-09 -9.3905 0.40691E-09 -9.3905 0.10000E+01 0.0000 71 NaCl,aq 0.69846E-08 -8.1559 0.69846E-08 -8.1559 0.10000E+01 0.0000 72 NaOH,aq 0.11263E-08 -8.9483 0.11263E-08 -8.9483 0.10000E+01 0.0000 74 OH- 0.99151E-05 -5.0037 0.95305E-05 -5.0209 0.96121E+00 -0.0172 79 HPO3-2 0.28267E-18 -18.5487 0.25466E-18 -18.5940 0.90092E+00 -0.0453 81 H2PO3- 0.32207E-19 -19.4920 0.30959E-19 -19.5092 0.96124E+00 -0.0172 82 H3PO4,aq 0.28102E-12 -12.5513 0.28102E-12 -12.5513 0.10000E+01 0.0000 83 H2PO4- 0.12719E-07 -7.8955 0.12226E-07 -7.9127 0.96126E+00 -0.0172 84 PO4-3 0.18181E-12 -12.7404 0.14713E-12 -12.8323 0.80924E+00 -0.0919 87 H2P2O7-2 0.13010E-16 -16.8857 0.11721E-16 -16.9310 0.90092E+00 -0.0453 88 HP2O7-3 0.47751E-16 -16.3210 0.38605E-16 -16.4134 0.80848E+00 -0.0923 89 P2O7-4 0.21883E-18 -18.6599 0.15213E-18 -18.8178 0.69519E+00 -0.1579 90 H2S,aq 0.38080E-07 -7.4193 0.38077E-07 -7.4193 0.99992E+00 0.0000 91 S2-2 0.13589E-15 -15.8668 0.12243E-15 -15.9121 0.90092E+00 -0.0453 96 SO2,aq 0.27777E-17 -17.5563 0.27777E-17 -17.5563 0.10000E+01 0.0000 97 SO3-2 0.24403E-13 -13.6126 0.21991E-13 -13.6578 0.90117E+00 -0.0452 98 HSO3- 0.86840E-13 -13.0613 0.83474E-13 -13.0784 0.96124E+00 -0.0172 99 HSO4- 0.13760E-08 -8.8614 0.13227E-08 -8.8785 0.96129E+00 -0.0171 101 S2O3-2 0.11240E-13 -13.9492 0.10127E-13 -13.9945 0.90092E+00 -0.0453 102 HS2O3- 0.11420E-18 -18.9424 0.10977E-18 -18.9595 0.96124E+00 -0.0172 Charge balance for all species = 0.9762E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.6306117E-07 -.1227355E-04 -.1237082E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999830E+06 0.0000 3 Cl- 0.1379629E-03 0.1379744E-03 0.4891533E+01 3.3399 4 SO4-- 0.2512893E-04 0.2525317E-04 0.2425824E+01 9.7896 5 HCO3- 0.1159821E-04 0.1307002E-04 0.7974842E+00 2.2646 6 HS- 0.2114187E-06 0.2513398E-06 0.8312186E-02 0.5253 7 Al+++ 0.2060459E-18 0.7897178E-06 0.2130745E-01 2.8737 8 H4SiO4 0.4304205E-04 0.4373376E-04 0.4203425E+01 -4.3661 9 Ca++ 0.1914392E-04 0.1930169E-04 0.7735616E+00 9.6714 10 Mg++ 0.3311439E-05 0.3333339E-05 0.8103892E-01 8.9093 11 Fe++ 0.3467943E-07 0.5275036E-07 0.2945905E-02 6.9294 12 K+ 0.8913999E-06 0.8917212E-06 0.3486756E-01 1.1503 13 Na+ 0.1653335E-03 0.1653433E-03 0.3801152E+01 3.4185 14 Mn++ 0.6911443E-07 0.7282222E-07 0.4000647E-02 7.2289 15 HPO4-- 0.1213430E-07 0.2485386E-07 0.2385413E-02 6.4734 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.5650576E-04 -.1227353E-04 -.4423223E-04 0.0000000E+00 2 H2O 0.5550820E+02 0.5550817E+02 0.2875268E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2562087E-04 0.2525313E-04 0.3677357E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1163963E-06 0.2513394E-06 -.3677357E-06 0.0000000E+00 7 Al+++ 0.1369511E-04 0.7897166E-06 0.1290540E-04 0.0000000E+00 8 H4SiO4 0.4373369E-04 0.4373369E-04 0.0000000E+00 0.0000000E+00 9 Ca++ 0.1930166E-04 0.1930166E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3333333E-05 0.3333333E-05 0.0000000E+00 0.0000000E+00 11 Fe++ 0.2994636E-05 0.5275028E-07 0.2941886E-05 0.0000000E+00 12 K+ 0.8917197E-06 0.8917197E-06 0.0000000E+00 0.0000000E+00 13 Na+ 0.1653430E-03 0.1653430E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.7282210E-07 0.7282210E-07 0.0000000E+00 0.0000000E+00 15 HPO4-- 0.2485382E-07 0.2485382E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.2541E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0042000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) diaspore 0.1291E-04 -4.889 0.7742E-03 -3.111 76.72 0.2305E-03 hematite 0.1471E-05 -5.832 0.2349E-03 -3.629 23.28 0.4452E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001009 g Volume = 0.000275 cm3 Porosity: 99.9725% V(tot) - V(min): 0.10014E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0042000 g log = -2.3768 Original solution: 1000.0103000 g Original solution / Rock added: 238097.69 (Water/Rock Ratio), log = 5.3768 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0205 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9998E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1504E-03 1.0071 0.1545E-03 0.1534E-03 CH4,gas 0.1385E-09 1.0125 0.1431E-09 0.1413E-09 H2,gas 0.9611E-05 1.0005 0.9813E-05 0.9808E-05 H2S,gas 0.1030E-05 0.9960 0.1047E-05 0.1051E-05 S2,gas 0.4185E-21 1.0000 0.4270E-21 0.4270E-21 CO,gas 0.3960E-12 1.0000 0.4041E-12 0.4041E-12 SO3,gas 0.3083E-34 1.0000 0.3146E-34 0.3146E-34 SO2,gas 0.1177E-16 1.0000 0.1201E-16 0.1201E-16 HCl,gas 0.2547E-14 1.0000 0.2600E-14 0.2600E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.17 -5.51 -1.837 0.94082E+04 -3.811 3 CH4,gas 4.54 -7.00 -11.54 -2.886 0.19710E+05 -9.844 4 H2,gas 8.00 1.29 -6.71 -3.833 0.11452E+05 -5.008 5 H2S,gas -6.23 -13.91 -7.68 -3.840 0.13112E+05 -5.980 6 S2,gas -7.34 -30.40 -23.07 -3.549 0.39389E+05 -21.370 7 CO,gas 3.21 -10.88 -14.09 -4.336 0.24062E+05 -12.393 8 SO3,gas 17.12 -19.08 -36.20 -9.050 0.61813E+05 -34.502 9 SO2,gas 0.83 -17.79 -18.62 -4.965 0.31792E+05 -16.920 10 HCl,gas 5.19 -11.09 -16.28 -8.142 0.27805E+05 -14.585 21 andalusite 5.00 1.38 -3.62 -0.362 0.61815E+04 24 anhydrite -5.32 -9.41 -4.09 -2.046 0.69864E+04 32 apatite-OH -18.15 -18.83 -0.68 -0.052 0.11569E+04 35 aragonite 0.97 -2.50 -3.47 -1.155 0.59168E+04 36 brucite 12.57 8.91 -3.66 -0.732 0.62480E+04 37 calcite 0.81 -2.50 -3.31 -1.104 0.56526E+04 40 carpholite-Mg 8.58 5.92 -2.66 -0.177 0.45377E+04 41 carpholite-Fe 6.71 3.94 -2.77 -0.185 0.47264E+04 46 clinochlore 39.07 37.20 -1.87 -0.059 0.31994E+04 47 daphnite 28.97 27.30 -1.67 -0.052 0.28501E+04 50 chloritoid-Mg 13.20 10.29 -2.91 -0.194 0.49638E+04 51 chloritoid-Fe 9.17 8.31 -0.86 -0.058 0.14734E+04 52 chloritoid-Mn 11.40 8.61 -2.79 -0.186 0.47654E+04 54 coesite -2.38 -4.37 -1.99 -0.663 0.33979E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.37 -1.81 -0.602 0.30833E+04 78 fayalite 14.05 9.49 -4.55 -0.650 0.77742E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.06 -4.08 -0.340 0.69725E+04 92 hercynite 17.28 12.68 -4.60 -0.307 0.78574E+04 98 kaolinite -1.33 -2.98 -1.65 -0.150 0.28208E+04 99 kyanite 4.88 1.38 -3.49 -0.349 0.59674E+04 101 laumontite 2.88 -2.05 -4.93 -0.329 0.84162E+04 102 lawsonite 9.62 6.69 -2.93 -0.195 0.50021E+04 106 magnesite 0.69 -3.26 -3.95 -1.317 0.67469E+04 107 magnetite 20.09 19.50 -0.59 -0.048 0.10105E+04 110 magnesioferrite 26.21 21.48 -4.74 -0.387 0.80881E+04 113 margarite 17.32 12.43 -4.89 -0.196 0.83490E+04 128 periclase-Fe 11.63 6.93 -4.70 -1.174 0.80203E+04 142 pyrite -21.25 -22.18 -0.94 -0.220 0.15966E+04 143 pyrrhotite -4.26 -6.98 -2.72 -0.907 0.46437E+04 144 pyrrhotiteFe0.875 -6.02 -8.01 -1.99 -0.732 0.33970E+04 145 pyroxmangite 7.40 2.86 -4.54 -0.907 0.77449E+04 147 quartz -2.99 -4.37 -1.38 -0.459 0.23506E+04 151 rhodochrosite -0.98 -4.94 -3.96 -1.322 0.67700E+04 152 rhodonite 7.45 2.86 -4.58 -0.917 0.78252E+04 155 siderite -2.61 -5.24 -2.63 -0.878 0.44951E+04 156 sillimanite 5.26 1.38 -3.88 -0.388 0.66254E+04 168 sudoite 21.08 16.22 -4.86 -0.157 0.83021E+04 177 topaz-H 4.62 1.38 -3.24 -0.294 0.55274E+04 178 tridymite -2.63 -4.37 -1.74 -0.580 0.29706E+04 181 troilite-low -4.41 -6.98 -2.57 -0.856 0.43866E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.37 -1.56 -0.521 0.26699E+04 205 nontronite-Ca 3.21 -0.91 -4.13 -0.268 0.70482E+04 208 nontronite-Mg 3.07 -1.04 -4.11 -0.267 0.70240E+04 209 nontronite-Na 3.52 -1.38 -4.90 -0.315 0.83678E+04 214 gypsum -4.96 -9.41 -4.45 -1.113 0.76040E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.93 -2.88 -0.721 0.49213E+04 240 silica-amorphous -2.09 -4.37 -2.27 -0.758 0.38841E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0042000 g New total amount of reactant added: 0.0044000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9762E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0044000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2595833E-03 Osmotic coef. = 0.9903 True ionic strength = .2606202E-03 Chg. balance for total moles = 0.9762E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.58289E-07 -7.2344 0.56033E-07 -7.2516 0.96130E+00 -0.0171 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13261E-03 -3.8774 0.96118E+00 -0.0172 4 SO4-- 0.25115E-04 -4.6001 0.22622E-04 -4.6455 0.90075E+00 -0.0454 5 HCO3- 0.11694E-04 -4.9320 0.11241E-04 -4.9492 0.96121E+00 -0.0172 6 HS- 0.22496E-06 -6.6479 0.21623E-06 -6.6651 0.96119E+00 -0.0172 7 Al+++ 0.16278E-18 -18.7884 0.13153E-18 -18.8810 0.80805E+00 -0.0926 8 H4SiO4 0.45033E-04 -4.3465 0.45033E-04 -4.3465 0.10000E+01 0.0000 9 Ca++ 0.19370E-04 -4.7129 0.17445E-04 -4.7583 0.90062E+00 -0.0455 10 Mg++ 0.34674E-05 -5.4600 0.31225E-05 -5.5055 0.90054E+00 -0.0455 11 Fe++ 0.30162E-07 -7.5205 0.27163E-07 -7.5660 0.90056E+00 -0.0455 12 K+ 0.93385E-06 -6.0297 0.89763E-06 -6.0469 0.96122E+00 -0.0172 13 Na+ 0.16558E-03 -3.7810 0.15916E-03 -3.7982 0.96118E+00 -0.0172 14 Mn++ 0.72141E-07 -7.1418 0.64969E-07 -7.1873 0.90058E+00 -0.0455 15 HPO4-- 0.13226E-07 -7.8786 0.11913E-07 -7.9240 0.90075E+00 -0.0454 16 HSiO3- 0.78075E-06 -6.1075 0.75044E-06 -6.1247 0.96118E+00 -0.0172 17 Ca(HSiO3)+ 0.31017E-09 -9.5084 0.29814E-09 -9.5256 0.96122E+00 -0.0172 18 Mg(HSiO3)+ 0.69093E-10 -10.1606 0.66413E-10 -10.1777 0.96122E+00 -0.0172 19 NaHSiO3,aq 0.19317E-08 -8.7141 0.19317E-08 -8.7141 0.10000E+01 0.0000 20 AlO+ 0.59292E-11 -11.2270 0.56992E-11 -11.2442 0.96122E+00 -0.0172 21 AlOH+2 0.17657E-14 -14.7531 0.15901E-14 -14.7986 0.90059E+00 -0.0455 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.83255E-06 -6.0796 0.80020E-06 -6.0968 0.96115E+00 -0.0172 24 CH4,aq 0.10438E-12 -12.9814 0.10437E-12 -12.9814 0.99992E+00 0.0000 29 CO,aq 0.26182E-15 -15.5820 0.26182E-15 -15.5820 0.10000E+01 0.0000 30 CO2,aq 0.13460E-05 -5.8710 0.13459E-05 -5.8710 0.99992E+00 0.0000 31 CO3-2 0.19454E-07 -7.7110 0.17523E-07 -7.7564 0.90071E+00 -0.0454 32 CaCO3,aq 0.38329E-08 -8.4165 0.38329E-08 -8.4165 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.52075E-08 -8.2834 0.50056E-08 -8.3005 0.96122E+00 -0.0172 34 CaCl+ 0.38948E-08 -8.4095 0.37437E-08 -8.4267 0.96122E+00 -0.0172 35 CaCl2,aq 0.11795E-12 -12.9283 0.11795E-12 -12.9283 0.10000E+01 0.0000 36 CaOH+ 0.23084E-07 -7.6367 0.22189E-07 -7.6539 0.96122E+00 -0.0172 37 CaSO4,aq 0.12532E-06 -6.9020 0.12532E-06 -6.9020 0.10000E+01 0.0000 38 HCl,aq 0.13616E-11 -11.8660 0.13616E-11 -11.8660 0.10000E+01 0.0000 43 FeCl+ 0.59313E-11 -11.2268 0.57013E-11 -11.2440 0.96122E+00 -0.0172 44 FeCl2,aq 0.23936E-19 -19.6209 0.23936E-19 -19.6209 0.10000E+01 0.0000 46 FeO,aq 0.33624E-09 -9.4734 0.33624E-09 -9.4734 0.10000E+01 0.0000 47 FeOH+ 0.16416E-07 -7.7847 0.15779E-07 -7.8019 0.96122E+00 -0.0172 48 HFeO2- 0.65322E-10 -10.1849 0.62786E-10 -10.2021 0.96118E+00 -0.0172 49 FeO+ 0.44495E-12 -12.3517 0.42769E-12 -12.3689 0.96122E+00 -0.0172 50 FeOH+2 0.50818E-17 -17.2940 0.45766E-17 -17.3395 0.90059E+00 -0.0455 51 FeO2- 0.28999E-10 -10.5376 0.27874E-10 -10.5548 0.96118E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.77446E-08 -8.1110 0.77440E-08 -8.1110 0.99992E+00 0.0000 54 KCl,aq 0.21574E-11 -11.6661 0.21574E-11 -11.6661 0.10000E+01 0.0000 55 KHSO4,aq 0.32170E-17 -17.4925 0.32170E-17 -17.4925 0.10000E+01 0.0000 56 KOH,aq 0.68413E-11 -11.1649 0.68413E-11 -11.1649 0.10000E+01 0.0000 57 KSO4- 0.32783E-09 -9.4844 0.31510E-09 -9.5015 0.96118E+00 -0.0172 58 MgCO3,aq 0.17197E-09 -9.7646 0.17197E-09 -9.7646 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.95244E-09 -9.0212 0.91550E-09 -9.0383 0.96122E+00 -0.0172 60 MgCl+ 0.63184E-09 -9.1994 0.60734E-09 -9.2166 0.96122E+00 -0.0172 61 MgOH+ 0.22863E-07 -7.6409 0.21977E-07 -7.6580 0.96122E+00 -0.0172 63 MnO,aq 0.21429E-10 -10.6690 0.21429E-10 -10.6690 0.10000E+01 0.0000 64 MnOH+ 0.36476E-08 -8.4380 0.35061E-08 -8.4552 0.96122E+00 -0.0172 65 MnO2-2 0.25148E-18 -18.5995 0.22651E-18 -18.6449 0.90071E+00 -0.0454 66 HMnO2- 0.28929E-14 -14.5387 0.27807E-14 -14.5559 0.96118E+00 -0.0172 69 MnCl+ 0.55193E-10 -10.2581 0.53053E-10 -10.2753 0.96122E+00 -0.0172 70 MnSO4,aq 0.42430E-09 -9.3723 0.42430E-09 -9.3723 0.10000E+01 0.0000 71 NaCl,aq 0.69944E-08 -8.1553 0.69944E-08 -8.1553 0.10000E+01 0.0000 72 NaOH,aq 0.12204E-08 -8.9135 0.12204E-08 -8.9135 0.10000E+01 0.0000 74 OH- 0.10728E-04 -4.9695 0.10311E-04 -4.9867 0.96115E+00 -0.0172 79 HPO3-2 0.31919E-18 -18.4959 0.28750E-18 -18.5414 0.90071E+00 -0.0454 81 H2PO3- 0.33609E-19 -19.4735 0.32304E-19 -19.4907 0.96118E+00 -0.0172 82 H3PO4,aq 0.26160E-12 -12.5824 0.26160E-12 -12.5824 0.10000E+01 0.0000 83 H2PO4- 0.12811E-07 -7.8924 0.12314E-07 -7.9096 0.96120E+00 -0.0172 84 PO4-3 0.21447E-12 -12.6686 0.17347E-12 -12.7608 0.80882E+00 -0.0921 87 H2P2O7-2 0.13201E-16 -16.8794 0.11890E-16 -16.9248 0.90071E+00 -0.0454 88 HP2O7-3 0.52434E-16 -16.2804 0.42370E-16 -16.3729 0.80806E+00 -0.0926 89 P2O7-4 0.26009E-18 -18.5849 0.18064E-18 -18.7432 0.69455E+00 -0.1583 90 H2S,aq 0.37449E-07 -7.4266 0.37445E-07 -7.4266 0.99992E+00 0.0000 91 S2-2 0.14852E-15 -15.8282 0.13378E-15 -15.8736 0.90071E+00 -0.0454 96 SO2,aq 0.24564E-17 -17.6097 0.24564E-17 -17.6097 0.10000E+01 0.0000 97 SO3-2 0.25268E-13 -13.5974 0.22765E-13 -13.6427 0.90096E+00 -0.0453 98 HSO3- 0.83094E-13 -13.0804 0.79869E-13 -13.0976 0.96118E+00 -0.0172 99 HSO4- 0.12709E-08 -8.8959 0.12216E-08 -8.9131 0.96124E+00 -0.0172 101 S2O3-2 0.11048E-13 -13.9567 0.99507E-14 -14.0021 0.90071E+00 -0.0454 102 HS2O3- 0.10372E-18 -18.9841 0.99694E-19 -19.0013 0.96118E+00 -0.0172 Charge balance for all species = 0.9762E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5828903E-07 -.1354033E-04 -.1364763E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999827E+06 0.0000 3 Cl- 0.1379628E-03 0.1379744E-03 0.4891533E+01 3.3741 4 SO4-- 0.2511477E-04 0.2524020E-04 0.2424577E+01 9.8576 5 HCO3- 0.1169444E-04 0.1307002E-04 0.7974840E+00 2.3024 6 HS- 0.2249582E-06 0.2643145E-06 0.8741277E-02 0.5865 7 Al+++ 0.1627758E-18 0.8528094E-06 0.2300973E-01 2.8737 8 H4SiO4 0.4503327E-04 0.4581632E-04 0.4403587E+01 -4.3465 9 Ca++ 0.1937007E-04 0.1953172E-04 0.7827804E+00 9.7448 10 Mg++ 0.3467381E-05 0.3492070E-05 0.8489790E-01 8.9976 11 Fe++ 0.3016181E-07 0.4721343E-07 0.2636688E-02 6.9371 12 K+ 0.9338474E-06 0.9341842E-06 0.3652791E-01 1.2047 13 Na+ 0.1655842E-03 0.1655944E-03 0.3806923E+01 3.4534 14 Mn++ 0.7214146E-07 0.7628995E-07 0.4191154E-02 7.3158 15 HPO4-- 0.1322577E-07 0.2603738E-07 0.2499004E-02 6.5791 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.5981747E-04 -.1354031E-04 -.4627716E-04 0.0000000E+00 2 H2O 0.5550820E+02 0.5550816E+02 0.3007893E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2562641E-04 0.2524016E-04 0.3862531E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1219390E-06 0.2643141E-06 -.3862531E-06 0.0000000E+00 7 Al+++ 0.1434726E-04 0.8528079E-06 0.1349446E-04 0.0000000E+00 8 H4SiO4 0.4581625E-04 0.4581625E-04 0.0000000E+00 0.0000000E+00 9 Ca++ 0.1953169E-04 0.1953169E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3492063E-05 0.3492063E-05 0.0000000E+00 0.0000000E+00 11 Fe++ 0.3137238E-05 0.4721335E-07 0.3090024E-05 0.0000000E+00 12 K+ 0.9341826E-06 0.9341826E-06 0.0000000E+00 0.0000000E+00 13 Na+ 0.1655941E-03 0.1655941E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.7628982E-07 0.7628982E-07 0.0000000E+00 0.0000000E+00 15 HPO4-- 0.2603734E-07 0.2603734E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.6776E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0044000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) diaspore 0.1349E-04 -4.870 0.8095E-03 -3.092 76.64 0.2410E-03 hematite 0.1545E-05 -5.811 0.2467E-03 -3.608 23.36 0.4677E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001056 g Volume = 0.000288 cm3 Porosity: 99.9713% V(tot) - V(min): 0.10015E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0044000 g log = -2.3565 Original solution: 1000.0103000 g Original solution / Rock added: 227275.07 (Water/Rock Ratio), log = 5.3566 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0205 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9998E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1401E-03 1.0071 0.1440E-03 0.1430E-03 CH4,gas 0.1487E-09 1.0125 0.1536E-09 0.1517E-09 H2,gas 0.9958E-05 1.0005 0.1017E-04 0.1016E-04 H2S,gas 0.1013E-05 0.9960 0.1029E-05 0.1033E-05 S2,gas 0.3771E-21 1.0000 0.3848E-21 0.3848E-21 CO,gas 0.3823E-12 1.0000 0.3902E-12 0.3902E-12 SO3,gas 0.2632E-34 1.0000 0.2686E-34 0.2686E-34 SO2,gas 0.1041E-16 1.0000 0.1062E-16 0.1062E-16 HCl,gas 0.2354E-14 1.0000 0.2403E-14 0.2403E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 0.00000E+00 46 clinochlore 39.07 37.70 -1.37 -0.043 0.23451E+04 47 daphnite 28.97 27.39 -1.57 -0.049 0.26839E+04 48 chlorite-Mn 46.87 29.29 -17.58 -0.549 0.30020E+05 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.20 -5.54 -1.847 0.94605E+04 -3.842 3 CH4,gas 4.54 -6.97 -11.51 -2.878 0.19657E+05 -9.814 4 H2,gas 8.00 1.31 -6.69 -3.824 0.11426E+05 -4.993 5 H2S,gas -6.23 -13.92 -7.69 -3.843 0.13124E+05 -5.987 6 S2,gas -7.34 -30.45 -23.11 -3.556 0.39466E+05 -21.415 7 CO,gas 3.21 -10.89 -14.11 -4.341 0.24089E+05 -12.409 8 SO3,gas 17.12 -19.15 -36.27 -9.067 0.61930E+05 -34.571 9 SO2,gas 0.83 -17.84 -18.67 -4.979 0.31883E+05 -16.974 10 HCl,gas 5.19 -11.13 -16.32 -8.159 0.27863E+05 -14.619 21 andalusite 5.00 1.40 -3.60 -0.360 0.61479E+04 24 anhydrite -5.32 -9.40 -4.09 -2.043 0.69784E+04 32 apatite-OH -18.15 -18.56 -0.40 -0.031 0.68955E+03 35 aragonite 0.97 -2.46 -3.42 -1.141 0.58438E+04 36 brucite 12.57 9.00 -3.57 -0.714 0.60973E+04 37 calcite 0.81 -2.46 -3.27 -1.089 0.55796E+04 40 carpholite-Mg 8.58 6.05 -2.53 -0.169 0.43199E+04 41 carpholite-Fe 6.71 3.99 -2.72 -0.181 0.46462E+04 50 chloritoid-Mg 13.20 10.40 -2.80 -0.187 0.47795E+04 51 chloritoid-Fe 9.17 8.34 -0.84 -0.056 0.14268E+04 52 chloritoid-Mn 11.40 8.72 -2.68 -0.179 0.45834E+04 54 coesite -2.38 -4.35 -1.97 -0.657 0.33644E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.35 -1.79 -0.595 0.30498E+04 78 fayalite 14.05 9.53 -4.52 -0.645 0.77144E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.12 -4.02 -0.335 0.68661E+04 92 hercynite 17.28 12.68 -4.59 -0.306 0.78442E+04 98 kaolinite -1.33 -2.95 -1.61 -0.147 0.27538E+04 99 kyanite 4.88 1.40 -3.48 -0.348 0.59338E+04 101 laumontite 2.88 -1.89 -4.78 -0.318 0.81568E+04 102 lawsonite 9.62 6.80 -2.82 -0.188 0.48097E+04 105 lizardite 23.24 18.30 -4.94 -0.412 0.84416E+04 106 magnesite 0.69 -3.20 -3.89 -1.298 0.66485E+04 107 magnetite 20.09 19.50 -0.58 -0.048 0.99738E+03 110 magnesioferrite 26.21 21.56 -4.65 -0.379 0.79373E+04 113 margarite 17.32 12.55 -4.78 -0.191 0.81566E+04 128 periclase-Fe 11.63 6.94 -4.69 -1.172 0.80072E+04 142 pyrite -21.25 -22.20 -0.96 -0.225 0.16345E+04 143 pyrrhotite -4.26 -6.98 -2.72 -0.906 0.46430E+04 144 pyrrhotiteFe0.875 -6.02 -8.01 -1.99 -0.733 0.34012E+04 145 pyroxmangite 7.40 2.97 -4.43 -0.886 0.75630E+04 147 quartz -2.99 -4.35 -1.36 -0.452 0.23171E+04 151 rhodochrosite -0.98 -4.88 -3.91 -1.303 0.66739E+04 152 rhodonite 7.45 2.97 -4.48 -0.895 0.76432E+04 155 siderite -2.61 -5.26 -2.66 -0.885 0.45342E+04 156 sillimanite 5.26 1.40 -3.86 -0.386 0.65919E+04 168 sudoite 21.08 16.45 -4.63 -0.149 0.79000E+04 177 topaz-H 4.62 1.40 -3.22 -0.293 0.54939E+04 178 tridymite -2.63 -4.35 -1.72 -0.573 0.29371E+04 181 troilite-low -4.41 -6.98 -2.57 -0.856 0.43858E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.35 -1.54 -0.515 0.26364E+04 205 nontronite-Ca 3.21 -0.83 -4.04 -0.262 0.69045E+04 206 nontronite-H 2.53 -2.44 -4.97 -0.333 0.84857E+04 208 nontronite-Mg 3.07 -0.95 -4.03 -0.261 0.68761E+04 209 nontronite-Na 3.52 -1.30 -4.82 -0.309 0.82251E+04 214 gypsum -4.96 -9.40 -4.45 -1.112 0.75960E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.94 -2.87 -0.719 0.49081E+04 240 silica-amorphous -2.09 -4.35 -2.26 -0.752 0.38506E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0044000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2594754E-03 Osmotic coef. = 0.9903 True ionic strength = .2604919E-03 Chg. balance for total moles = 0.9762E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.58695E-07 -7.2314 0.56423E-07 -7.2485 0.96130E+00 -0.0171 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13261E-03 -3.8774 0.96119E+00 -0.0172 4 SO4-- 0.25120E-04 -4.6000 0.22627E-04 -4.6454 0.90077E+00 -0.0454 5 HCO3- 0.11686E-04 -4.9323 0.11233E-04 -4.9495 0.96122E+00 -0.0172 6 HS- 0.22017E-06 -6.6572 0.21163E-06 -6.6744 0.96119E+00 -0.0172 7 Al+++ 0.16619E-18 -18.7794 0.13430E-18 -18.8719 0.80809E+00 -0.0925 8 H4SiO4 0.44987E-04 -4.3469 0.44987E-04 -4.3469 0.10000E+01 0.0000 9 Ca++ 0.19370E-04 -4.7129 0.17446E-04 -4.7583 0.90064E+00 -0.0454 10 Mg++ 0.34225E-05 -5.4657 0.30822E-05 -5.5111 0.90056E+00 -0.0455 11 Fe++ 0.30473E-07 -7.5161 0.27444E-07 -7.5616 0.90058E+00 -0.0455 12 K+ 0.93385E-06 -6.0297 0.89763E-06 -6.0469 0.96122E+00 -0.0172 13 Na+ 0.16558E-03 -3.7810 0.15916E-03 -3.7982 0.96119E+00 -0.0172 14 Mn++ 0.72141E-07 -7.1418 0.64969E-07 -7.1873 0.90059E+00 -0.0455 15 HPO4-- 0.13181E-07 -7.8801 0.11873E-07 -7.9255 0.90077E+00 -0.0454 16 HSiO3- 0.77454E-06 -6.1110 0.74448E-06 -6.1281 0.96119E+00 -0.0172 17 Ca(HSiO3)+ 0.30772E-09 -9.5118 0.29578E-09 -9.5290 0.96122E+00 -0.0172 18 Mg(HSiO3)+ 0.67658E-10 -10.1697 0.65035E-10 -10.1869 0.96122E+00 -0.0172 19 NaHSiO3,aq 0.19164E-08 -8.7175 0.19164E-08 -8.7175 0.10000E+01 0.0000 20 AlO+ 0.59704E-11 -11.2240 0.57389E-11 -11.2412 0.96122E+00 -0.0172 21 AlOH+2 0.17903E-14 -14.7471 0.16124E-14 -14.7925 0.90061E+00 -0.0455 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.82679E-06 -6.0826 0.79467E-06 -6.0998 0.96116E+00 -0.0172 24 CH4,aq 0.10206E-12 -12.9911 0.10205E-12 -12.9912 0.99992E+00 0.0000 29 CO,aq 0.26158E-15 -15.5824 0.26158E-15 -15.5824 0.10000E+01 0.0000 30 CO2,aq 0.13544E-05 -5.8683 0.13543E-05 -5.8683 0.99992E+00 0.0000 31 CO3-2 0.19306E-07 -7.7143 0.17389E-07 -7.7597 0.90073E+00 -0.0454 32 CaCO3,aq 0.38039E-08 -8.4198 0.38039E-08 -8.4198 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.52040E-08 -8.2837 0.50022E-08 -8.3008 0.96122E+00 -0.0172 34 CaCl+ 0.38949E-08 -8.4095 0.37439E-08 -8.4267 0.96122E+00 -0.0172 35 CaCl2,aq 0.11795E-12 -12.9283 0.11795E-12 -12.9283 0.10000E+01 0.0000 36 CaOH+ 0.22925E-07 -7.6397 0.22036E-07 -7.6569 0.96122E+00 -0.0172 37 CaSO4,aq 0.12535E-06 -6.9019 0.12535E-06 -6.9019 0.10000E+01 0.0000 38 HCl,aq 0.13711E-11 -11.8629 0.13711E-11 -11.8629 0.10000E+01 0.0000 43 FeCl+ 0.59927E-11 -11.2224 0.57603E-11 -11.2396 0.96122E+00 -0.0172 44 FeCl2,aq 0.24184E-19 -19.6165 0.24184E-19 -19.6165 0.10000E+01 0.0000 46 FeO,aq 0.33504E-09 -9.4749 0.33504E-09 -9.4749 0.10000E+01 0.0000 47 FeOH+ 0.16471E-07 -7.7833 0.15832E-07 -7.8005 0.96122E+00 -0.0172 48 HFeO2- 0.64638E-10 -10.1895 0.62129E-10 -10.2067 0.96119E+00 -0.0172 49 FeO+ 0.44805E-12 -12.3487 0.43067E-12 -12.3659 0.96122E+00 -0.0172 50 FeOH+2 0.51527E-17 -17.2880 0.46406E-17 -17.3334 0.90061E+00 -0.0455 51 FeO2- 0.28799E-10 -10.5406 0.27681E-10 -10.5578 0.96119E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.76893E-08 -8.1141 0.76887E-08 -8.1141 0.99992E+00 0.0000 54 KCl,aq 0.21574E-11 -11.6661 0.21574E-11 -11.6661 0.10000E+01 0.0000 55 KHSO4,aq 0.32402E-17 -17.4894 0.32402E-17 -17.4894 0.10000E+01 0.0000 56 KOH,aq 0.67940E-11 -11.1679 0.67940E-11 -11.1679 0.10000E+01 0.0000 57 KSO4- 0.32790E-09 -9.4843 0.31518E-09 -9.5014 0.96119E+00 -0.0172 58 MgCO3,aq 0.16845E-09 -9.7735 0.16845E-09 -9.7735 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.93947E-09 -9.0271 0.90304E-09 -9.0443 0.96122E+00 -0.0172 60 MgCl+ 0.62368E-09 -9.2050 0.59949E-09 -9.2222 0.96122E+00 -0.0172 61 MgOH+ 0.22412E-07 -7.6495 0.21543E-07 -7.6667 0.96122E+00 -0.0172 63 MnO,aq 0.21134E-10 -10.6750 0.21134E-10 -10.6750 0.10000E+01 0.0000 64 MnOH+ 0.36223E-08 -8.4410 0.34819E-08 -8.4582 0.96122E+00 -0.0172 65 MnO2-2 0.24459E-18 -18.6116 0.22031E-18 -18.6570 0.90073E+00 -0.0454 66 HMnO2- 0.28333E-14 -14.5477 0.27234E-14 -14.5649 0.96119E+00 -0.0172 69 MnCl+ 0.55194E-10 -10.2581 0.53054E-10 -10.2753 0.96122E+00 -0.0172 70 MnSO4,aq 0.42440E-09 -9.3722 0.42440E-09 -9.3722 0.10000E+01 0.0000 71 NaCl,aq 0.69944E-08 -8.1552 0.69944E-08 -8.1552 0.10000E+01 0.0000 72 NaOH,aq 0.12119E-08 -8.9165 0.12119E-08 -8.9165 0.10000E+01 0.0000 74 OH- 0.10654E-04 -4.9725 0.10240E-04 -4.9897 0.96116E+00 -0.0172 79 HPO3-2 0.31583E-18 -18.5006 0.28447E-18 -18.5460 0.90073E+00 -0.0454 81 H2PO3- 0.33487E-19 -19.4751 0.32187E-19 -19.4923 0.96119E+00 -0.0172 82 H3PO4,aq 0.26435E-12 -12.5778 0.26435E-12 -12.5778 0.10000E+01 0.0000 83 H2PO4- 0.12856E-07 -7.8909 0.12358E-07 -7.9081 0.96121E+00 -0.0172 84 PO4-3 0.21225E-12 -12.6732 0.17168E-12 -12.7653 0.80886E+00 -0.0921 87 H2P2O7-2 0.13294E-16 -16.8763 0.11974E-16 -16.9218 0.90073E+00 -0.0454 88 HP2O7-3 0.52439E-16 -16.2803 0.42375E-16 -16.3729 0.80809E+00 -0.0925 89 P2O7-4 0.25830E-18 -18.5879 0.17942E-18 -18.7461 0.69460E+00 -0.1583 90 H2S,aq 0.36907E-07 -7.4329 0.36904E-07 -7.4329 0.99992E+00 0.0000 91 S2-2 0.14329E-15 -15.8438 0.12907E-15 -15.8892 0.90073E+00 -0.0454 96 SO2,aq 0.24735E-17 -17.6067 0.24735E-17 -17.6067 0.10000E+01 0.0000 97 SO3-2 0.25092E-13 -13.6005 0.22608E-13 -13.6457 0.90098E+00 -0.0453 98 HSO3- 0.83094E-13 -13.0804 0.79869E-13 -13.0976 0.96119E+00 -0.0172 99 HSO4- 0.12800E-08 -8.8928 0.12304E-08 -8.9100 0.96124E+00 -0.0172 101 S2O3-2 0.10890E-13 -13.9630 0.98091E-14 -14.0084 0.90073E+00 -0.0454 102 HS2O3- 0.10296E-18 -18.9873 0.98960E-19 -19.0045 0.96119E+00 -0.0172 Charge balance for all species = 0.9762E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5869466E-07 -.1342767E-04 -.1353408E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999828E+06 0.0000 3 Cl- 0.1379628E-03 0.1379744E-03 0.4891533E+01 3.3711 4 SO4-- 0.2512005E-04 0.2524554E-04 0.2425090E+01 9.8517 5 HCO3- 0.1168621E-04 0.1307002E-04 0.7974840E+00 2.2990 6 HS- 0.2201717E-06 0.2589729E-06 0.8564620E-02 0.5741 7 Al+++ 0.1661925E-18 0.8470472E-06 0.2285426E-01 2.8737 8 H4SiO4 0.4498684E-04 0.4576368E-04 0.4398527E+01 -4.3469 9 Ca++ 0.1937024E-04 0.1953172E-04 0.7827804E+00 9.7388 10 Mg++ 0.3422506E-05 0.3446717E-05 0.8379530E-01 8.9859 11 Fe++ 0.3047332E-07 0.4757802E-07 0.2657049E-02 6.9355 12 K+ 0.9338473E-06 0.9341842E-06 0.3652791E-01 1.2016 13 Na+ 0.1655842E-03 0.1655944E-03 0.3806923E+01 3.4504 14 Mn++ 0.7214053E-07 0.7626361E-07 0.4189707E-02 7.3098 15 HPO4-- 0.1318051E-07 0.2603738E-07 0.2499004E-02 6.5716 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.5981747E-04 -.1342765E-04 -.4638982E-04 0.0000000E+00 2 H2O 0.5550820E+02 0.5550816E+02 0.3008283E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2562641E-04 0.2524550E-04 0.3809114E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1219390E-06 0.2589724E-06 -.3809114E-06 0.0000000E+00 7 Al+++ 0.1434726E-04 0.8470457E-06 0.1350022E-04 0.0000000E+00 8 H4SiO4 0.4581625E-04 0.4576360E-04 0.5264855E-07 0.0000000E+00 9 Ca++ 0.1953169E-04 0.1953169E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3492063E-05 0.3446711E-05 0.4535272E-07 0.0000000E+00 11 Fe++ 0.3137238E-05 0.4757793E-07 0.3089660E-05 0.0000000E+00 12 K+ 0.9341826E-06 0.9341826E-06 0.0000000E+00 0.0000000E+00 13 Na+ 0.1655941E-03 0.1655941E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.7628982E-07 0.7626348E-07 0.2634160E-10 0.0000000E+00 15 HPO4-- 0.2603734E-07 0.2603734E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.3124E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0044000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) diaspore 0.1347E-04 -4.871 0.8078E-03 -3.093 76.05 0.2405E-03 hematite 0.1524E-05 -5.817 0.2433E-03 -3.614 22.91 0.4612E-04 clinochlore 0.9071E-08 -8.042 0.5042E-05 -5.297 0.4746 0.1918E-05 daphnite 0.8474E-08 -8.072 0.6046E-05 -5.219 0.5692 0.1832E-05 chlorite-Mn 0.5268E-11 -11.278 0.3735E-08 -8.428 0.3516E-03 0.1190E-08 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5169E+00 0.5169E+00 1.0000 -0.287 daphnite 0.4828E+00 0.4828E+00 1.0000 -0.316 chlorite-Mn 0.3002E-03 0.3002E-03 1.0000 -3.523 Solid products produced: Mass = 0.001062 g Volume = 0.000290 cm3 Porosity: 99.9710% V(tot) - V(min): 0.10015E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0044000 g log = -2.3565 Original solution: 1000.0103000 g Original solution / Rock added: 227275.07 (Water/Rock Ratio), log = 5.3566 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0205 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9998E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1410E-03 1.0071 0.1449E-03 0.1439E-03 CH4,gas 0.1454E-09 1.0125 0.1502E-09 0.1484E-09 H2,gas 0.9887E-05 1.0005 0.1009E-04 0.1009E-04 H2S,gas 0.9981E-06 0.9960 0.1014E-05 0.1019E-05 S2,gas 0.3715E-21 1.0000 0.3791E-21 0.3791E-21 CO,gas 0.3820E-12 1.0000 0.3898E-12 0.3898E-12 SO3,gas 0.2669E-34 1.0000 0.2724E-34 0.2724E-34 SO2,gas 0.1048E-16 1.0000 0.1070E-16 0.1070E-16 HCl,gas 0.2371E-14 1.0000 0.2419E-14 0.2419E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.24265E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.24265E-10 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.20 -5.54 -1.846 0.94558E+04 -3.839 3 CH4,gas 4.54 -6.98 -11.52 -2.881 0.19674E+05 -9.823 4 H2,gas 8.00 1.30 -6.69 -3.826 0.11431E+05 -4.996 5 H2S,gas -6.23 -13.92 -7.69 -3.846 0.13135E+05 -5.994 6 S2,gas -7.34 -30.46 -23.12 -3.557 0.39477E+05 -21.421 7 CO,gas 3.21 -10.89 -14.11 -4.341 0.24089E+05 -12.409 8 SO3,gas 17.12 -19.14 -36.26 -9.066 0.61919E+05 -34.565 9 SO2,gas 0.83 -17.84 -18.67 -4.979 0.31878E+05 -16.971 10 HCl,gas 5.19 -11.13 -16.32 -8.158 0.27858E+05 -14.616 21 andalusite 5.00 1.40 -3.60 -0.360 0.61487E+04 24 anhydrite -5.32 -9.40 -4.09 -2.043 0.69782E+04 32 apatite-OH -18.15 -18.57 -0.42 -0.032 0.71761E+03 35 aragonite 0.97 -2.46 -3.43 -1.142 0.58495E+04 36 brucite 12.57 8.99 -3.58 -0.717 0.61172E+04 37 calcite 0.81 -2.46 -3.27 -1.090 0.55852E+04 40 carpholite-Mg 8.58 6.04 -2.54 -0.170 0.43414E+04 41 carpholite-Fe 6.71 3.99 -2.72 -0.182 0.46504E+04 50 chloritoid-Mg 13.20 10.39 -2.81 -0.187 0.48002E+04 51 chloritoid-Fe 9.17 8.34 -0.84 -0.056 0.14302E+04 52 chloritoid-Mn 11.40 8.71 -2.69 -0.179 0.45945E+04 54 coesite -2.38 -4.35 -1.97 -0.657 0.33652E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.35 -1.79 -0.596 0.30505E+04 78 fayalite 14.05 9.52 -4.52 -0.646 0.77205E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.11 -4.03 -0.336 0.68756E+04 92 hercynite 17.28 12.68 -4.60 -0.306 0.78469E+04 98 kaolinite -1.33 -2.95 -1.61 -0.147 0.27553E+04 99 kyanite 4.88 1.40 -3.48 -0.348 0.59346E+04 101 laumontite 2.88 -1.90 -4.78 -0.319 0.81701E+04 102 lawsonite 9.62 6.79 -2.82 -0.188 0.48215E+04 105 lizardite 23.24 18.26 -4.98 -0.415 0.85030E+04 106 magnesite 0.69 -3.21 -3.90 -1.301 0.66638E+04 107 magnetite 20.09 19.50 -0.59 -0.048 0.10000E+04 110 magnesioferrite 26.21 21.55 -4.66 -0.380 0.79573E+04 113 margarite 17.32 12.54 -4.78 -0.191 0.81684E+04 128 periclase-Fe 11.63 6.94 -4.69 -1.173 0.80099E+04 142 pyrite -21.25 -22.22 -0.97 -0.228 0.16534E+04 143 pyrrhotite -4.26 -6.99 -2.73 -0.909 0.46565E+04 144 pyrrhotiteFe0.875 -6.02 -8.02 -2.00 -0.735 0.34136E+04 145 pyroxmangite 7.40 2.96 -4.44 -0.887 0.75740E+04 147 quartz -2.99 -4.35 -1.36 -0.452 0.23179E+04 151 rhodochrosite -0.98 -4.89 -3.91 -1.304 0.66795E+04 152 rhodonite 7.45 2.96 -4.48 -0.897 0.76543E+04 155 siderite -2.61 -5.26 -2.65 -0.885 0.45323E+04 156 sillimanite 5.26 1.40 -3.86 -0.386 0.65926E+04 168 sudoite 21.08 16.43 -4.65 -0.150 0.79422E+04 177 topaz-H 4.62 1.40 -3.22 -0.293 0.54947E+04 178 tridymite -2.63 -4.35 -1.72 -0.574 0.29378E+04 181 troilite-low -4.41 -6.99 -2.58 -0.859 0.43993E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.35 -1.54 -0.515 0.26372E+04 205 nontronite-Ca 3.21 -0.83 -4.05 -0.262 0.69090E+04 206 nontronite-H 2.53 -2.44 -4.97 -0.333 0.84885E+04 208 nontronite-Mg 3.07 -0.96 -4.03 -0.261 0.68822E+04 209 nontronite-Na 3.52 -1.30 -4.82 -0.309 0.82296E+04 214 gypsum -4.96 -9.40 -4.45 -1.112 0.75958E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.94 -2.88 -0.719 0.49108E+04 240 silica-amorphous -2.09 -4.35 -2.26 -0.752 0.38513E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0044000 g New total amount of reactant added: 0.0046000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9762E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0046000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2597722E-03 Osmotic coef. = 0.9903 True ionic strength = .2608555E-03 Chg. balance for total moles = 0.9762E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.57606E-07 -7.2395 0.55376E-07 -7.2567 0.96129E+00 -0.0171 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13261E-03 -3.8774 0.96117E+00 -0.0172 4 SO4-- 0.25150E-04 -4.5995 0.22653E-04 -4.6449 0.90071E+00 -0.0454 5 HCO3- 0.11708E-04 -4.9315 0.11254E-04 -4.9487 0.96120E+00 -0.0172 6 HS- 0.19337E-06 -6.7136 0.18586E-06 -6.7308 0.96118E+00 -0.0172 7 Al+++ 0.15713E-18 -18.8037 0.12696E-18 -18.8963 0.80798E+00 -0.0926 8 H4SiO4 0.46588E-04 -4.3317 0.46588E-04 -4.3317 0.10000E+01 0.0000 9 Ca++ 0.19598E-04 -4.7078 0.17649E-04 -4.7533 0.90059E+00 -0.0455 10 Mg++ 0.32071E-05 -5.4939 0.28880E-05 -5.5394 0.90051E+00 -0.0455 11 Fe++ 0.28945E-07 -7.5384 0.26066E-07 -7.5839 0.90053E+00 -0.0455 12 K+ 0.97629E-06 -6.0104 0.93842E-06 -6.0276 0.96121E+00 -0.0172 13 Na+ 0.16584E-03 -3.7803 0.15940E-03 -3.7975 0.96117E+00 -0.0172 14 Mn++ 0.75120E-07 -7.1242 0.67649E-07 -7.1697 0.90054E+00 -0.0455 15 HPO4-- 0.13907E-07 -7.8568 0.12527E-07 -7.9022 0.90072E+00 -0.0454 16 HSiO3- 0.81729E-06 -6.0876 0.78556E-06 -6.1048 0.96117E+00 -0.0172 17 Ca(HSiO3)+ 0.32849E-09 -9.4835 0.31575E-09 -9.5007 0.96121E+00 -0.0172 18 Mg(HSiO3)+ 0.66895E-10 -10.1746 0.64301E-10 -10.1918 0.96121E+00 -0.0172 19 NaHSiO3,aq 0.20252E-08 -8.6935 0.20252E-08 -8.6935 0.10000E+01 0.0000 20 AlO+ 0.58597E-11 -11.2321 0.56324E-11 -11.2493 0.96121E+00 -0.0172 21 AlOH+2 0.17245E-14 -14.7633 0.15530E-14 -14.8088 0.90056E+00 -0.0455 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.84244E-06 -6.0745 0.80970E-06 -6.0917 0.96114E+00 -0.0172 24 CH4,aq 0.89701E-13 -13.0472 0.89694E-13 -13.0472 0.99992E+00 0.0000 29 CO,aq 0.25008E-15 -15.6019 0.25008E-15 -15.6019 0.10000E+01 0.0000 30 CO2,aq 0.13317E-05 -5.8756 0.13316E-05 -5.8756 0.99992E+00 0.0000 31 CO3-2 0.19709E-07 -7.7053 0.17751E-07 -7.7508 0.90068E+00 -0.0454 32 CaCO3,aq 0.39285E-08 -8.4058 0.39285E-08 -8.4058 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.52748E-08 -8.2778 0.50702E-08 -8.2950 0.96121E+00 -0.0172 34 CaCl+ 0.39404E-08 -8.4045 0.37875E-08 -8.4216 0.96121E+00 -0.0172 35 CaCl2,aq 0.11932E-12 -12.9233 0.11932E-12 -12.9233 0.10000E+01 0.0000 36 CaOH+ 0.23632E-07 -7.6265 0.22715E-07 -7.6437 0.96121E+00 -0.0172 37 CaSO4,aq 0.12696E-06 -6.8963 0.12696E-06 -6.8963 0.10000E+01 0.0000 38 HCl,aq 0.13456E-11 -11.8711 0.13456E-11 -11.8711 0.10000E+01 0.0000 43 FeCl+ 0.56918E-11 -11.2447 0.54710E-11 -11.2619 0.96121E+00 -0.0172 44 FeCl2,aq 0.22969E-19 -19.6389 0.22969E-19 -19.6389 0.10000E+01 0.0000 46 FeO,aq 0.33037E-09 -9.4810 0.33037E-09 -9.4810 0.10000E+01 0.0000 47 FeOH+ 0.15940E-07 -7.7975 0.15322E-07 -7.8147 0.96121E+00 -0.0172 48 HFeO2- 0.64944E-10 -10.1875 0.62423E-10 -10.2047 0.96117E+00 -0.0172 49 FeO+ 0.43973E-12 -12.3568 0.42268E-12 -12.3740 0.96121E+00 -0.0172 50 FeOH+2 0.49634E-17 -17.3042 0.44698E-17 -17.3497 0.90056E+00 -0.0455 51 FeO2- 0.29344E-10 -10.5325 0.28205E-10 -10.5497 0.96117E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.74766E-08 -8.1263 0.74760E-08 -8.1263 0.99992E+00 0.0000 54 KCl,aq 0.22554E-11 -11.6468 0.22554E-11 -11.6468 0.10000E+01 0.0000 55 KHSO4,aq 0.33284E-17 -17.4778 0.33284E-17 -17.4778 0.10000E+01 0.0000 56 KOH,aq 0.72371E-11 -11.1404 0.72371E-11 -11.1404 0.10000E+01 0.0000 57 KSO4- 0.34320E-09 -9.4645 0.32988E-09 -9.4816 0.96117E+00 -0.0172 58 MgCO3,aq 0.16113E-09 -9.7928 0.16113E-09 -9.7928 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.88196E-09 -9.0546 0.84774E-09 -9.0717 0.96121E+00 -0.0172 60 MgCl+ 0.58439E-09 -9.2333 0.56172E-09 -9.2505 0.96121E+00 -0.0172 61 MgOH+ 0.21398E-07 -7.6696 0.20568E-07 -7.6868 0.96121E+00 -0.0172 63 MnO,aq 0.22846E-10 -10.6412 0.22846E-10 -10.6412 0.10000E+01 0.0000 64 MnOH+ 0.38432E-08 -8.4153 0.36941E-08 -8.4325 0.96121E+00 -0.0172 65 MnO2-2 0.27453E-18 -18.5614 0.24726E-18 -18.6068 0.90068E+00 -0.0454 66 HMnO2- 0.31209E-14 -14.5057 0.29997E-14 -14.5229 0.96117E+00 -0.0172 69 MnCl+ 0.57470E-10 -10.2406 0.55241E-10 -10.2577 0.96121E+00 -0.0172 70 MnSO4,aq 0.44241E-09 -9.3542 0.44241E-09 -9.3542 0.10000E+01 0.0000 71 NaCl,aq 0.70048E-08 -8.1546 0.70048E-08 -8.1546 0.10000E+01 0.0000 72 NaOH,aq 0.12367E-08 -8.9077 0.12367E-08 -8.9077 0.10000E+01 0.0000 74 OH- 0.10856E-04 -4.9643 0.10434E-04 -4.9816 0.96114E+00 -0.0172 79 HPO3-2 0.32403E-18 -18.4894 0.29184E-18 -18.5349 0.90068E+00 -0.0454 81 H2PO3- 0.33717E-19 -19.4722 0.32408E-19 -19.4894 0.96117E+00 -0.0172 82 H3PO4,aq 0.26865E-12 -12.5708 0.26865E-12 -12.5708 0.10000E+01 0.0000 83 H2PO4- 0.13313E-07 -7.8757 0.12796E-07 -7.8929 0.96119E+00 -0.0172 84 PO4-3 0.22821E-12 -12.6417 0.18456E-12 -12.7339 0.80876E+00 -0.0922 87 H2P2O7-2 0.14255E-16 -16.8460 0.12839E-16 -16.8915 0.90068E+00 -0.0454 88 HP2O7-3 0.57299E-16 -16.2419 0.46297E-16 -16.3344 0.80799E+00 -0.0926 89 P2O7-4 0.28761E-18 -18.5412 0.19973E-18 -18.6996 0.69444E+00 -0.1584 90 H2S,aq 0.31812E-07 -7.4974 0.31810E-07 -7.4974 0.99992E+00 0.0000 91 S2-2 0.11368E-15 -15.9443 0.10239E-15 -15.9898 0.90068E+00 -0.0454 96 SO2,aq 0.23193E-17 -17.6346 0.23193E-17 -17.6346 0.10000E+01 0.0000 97 SO3-2 0.24428E-13 -13.6121 0.22008E-13 -13.6574 0.90093E+00 -0.0453 98 HSO3- 0.79387E-13 -13.1002 0.76305E-13 -13.1174 0.96117E+00 -0.0172 99 HSO4- 0.12577E-08 -8.9004 0.12089E-08 -8.9176 0.96123E+00 -0.0172 101 S2O3-2 0.93981E-14 -14.0270 0.84646E-14 -14.0724 0.90068E+00 -0.0454 102 HS2O3- 0.87196E-19 -19.0595 0.83811E-19 -19.0767 0.96117E+00 -0.0172 Charge balance for all species = 0.9762E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5760567E-07 -.1376317E-04 -.1387223E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999826E+06 0.0000 3 Cl- 0.1379628E-03 0.1379744E-03 0.4891532E+01 3.3792 4 SO4-- 0.2515033E-04 0.2527749E-04 0.2428159E+01 9.8685 5 HCO3- 0.1170833E-04 0.1307002E-04 0.7974840E+00 2.3080 6 HS- 0.1933703E-06 0.2270232E-06 0.7507994E-02 0.5259 7 Al+++ 0.1571267E-18 0.8627017E-06 0.2327663E-01 2.8737 8 H4SiO4 0.4658768E-04 0.4740739E-04 0.4556510E+01 -4.3317 9 Ca++ 0.1959769E-04 0.1976175E-04 0.7919993E+00 9.7601 10 Mg++ 0.3207103E-05 0.3230196E-05 0.7853131E-01 8.9740 11 Fe++ 0.2894503E-07 0.4551483E-07 0.2541828E-02 6.9294 12 K+ 0.9762945E-06 0.9766472E-06 0.3818827E-01 1.2291 13 Na+ 0.1658352E-03 0.1658454E-03 0.3812694E+01 3.4592 14 Mn++ 0.7512032E-07 0.7948621E-07 0.4366746E-02 7.3436 15 HPO4-- 0.1390743E-07 0.2722090E-07 0.2612595E-02 6.6112 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.6312917E-04 -.1376314E-04 -.4936603E-04 0.0000000E+00 2 H2O 0.5550819E+02 0.5550816E+02 0.3143712E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2563195E-04 0.2527745E-04 0.3545044E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1274817E-06 0.2270228E-06 -.3545044E-06 0.0000000E+00 7 Al+++ 0.1499941E-04 0.8627002E-06 0.1413671E-04 0.0000000E+00 8 H4SiO4 0.4789880E-04 0.4740730E-04 0.4914988E-06 0.0000000E+00 9 Ca++ 0.1976172E-04 0.1976172E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3650794E-05 0.3230190E-05 0.4206039E-06 0.0000000E+00 11 Fe++ 0.3279840E-05 0.4551475E-07 0.3234325E-05 0.0000000E+00 12 K+ 0.9766454E-06 0.9766454E-06 0.0000000E+00 0.0000000E+00 13 Na+ 0.1658451E-03 0.1658451E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.7975754E-07 0.7948607E-07 0.2714697E-09 0.0000000E+00 15 HPO4-- 0.2722085E-07 0.2722085E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.5593E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0046000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) clinochlore 0.8412E-07 -7.075 0.4676E-04 -4.330 4.036 0.1779E-04 daphnite 0.7966E-07 -7.099 0.5684E-04 -4.245 4.906 0.1722E-04 chlorite-Mn 0.5429E-10 -10.265 0.3849E-07 -7.415 0.3323E-02 0.1227E-07 diaspore 0.1381E-04 -4.860 0.8284E-03 -3.082 71.51 0.2466E-03 hematite 0.1418E-05 -5.848 0.2265E-03 -3.645 19.55 0.4292E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity clinochlore 0.5135E+00 0.5135E+00 1.0000 -0.289 daphnite 0.4862E+00 0.4862E+00 1.0000 -0.313 chlorite-Mn 0.3314E-03 0.3314E-03 1.0000 -3.480 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001158 g Volume = 0.000325 cm3 Porosity: 99.9676% V(tot) - V(min): 0.10015E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0046000 g log = -2.3372 Original solution: 1000.0103000 g Original solution / Rock added: 217393.54 (Water/Rock Ratio), log = 5.3372 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1386E-03 1.0071 0.1425E-03 0.1415E-03 CH4,gas 0.1278E-09 1.0125 0.1320E-09 0.1304E-09 H2,gas 0.9613E-05 1.0005 0.9815E-05 0.9810E-05 H2S,gas 0.8603E-06 0.9960 0.8744E-06 0.8779E-06 S2,gas 0.2920E-21 1.0000 0.2979E-21 0.2979E-21 CO,gas 0.3652E-12 1.0000 0.3727E-12 0.3727E-12 SO3,gas 0.2574E-34 1.0000 0.2627E-34 0.2627E-34 SO2,gas 0.9828E-17 1.0000 0.1003E-16 0.1003E-16 HCl,gas 0.2327E-14 1.0000 0.2374E-14 0.2374E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 46 clinochlore 39.07 39.07 0.00 0.000 0.00000E+00 47 daphnite 28.97 28.97 0.00 0.000 -0.24265E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 -0.12132E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.21 -5.55 -1.848 0.94684E+04 -3.846 3 CH4,gas 4.54 -7.03 -11.58 -2.895 0.19770E+05 -9.879 4 H2,gas 8.00 1.29 -6.71 -3.833 0.11452E+05 -5.008 5 H2S,gas -6.23 -13.99 -7.76 -3.879 0.13245E+05 -6.058 6 S2,gas -7.34 -30.56 -23.22 -3.573 0.39656E+05 -21.526 7 CO,gas 3.21 -10.91 -14.13 -4.347 0.24123E+05 -12.429 8 SO3,gas 17.12 -19.16 -36.28 -9.070 0.61946E+05 -34.581 9 SO2,gas 0.83 -17.87 -18.70 -4.986 0.31926E+05 -16.999 10 HCl,gas 5.19 -11.13 -16.32 -8.162 0.27872E+05 -14.624 21 andalusite 5.00 1.42 -3.59 -0.359 0.61228E+04 24 anhydrite -5.32 -9.40 -4.08 -2.041 0.69688E+04 32 apatite-OH -18.15 -18.45 -0.29 -0.023 0.49966E+03 35 aragonite 0.97 -2.45 -3.41 -1.137 0.58256E+04 36 brucite 12.57 8.97 -3.59 -0.719 0.61377E+04 37 calcite 0.81 -2.45 -3.26 -1.086 0.55613E+04 40 carpholite-Mg 8.58 6.06 -2.52 -0.168 0.43100E+04 41 carpholite-Fe 6.71 4.01 -2.70 -0.180 0.46089E+04 50 chloritoid-Mg 13.20 10.39 -2.81 -0.187 0.47947E+04 51 chloritoid-Fe 9.17 8.35 -0.83 -0.055 0.14147E+04 52 chloritoid-Mn 11.40 8.76 -2.64 -0.176 0.45108E+04 54 coesite -2.38 -4.33 -1.96 -0.652 0.33392E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.33 -1.77 -0.590 0.30246E+04 78 fayalite 14.05 9.53 -4.52 -0.646 0.77154E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.12 -4.01 -0.335 0.68549E+04 92 hercynite 17.28 12.68 -4.60 -0.307 0.78573E+04 98 kaolinite -1.33 -2.92 -1.58 -0.144 0.27034E+04 99 kyanite 4.88 1.42 -3.46 -0.346 0.59087E+04 101 laumontite 2.88 -1.82 -4.70 -0.314 0.80300E+04 102 lawsonite 9.62 6.84 -2.77 -0.185 0.47332E+04 105 lizardite 23.24 18.26 -4.99 -0.415 0.85125E+04 106 magnesite 0.69 -3.23 -3.92 -1.307 0.66967E+04 107 magnetite 20.09 19.50 -0.59 -0.048 0.10104E+04 110 magnesioferrite 26.21 21.54 -4.67 -0.381 0.79777E+04 113 margarite 17.32 12.59 -4.73 -0.189 0.80801E+04 128 periclase-Fe 11.63 6.93 -4.70 -1.174 0.80203E+04 142 pyrite -21.25 -22.34 -1.09 -0.257 0.18634E+04 143 pyrrhotite -4.26 -7.06 -2.80 -0.933 0.47771E+04 144 pyrrhotiteFe0.875 -6.02 -8.08 -2.07 -0.760 0.35303E+04 145 pyroxmangite 7.40 3.01 -4.39 -0.877 0.74903E+04 147 quartz -2.99 -4.33 -1.34 -0.447 0.22919E+04 151 rhodochrosite -0.98 -4.86 -3.89 -1.295 0.66343E+04 152 rhodonite 7.45 3.01 -4.43 -0.887 0.75706E+04 155 siderite -2.61 -5.28 -2.67 -0.889 0.45552E+04 156 sillimanite 5.26 1.42 -3.85 -0.385 0.65667E+04 168 sudoite 21.08 16.45 -4.63 -0.149 0.79053E+04 177 topaz-H 4.62 1.42 -3.20 -0.291 0.54687E+04 178 tridymite -2.63 -4.33 -1.71 -0.568 0.29119E+04 181 troilite-low -4.41 -7.06 -2.65 -0.882 0.45199E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.33 -1.53 -0.510 0.26112E+04 205 nontronite-Ca 3.21 -0.77 -3.99 -0.259 0.68078E+04 206 nontronite-H 2.53 -2.38 -4.92 -0.329 0.83933E+04 208 nontronite-Mg 3.07 -0.90 -3.98 -0.258 0.67904E+04 209 nontronite-Na 3.52 -1.24 -4.76 -0.306 0.81295E+04 214 gypsum -4.96 -9.40 -4.44 -1.111 0.75863E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.93 -2.88 -0.721 0.49212E+04 240 silica-amorphous -2.09 -4.33 -2.24 -0.747 0.38254E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0046000 g New total amount of reactant added: 0.0048000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9762E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0048000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2601008E-03 Osmotic coef. = 0.9903 True ionic strength = .2612566E-03 Chg. balance for total moles = 0.9762E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.56451E-07 -7.2483 0.54265E-07 -7.2655 0.96127E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13260E-03 -3.8774 0.96116E+00 -0.0172 4 SO4-- 0.25180E-04 -4.5989 0.22678E-04 -4.6444 0.90065E+00 -0.0454 5 HCO3- 0.11732E-04 -4.9306 0.11276E-04 -4.9478 0.96119E+00 -0.0172 6 HS- 0.16714E-06 -6.7769 0.16064E-06 -6.7941 0.96116E+00 -0.0172 7 Al+++ 0.14788E-18 -18.8301 0.11947E-18 -18.9227 0.80786E+00 -0.0927 8 H4SiO4 0.48197E-04 -4.3170 0.48197E-04 -4.3170 0.10000E+01 0.0000 9 Ca++ 0.19825E-04 -4.7028 0.17853E-04 -4.7483 0.90053E+00 -0.0455 10 Mg++ 0.30046E-05 -5.5222 0.27055E-05 -5.5678 0.90045E+00 -0.0455 11 Fe++ 0.27361E-07 -7.5629 0.24638E-07 -7.6084 0.90047E+00 -0.0455 12 K+ 0.10187E-05 -5.9919 0.97921E-06 -6.0091 0.96119E+00 -0.0172 13 Na+ 0.16609E-03 -3.7797 0.15963E-03 -3.7969 0.96116E+00 -0.0172 14 Mn++ 0.78046E-07 -7.1076 0.70279E-07 -7.1532 0.90048E+00 -0.0455 15 HPO4-- 0.14656E-07 -7.8340 0.13200E-07 -7.8794 0.90066E+00 -0.0454 16 HSiO3- 0.86284E-06 -6.0641 0.82933E-06 -6.0813 0.96116E+00 -0.0172 17 Ca(HSiO3)+ 0.35080E-09 -9.4549 0.33719E-09 -9.4721 0.96119E+00 -0.0172 18 Mg(HSiO3)+ 0.66160E-10 -10.1794 0.63593E-10 -10.1966 0.96119E+00 -0.0172 19 NaHSiO3,aq 0.21412E-08 -8.6693 0.21412E-08 -8.6693 0.10000E+01 0.0000 20 AlO+ 0.57422E-11 -11.2409 0.55194E-11 -11.2581 0.96119E+00 -0.0172 21 AlOH+2 0.16562E-14 -14.7809 0.14914E-14 -14.8264 0.90050E+00 -0.0455 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.85969E-06 -6.0657 0.82627E-06 -6.0829 0.96113E+00 -0.0172 24 CH4,aq 0.77598E-13 -13.1101 0.77592E-13 -13.1102 0.99992E+00 0.0000 29 CO,aq 0.23790E-15 -15.6236 0.23790E-15 -15.6236 0.10000E+01 0.0000 30 CO2,aq 0.13076E-05 -5.8835 0.13075E-05 -5.8835 0.99992E+00 0.0000 31 CO3-2 0.20154E-07 -7.6956 0.18151E-07 -7.7411 0.90062E+00 -0.0455 32 CaCO3,aq 0.40632E-08 -8.3911 0.40632E-08 -8.3911 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.53464E-08 -8.2719 0.51389E-08 -8.2891 0.96119E+00 -0.0172 34 CaCl+ 0.39858E-08 -8.3995 0.38312E-08 -8.4167 0.96119E+00 -0.0172 35 CaCl2,aq 0.12070E-12 -12.9183 0.12070E-12 -12.9183 0.10000E+01 0.0000 36 CaOH+ 0.24394E-07 -7.6127 0.23447E-07 -7.6299 0.96119E+00 -0.0172 37 CaSO4,aq 0.12857E-06 -6.8909 0.12857E-06 -6.8909 0.10000E+01 0.0000 38 HCl,aq 0.13186E-11 -11.8799 0.13186E-11 -11.8799 0.10000E+01 0.0000 43 FeCl+ 0.53800E-11 -11.2692 0.51712E-11 -11.2864 0.96119E+00 -0.0172 44 FeCl2,aq 0.21710E-19 -19.6633 0.21710E-19 -19.6633 0.10000E+01 0.0000 46 FeO,aq 0.32518E-09 -9.4879 0.32518E-09 -9.4879 0.10000E+01 0.0000 47 FeOH+ 0.15376E-07 -7.8132 0.14779E-07 -7.8304 0.96119E+00 -0.0172 48 HFeO2- 0.65233E-10 -10.1855 0.62699E-10 -10.2027 0.96116E+00 -0.0172 49 FeO+ 0.43092E-12 -12.3656 0.41420E-12 -12.3828 0.96119E+00 -0.0172 50 FeOH+2 0.47667E-17 -17.3218 0.42924E-17 -17.3673 0.90050E+00 -0.0455 51 FeO2- 0.29945E-10 -10.5237 0.28782E-10 -10.5409 0.96116E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.72436E-08 -8.1400 0.72430E-08 -8.1401 0.99992E+00 0.0000 54 KCl,aq 0.23534E-11 -11.6283 0.23534E-11 -11.6283 0.10000E+01 0.0000 55 KHSO4,aq 0.34071E-17 -17.4676 0.34071E-17 -17.4676 0.10000E+01 0.0000 56 KOH,aq 0.77062E-11 -11.1132 0.77062E-11 -11.1132 0.10000E+01 0.0000 57 KSO4- 0.35852E-09 -9.4455 0.34459E-09 -9.4627 0.96116E+00 -0.0172 58 MgCO3,aq 0.15434E-09 -9.8115 0.15434E-09 -9.8115 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.82787E-09 -9.0820 0.79575E-09 -9.0992 0.96119E+00 -0.0172 60 MgCl+ 0.54745E-09 -9.2617 0.52621E-09 -9.2788 0.96119E+00 -0.0172 61 MgOH+ 0.20456E-07 -7.6892 0.19662E-07 -7.7064 0.96119E+00 -0.0172 63 MnO,aq 0.24716E-10 -10.6070 0.24716E-10 -10.6070 0.10000E+01 0.0000 64 MnOH+ 0.40744E-08 -8.3899 0.39163E-08 -8.4071 0.96119E+00 -0.0172 65 MnO2-2 0.30929E-18 -18.5096 0.27855E-18 -18.5551 0.90062E+00 -0.0455 66 HMnO2- 0.34454E-14 -14.4628 0.33116E-14 -14.4800 0.96116E+00 -0.0172 69 MnCl+ 0.59705E-10 -10.2240 0.57388E-10 -10.2412 0.96119E+00 -0.0172 70 MnSO4,aq 0.46012E-09 -9.3371 0.46012E-09 -9.3371 0.10000E+01 0.0000 71 NaCl,aq 0.70152E-08 -8.1540 0.70152E-08 -8.1540 0.10000E+01 0.0000 72 NaOH,aq 0.12639E-08 -8.8983 0.12639E-08 -8.8983 0.10000E+01 0.0000 74 OH- 0.11078E-04 -4.9555 0.10647E-04 -4.9728 0.96113E+00 -0.0172 79 HPO3-2 0.33083E-18 -18.4804 0.29795E-18 -18.5259 0.90062E+00 -0.0455 81 H2PO3- 0.33732E-19 -19.4720 0.32422E-19 -19.4892 0.96116E+00 -0.0172 82 H3PO4,aq 0.27186E-12 -12.5657 0.27186E-12 -12.5657 0.10000E+01 0.0000 83 H2PO4- 0.13748E-07 -7.8618 0.13214E-07 -7.8790 0.96118E+00 -0.0172 84 PO4-3 0.24544E-12 -12.6101 0.19847E-12 -12.7023 0.80864E+00 -0.0922 87 H2P2O7-2 0.15202E-16 -16.8181 0.13691E-16 -16.8636 0.90062E+00 -0.0455 88 HP2O7-3 0.62360E-16 -16.2051 0.50379E-16 -16.2978 0.80787E+00 -0.0927 89 P2O7-4 0.31946E-18 -18.4956 0.22179E-18 -18.6541 0.69426E+00 -0.1585 90 H2S,aq 0.26944E-07 -7.5695 0.26942E-07 -7.5696 0.99992E+00 0.0000 91 S2-2 0.87661E-16 -16.0572 0.78949E-16 -16.1027 0.90062E+00 -0.0455 96 SO2,aq 0.21602E-17 -17.6655 0.21602E-17 -17.6655 0.10000E+01 0.0000 97 SO3-2 0.23694E-13 -13.6254 0.21345E-13 -13.6707 0.90087E+00 -0.0453 98 HSO3- 0.75455E-13 -13.1223 0.72524E-13 -13.1395 0.96116E+00 -0.0172 99 HSO4- 0.12338E-08 -8.9087 0.11860E-08 -8.9259 0.96121E+00 -0.0172 101 S2O3-2 0.79694E-14 -14.0986 0.71773E-14 -14.1440 0.90062E+00 -0.0455 102 HS2O3- 0.72454E-19 -19.1399 0.69640E-19 -19.1571 0.96116E+00 -0.0172 Charge balance for all species = 0.9782E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5645135E-07 -.1412995E-04 -.1424192E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999824E+06 0.0000 3 Cl- 0.1379628E-03 0.1379744E-03 0.4891532E+01 3.3880 4 SO4-- 0.2517982E-04 0.2530866E-04 0.2431152E+01 9.8866 5 HCO3- 0.1173185E-04 0.1307002E-04 0.7974839E+00 2.3177 6 HS- 0.1671357E-06 0.1958624E-06 0.6477460E-02 0.4713 7 Al+++ 0.1478836E-18 0.8799559E-06 0.2374216E-01 2.8737 8 H4SiO4 0.4819720E-04 0.4906260E-04 0.4715598E+01 -4.3170 9 Ca++ 0.1982507E-04 0.1999178E-04 0.8012182E+00 9.7827 10 Mg++ 0.3004610E-05 0.3026661E-05 0.7358304E-01 8.9632 11 Fe++ 0.2736089E-07 0.4336127E-07 0.2421559E-02 6.9226 12 K+ 0.1018742E-05 0.1019110E-05 0.3984863E-01 1.2564 13 Na+ 0.1660861E-03 0.1660965E-03 0.3818465E+01 3.4686 14 Mn++ 0.7804616E-07 0.8266507E-07 0.4541383E-02 7.3778 15 HPO4-- 0.1465619E-07 0.2840442E-07 0.2726185E-02 6.6515 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.6644087E-04 -.1412993E-04 -.5231095E-04 0.0000000E+00 2 H2O 0.5550819E+02 0.5550816E+02 0.3278687E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2563749E-04 0.2530861E-04 0.3288864E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1330244E-06 0.1958620E-06 -.3288864E-06 0.0000000E+00 7 Al+++ 0.1565156E-04 0.8799543E-06 0.1477161E-04 0.0000000E+00 8 H4SiO4 0.4998136E-04 0.4906251E-04 0.9188505E-06 0.0000000E+00 9 Ca++ 0.1999174E-04 0.1999174E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3809524E-05 0.3026656E-05 0.7828682E-06 0.0000000E+00 11 Fe++ 0.3422441E-05 0.4336119E-07 0.3379080E-05 0.0000000E+00 12 K+ 0.1019108E-05 0.1019108E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1660962E-03 0.1660962E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.8322526E-07 0.8266492E-07 0.5603453E-09 0.0000000E+00 15 HPO4-- 0.2840437E-07 0.2840437E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8897E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0048000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) clinochlore 0.1566E-06 -6.805 0.8703E-04 -4.060 6.944 0.3310E-04 daphnite 0.1496E-06 -6.825 0.1067E-03 -3.972 8.516 0.3235E-04 chlorite-Mn 0.1121E-09 -9.951 0.7945E-07 -7.100 0.6339E-02 0.2532E-07 diaspore 0.1416E-04 -4.849 0.8494E-03 -3.071 67.77 0.2529E-03 hematite 0.1316E-05 -5.881 0.2101E-03 -3.678 16.76 0.3982E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity clinochlore 0.5112E+00 0.5112E+00 1.0000 -0.291 daphnite 0.4884E+00 0.4884E+00 1.0000 -0.311 chlorite-Mn 0.3659E-03 0.3659E-03 1.0000 -3.437 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001253 g Volume = 0.000358 cm3 Porosity: 99.9643% V(tot) - V(min): 0.10016E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0048000 g log = -2.3188 Original solution: 1000.0103000 g Original solution / Rock added: 208335.48 (Water/Rock Ratio), log = 5.3188 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1361E-03 1.0071 0.1399E-03 0.1389E-03 CH4,gas 0.1105E-09 1.0125 0.1142E-09 0.1128E-09 H2,gas 0.9314E-05 1.0005 0.9509E-05 0.9504E-05 H2S,gas 0.7287E-06 0.9960 0.7406E-06 0.7436E-06 S2,gas 0.2231E-21 1.0000 0.2277E-21 0.2277E-21 CO,gas 0.3474E-12 1.0000 0.3545E-12 0.3545E-12 SO3,gas 0.2474E-34 1.0000 0.2525E-34 0.2525E-34 SO2,gas 0.9154E-17 1.0000 0.9341E-17 0.9341E-17 HCl,gas 0.2280E-14 1.0000 0.2327E-14 0.2327E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 46 clinochlore 39.07 39.07 0.00 0.000 -0.24265E-10 47 daphnite 28.97 28.97 0.00 0.000 -0.18198E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.12132E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.21 -5.55 -1.851 0.94819E+04 -3.854 3 CH4,gas 4.54 -7.10 -11.64 -2.910 0.19877E+05 -9.942 4 H2,gas 8.00 1.28 -6.72 -3.840 0.11476E+05 -5.022 5 H2S,gas -6.23 -14.06 -7.83 -3.915 0.13368E+05 -6.130 6 S2,gas -7.34 -30.68 -23.34 -3.591 0.39855E+05 -21.643 7 CO,gas 3.21 -10.93 -14.15 -4.354 0.24160E+05 -12.450 8 SO3,gas 17.12 -19.18 -36.30 -9.074 0.61976E+05 -34.598 9 SO2,gas 0.83 -17.90 -18.73 -4.994 0.31979E+05 -17.030 10 HCl,gas 5.19 -11.14 -16.33 -8.166 0.27887E+05 -14.633 21 andalusite 5.00 1.43 -3.57 -0.357 0.60976E+04 24 anhydrite -5.32 -9.39 -4.08 -2.038 0.69594E+04 32 apatite-OH -18.15 -18.32 -0.16 -0.013 0.28052E+03 35 aragonite 0.97 -2.43 -3.40 -1.132 0.58005E+04 36 brucite 12.57 8.96 -3.61 -0.721 0.61561E+04 37 calcite 0.81 -2.43 -3.24 -1.081 0.55363E+04 40 carpholite-Mg 8.58 6.08 -2.51 -0.167 0.42780E+04 41 carpholite-Fe 6.71 4.04 -2.68 -0.178 0.45703E+04 50 chloritoid-Mg 13.20 10.39 -2.80 -0.187 0.47879E+04 51 chloritoid-Fe 9.17 8.35 -0.82 -0.055 0.14012E+04 52 chloritoid-Mn 11.40 8.81 -2.59 -0.173 0.44273E+04 54 coesite -2.38 -4.32 -1.94 -0.647 0.33141E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.32 -1.76 -0.586 0.29994E+04 78 fayalite 14.05 9.53 -4.52 -0.645 0.77137E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.13 -4.01 -0.334 0.68398E+04 92 hercynite 17.28 12.67 -4.61 -0.307 0.78690E+04 98 kaolinite -1.33 -2.89 -1.55 -0.141 0.26531E+04 99 kyanite 4.88 1.43 -3.45 -0.345 0.58835E+04 101 laumontite 2.88 -1.74 -4.62 -0.308 0.78907E+04 102 lawsonite 9.62 6.90 -2.72 -0.181 0.46443E+04 105 lizardite 23.24 18.26 -4.99 -0.416 0.85172E+04 106 magnesite 0.69 -3.25 -3.94 -1.314 0.67286E+04 107 magnetite 20.09 19.49 -0.60 -0.049 0.10222E+04 110 magnesioferrite 26.21 21.53 -4.68 -0.382 0.79961E+04 113 margarite 17.32 12.64 -4.68 -0.187 0.79912E+04 128 periclase-Fe 11.63 6.92 -4.70 -1.176 0.80320E+04 142 pyrite -21.25 -22.48 -1.23 -0.289 0.20979E+04 143 pyrrhotite -4.26 -7.14 -2.88 -0.959 0.49119E+04 144 pyrrhotiteFe0.875 -6.02 -8.16 -2.14 -0.789 0.36608E+04 145 pyroxmangite 7.40 3.06 -4.34 -0.868 0.74068E+04 147 quartz -2.99 -4.32 -1.33 -0.443 0.22667E+04 151 rhodochrosite -0.98 -4.84 -3.86 -1.286 0.65895E+04 152 rhodonite 7.45 3.06 -4.38 -0.877 0.74870E+04 155 siderite -2.61 -5.29 -2.68 -0.894 0.45805E+04 156 sillimanite 5.26 1.43 -3.83 -0.383 0.65415E+04 168 sudoite 21.08 16.47 -4.61 -0.149 0.78665E+04 177 topaz-H 4.62 1.43 -3.19 -0.290 0.54436E+04 178 tridymite -2.63 -4.32 -1.69 -0.564 0.28867E+04 181 troilite-low -4.41 -7.14 -2.73 -0.909 0.46548E+04 189 wollastonite 10.46 5.47 -5.00 -0.999 0.85296E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.32 -1.51 -0.505 0.25860E+04 205 nontronite-Ca 3.21 -0.71 -3.93 -0.255 0.67090E+04 206 nontronite-H 2.53 -2.33 -4.86 -0.326 0.83009E+04 208 nontronite-Mg 3.07 -0.85 -3.92 -0.255 0.67010E+04 209 nontronite-Na 3.52 -1.18 -4.70 -0.302 0.80317E+04 214 gypsum -4.96 -9.39 -4.44 -1.109 0.75770E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.92 -2.89 -0.722 0.49329E+04 240 silica-amorphous -2.09 -4.32 -2.23 -0.742 0.38002E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0048000 g New total amount of reactant added: 0.0050000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0050000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2604599E-03 Osmotic coef. = 0.9903 True ionic strength = .2616942E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.55240E-07 -7.2577 0.53100E-07 -7.2749 0.96125E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13260E-03 -3.8775 0.96114E+00 -0.0172 4 SO4-- 0.25208E-04 -4.5985 0.22702E-04 -4.6439 0.90059E+00 -0.0455 5 HCO3- 0.11757E-04 -4.9297 0.11300E-04 -4.9469 0.96117E+00 -0.0172 6 HS- 0.14201E-06 -6.8477 0.13649E-06 -6.8649 0.96114E+00 -0.0172 7 Al+++ 0.13858E-18 -18.8583 0.11194E-18 -18.9510 0.80773E+00 -0.0927 8 H4SiO4 0.49818E-04 -4.3026 0.49818E-04 -4.3026 0.10000E+01 0.0000 9 Ca++ 0.20052E-04 -4.6978 0.18056E-04 -4.7434 0.90046E+00 -0.0455 10 Mg++ 0.28149E-05 -5.5505 0.25345E-05 -5.5961 0.90038E+00 -0.0456 11 Fe++ 0.25739E-07 -7.5894 0.23175E-07 -7.6350 0.90040E+00 -0.0456 12 K+ 0.10612E-05 -5.9742 0.10200E-05 -5.9914 0.96117E+00 -0.0172 13 Na+ 0.16634E-03 -3.7790 0.15987E-03 -3.7962 0.96114E+00 -0.0172 14 Mn++ 0.80914E-07 -7.0920 0.72856E-07 -7.1375 0.90042E+00 -0.0456 15 HPO4-- 0.15428E-07 -7.8117 0.13894E-07 -7.8572 0.90059E+00 -0.0455 16 HSiO3- 0.91145E-06 -6.0403 0.87603E-06 -6.0575 0.96114E+00 -0.0172 17 Ca(HSiO3)+ 0.37479E-09 -9.4262 0.36024E-09 -9.4434 0.96118E+00 -0.0172 18 Mg(HSiO3)+ 0.65469E-10 -10.1840 0.62927E-10 -10.2012 0.96118E+00 -0.0172 19 NaHSiO3,aq 0.22652E-08 -8.6449 0.22652E-08 -8.6449 0.10000E+01 0.0000 20 AlO+ 0.56190E-11 -11.2503 0.54009E-11 -11.2675 0.96118E+00 -0.0172 21 AlOH+2 0.15859E-14 -14.7997 0.14280E-14 -14.8453 0.90044E+00 -0.0455 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.87857E-06 -6.0562 0.84440E-06 -6.0734 0.96111E+00 -0.0172 24 CH4,aq 0.66001E-13 -13.1805 0.65995E-13 -13.1805 0.99992E+00 0.0000 29 CO,aq 0.22513E-15 -15.6476 0.22513E-15 -15.6476 0.10000E+01 0.0000 30 CO2,aq 0.12822E-05 -5.8920 0.12821E-05 -5.8921 0.99992E+00 0.0000 31 CO3-2 0.20641E-07 -7.6853 0.18588E-07 -7.7308 0.90055E+00 -0.0455 32 CaCO3,aq 0.42085E-08 -8.3759 0.42085E-08 -8.3759 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.54187E-08 -8.2661 0.52083E-08 -8.2833 0.96118E+00 -0.0172 34 CaCl+ 0.40313E-08 -8.3946 0.38748E-08 -8.4118 0.96118E+00 -0.0172 35 CaCl2,aq 0.12207E-12 -12.9134 0.12207E-12 -12.9134 0.10000E+01 0.0000 36 CaOH+ 0.25214E-07 -7.5984 0.24235E-07 -7.6156 0.96118E+00 -0.0172 37 CaSO4,aq 0.13017E-06 -6.8855 0.13017E-06 -6.8855 0.10000E+01 0.0000 38 HCl,aq 0.12903E-11 -11.8893 0.12903E-11 -11.8893 0.10000E+01 0.0000 43 FeCl+ 0.50606E-11 -11.2958 0.48641E-11 -11.3130 0.96118E+00 -0.0172 44 FeCl2,aq 0.20421E-19 -19.6899 0.20421E-19 -19.6899 0.10000E+01 0.0000 46 FeO,aq 0.31945E-09 -9.4956 0.31945E-09 -9.4956 0.10000E+01 0.0000 47 FeOH+ 0.14781E-07 -7.8303 0.14207E-07 -7.8475 0.96118E+00 -0.0172 48 HFeO2- 0.65491E-10 -10.1838 0.62946E-10 -10.2010 0.96114E+00 -0.0172 49 FeO+ 0.42168E-12 -12.3750 0.40531E-12 -12.3922 0.96118E+00 -0.0172 50 FeOH+2 0.45645E-17 -17.3406 0.41100E-17 -17.3862 0.90044E+00 -0.0455 51 FeO2- 0.30602E-10 -10.5142 0.29413E-10 -10.5315 0.96114E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.69905E-08 -8.1555 0.69899E-08 -8.1555 0.99992E+00 0.0000 54 KCl,aq 0.24513E-11 -11.6106 0.24513E-11 -11.6106 0.10000E+01 0.0000 55 KHSO4,aq 0.34765E-17 -17.4589 0.34765E-17 -17.4589 0.10000E+01 0.0000 56 KOH,aq 0.82032E-11 -11.0860 0.82032E-11 -11.0860 0.10000E+01 0.0000 57 KSO4- 0.37385E-09 -9.4273 0.35932E-09 -9.4445 0.96114E+00 -0.0172 58 MgCO3,aq 0.14807E-09 -9.8295 0.14807E-09 -9.8295 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.77717E-09 -9.1095 0.74700E-09 -9.1267 0.96118E+00 -0.0172 60 MgCl+ 0.51284E-09 -9.2900 0.49293E-09 -9.3072 0.96118E+00 -0.0172 61 MgOH+ 0.19583E-07 -7.7081 0.18823E-07 -7.7253 0.96118E+00 -0.0172 63 MnO,aq 0.26759E-10 -10.5725 0.26759E-10 -10.5725 0.10000E+01 0.0000 64 MnOH+ 0.43165E-08 -8.3649 0.41489E-08 -8.3821 0.96118E+00 -0.0172 65 MnO2-2 0.34974E-18 -18.4563 0.31496E-18 -18.5017 0.90055E+00 -0.0455 66 HMnO2- 0.38122E-14 -14.4188 0.36640E-14 -14.4360 0.96114E+00 -0.0172 69 MnCl+ 0.61894E-10 -10.2084 0.59491E-10 -10.2255 0.96118E+00 -0.0172 70 MnSO4,aq 0.47749E-09 -9.3210 0.47749E-09 -9.3210 0.10000E+01 0.0000 71 NaCl,aq 0.70255E-08 -8.1533 0.70255E-08 -8.1533 0.10000E+01 0.0000 72 NaOH,aq 0.12936E-08 -8.8882 0.12936E-08 -8.8882 0.10000E+01 0.0000 74 OH- 0.11321E-04 -4.9461 0.10881E-04 -4.9633 0.96111E+00 -0.0172 79 HPO3-2 0.33607E-18 -18.4736 0.30265E-18 -18.5191 0.90055E+00 -0.0455 81 H2PO3- 0.33530E-19 -19.4746 0.32227E-19 -19.4918 0.96114E+00 -0.0172 82 H3PO4,aq 0.27399E-12 -12.5623 0.27399E-12 -12.5623 0.10000E+01 0.0000 83 H2PO4- 0.14160E-07 -7.8489 0.13610E-07 -7.8661 0.96116E+00 -0.0172 84 PO4-3 0.26405E-12 -12.5783 0.21348E-12 -12.6706 0.80851E+00 -0.0923 87 H2P2O7-2 0.16128E-16 -16.7924 0.14524E-16 -16.8379 0.90055E+00 -0.0455 88 HP2O7-3 0.67614E-16 -16.1700 0.54615E-16 -16.2627 0.80774E+00 -0.0927 89 P2O7-4 0.35402E-18 -18.4510 0.24571E-18 -18.6096 0.69406E+00 -0.1586 90 H2S,aq 0.22402E-07 -7.6497 0.22400E-07 -7.6498 0.99992E+00 0.0000 91 S2-2 0.65579E-16 -16.1832 0.59057E-16 -16.2287 0.90055E+00 -0.0455 96 SO2,aq 0.19982E-17 -17.6994 0.19982E-17 -17.6994 0.10000E+01 0.0000 97 SO3-2 0.22892E-13 -13.6403 0.20621E-13 -13.6857 0.90081E+00 -0.0454 98 HSO3- 0.71331E-13 -13.1467 0.68559E-13 -13.1639 0.96114E+00 -0.0172 99 HSO4- 0.12086E-08 -8.9177 0.11617E-08 -8.9349 0.96120E+00 -0.0172 101 S2O3-2 0.66332E-14 -14.1783 0.59735E-14 -14.2238 0.90055E+00 -0.0455 102 HS2O3- 0.59008E-19 -19.2291 0.56715E-19 -19.2463 0.96114E+00 -0.0172 Charge balance for all species = 0.9763E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5524026E-07 -.1452845E-04 -.1464357E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999822E+06 0.0000 3 Cl- 0.1379628E-03 0.1379744E-03 0.4891531E+01 3.3975 4 SO4-- 0.2520788E-04 0.2533839E-04 0.2434008E+01 9.9059 5 HCO3- 0.1175660E-04 0.1307003E-04 0.7974838E+00 2.3280 6 HS- 0.1420097E-06 0.1661305E-06 0.5494180E-02 0.4100 7 Al+++ 0.1385831E-18 0.8988351E-06 0.2425154E-01 2.8737 8 H4SiO4 0.4981814E-04 0.5073229E-04 0.4876078E+01 -4.3026 9 Ca++ 0.2005240E-04 0.2022181E-04 0.8104370E+00 9.8064 10 Mg++ 0.2814857E-05 0.2835944E-05 0.6894640E-01 8.9537 11 Fe++ 0.2573862E-07 0.4113880E-07 0.2297442E-02 6.9148 12 K+ 0.1061189E-05 0.1061573E-05 0.4150898E-01 1.2835 13 Na+ 0.1663370E-03 0.1663475E-03 0.3824236E+01 3.4787 14 Mn++ 0.8091361E-07 0.8579626E-07 0.4713401E-02 7.4123 15 HPO4-- 0.1542758E-07 0.2958794E-07 0.2839776E-02 6.6926 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.6975258E-04 -.1452842E-04 -.5522416E-04 0.0000000E+00 2 H2O 0.5550819E+02 0.5550815E+02 0.3413514E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2564304E-04 0.2533834E-04 0.3046972E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1385670E-06 0.1661301E-06 -.3046972E-06 0.0000000E+00 7 Al+++ 0.1630371E-04 0.8988333E-06 0.1540487E-04 0.0000000E+00 8 H4SiO4 0.5206391E-04 0.5073219E-04 0.1331723E-05 0.0000000E+00 9 Ca++ 0.2022177E-04 0.2022177E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.3968254E-05 0.2835939E-05 0.1132315E-05 0.0000000E+00 11 Fe++ 0.3565043E-05 0.4113872E-07 0.3523904E-05 0.0000000E+00 12 K+ 0.1061571E-05 0.1061571E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1663472E-03 0.1663472E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.8669298E-07 0.8579610E-07 0.8968836E-09 0.0000000E+00 15 HPO4-- 0.2958788E-07 0.2958788E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.3782E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0050000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) clinochlore 0.2265E-06 -6.645 0.1259E-03 -3.900 9.348 0.4788E-04 daphnite 0.2173E-06 -6.663 0.1550E-03 -3.810 11.51 0.4698E-04 chlorite-Mn 0.1794E-09 -9.746 0.1272E-06 -6.896 0.9444E-02 0.4053E-07 diaspore 0.1452E-04 -4.838 0.8709E-03 -3.060 64.68 0.2593E-03 hematite 0.1219E-05 -5.914 0.1946E-03 -3.711 14.45 0.3689E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity clinochlore 0.5102E+00 0.5102E+00 1.0000 -0.292 daphnite 0.4894E+00 0.4894E+00 1.0000 -0.310 chlorite-Mn 0.4041E-03 0.4041E-03 1.0000 -3.394 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001347 g Volume = 0.000391 cm3 Porosity: 99.9610% V(tot) - V(min): 0.10016E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0050000 g log = -2.3010 Original solution: 1000.0103000 g Original solution / Rock added: 200002.06 (Water/Rock Ratio), log = 5.3010 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1335E-03 1.0071 0.1372E-03 0.1362E-03 CH4,gas 0.9402E-10 1.0125 0.9714E-10 0.9594E-10 H2,gas 0.8988E-05 1.0005 0.9177E-05 0.9172E-05 H2S,gas 0.6058E-06 0.9960 0.6158E-06 0.6182E-06 S2,gas 0.1656E-21 1.0000 0.1690E-21 0.1690E-21 CO,gas 0.3288E-12 1.0000 0.3355E-12 0.3355E-12 SO3,gas 0.2372E-34 1.0000 0.2420E-34 0.2420E-34 SO2,gas 0.8468E-17 1.0000 0.8641E-17 0.8641E-17 HCl,gas 0.2231E-14 1.0000 0.2277E-14 0.2277E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.30331E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 -0.24265E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.22 -5.56 -1.854 0.94964E+04 -3.863 3 CH4,gas 4.54 -7.17 -11.71 -2.928 0.19997E+05 -10.013 4 H2,gas 8.00 1.26 -6.74 -3.849 0.11502E+05 -5.037 5 H2S,gas -6.23 -14.14 -7.91 -3.955 0.13505E+05 -6.211 6 S2,gas -7.34 -30.81 -23.47 -3.611 0.40076E+05 -21.772 7 CO,gas 3.21 -10.96 -14.17 -4.361 0.24201E+05 -12.474 8 SO3,gas 17.12 -19.19 -36.32 -9.079 0.62007E+05 -34.616 9 SO2,gas 0.83 -17.93 -18.76 -5.003 0.32036E+05 -17.063 10 HCl,gas 5.19 -11.15 -16.34 -8.171 0.27903E+05 -14.643 21 andalusite 5.00 1.44 -3.56 -0.356 0.60730E+04 24 anhydrite -5.32 -9.39 -4.07 -2.035 0.69503E+04 32 apatite-OH -18.15 -18.19 -0.04 -0.003 0.60179E+02 35 aragonite 0.97 -2.42 -3.38 -1.127 0.57745E+04 36 brucite 12.57 8.95 -3.61 -0.723 0.61723E+04 37 calcite 0.81 -2.42 -3.23 -1.076 0.55103E+04 40 carpholite-Mg 8.58 6.10 -2.49 -0.166 0.42452E+04 41 carpholite-Fe 6.71 4.06 -2.66 -0.177 0.45344E+04 50 chloritoid-Mg 13.20 10.40 -2.80 -0.187 0.47796E+04 51 chloritoid-Fe 9.17 8.36 -0.81 -0.054 0.13899E+04 52 chloritoid-Mn 11.40 8.86 -2.54 -0.170 0.43438E+04 54 coesite -2.38 -4.30 -1.93 -0.642 0.32895E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.30 -1.74 -0.581 0.29749E+04 78 fayalite 14.05 9.53 -4.52 -0.646 0.77155E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.14 -4.00 -0.333 0.68303E+04 92 hercynite 17.28 12.66 -4.62 -0.308 0.78822E+04 98 kaolinite -1.33 -2.86 -1.53 -0.139 0.26040E+04 99 kyanite 4.88 1.44 -3.43 -0.343 0.58589E+04 101 laumontite 2.88 -1.66 -4.54 -0.303 0.77520E+04 102 lawsonite 9.62 6.95 -2.67 -0.178 0.45546E+04 105 lizardite 23.24 18.26 -4.99 -0.416 0.85168E+04 106 magnesite 0.69 -3.27 -3.96 -1.320 0.67594E+04 107 magnetite 20.09 19.48 -0.61 -0.050 0.10354E+04 110 magnesioferrite 26.21 21.52 -4.69 -0.383 0.80123E+04 113 margarite 17.32 12.70 -4.63 -0.185 0.79015E+04 128 periclase-Fe 11.63 6.91 -4.71 -1.178 0.80452E+04 142 pyrite -21.25 -22.63 -1.38 -0.325 0.23586E+04 143 pyrrhotite -4.26 -7.22 -2.96 -0.988 0.50620E+04 144 pyrrhotiteFe0.875 -6.02 -8.25 -2.23 -0.820 0.38060E+04 145 pyroxmangite 7.40 3.11 -4.29 -0.858 0.73234E+04 147 quartz -2.99 -4.30 -1.31 -0.438 0.22422E+04 151 rhodochrosite -0.98 -4.81 -3.83 -1.278 0.65451E+04 152 rhodonite 7.45 3.11 -4.34 -0.867 0.74036E+04 155 siderite -2.61 -5.31 -2.70 -0.900 0.46082E+04 156 sillimanite 5.26 1.44 -3.82 -0.382 0.65170E+04 168 sudoite 21.08 16.49 -4.58 -0.148 0.78254E+04 177 topaz-H 4.62 1.44 -3.17 -0.289 0.54190E+04 178 tridymite -2.63 -4.30 -1.68 -0.559 0.28622E+04 181 troilite-low -4.41 -7.22 -2.81 -0.938 0.48049E+04 189 wollastonite 10.46 5.50 -4.96 -0.991 0.84645E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.30 -1.50 -0.500 0.25615E+04 205 nontronite-Ca 3.21 -0.66 -3.87 -0.251 0.66123E+04 206 nontronite-H 2.53 -2.28 -4.81 -0.322 0.82109E+04 208 nontronite-Mg 3.07 -0.80 -3.87 -0.251 0.66136E+04 209 nontronite-Na 3.52 -1.13 -4.65 -0.298 0.79360E+04 214 gypsum -4.96 -9.39 -4.43 -1.108 0.75678E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.91 -2.90 -0.724 0.49461E+04 240 silica-amorphous -2.09 -4.30 -2.21 -0.737 0.37757E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0050000 g New total amount of reactant added: 0.0052000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0052000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2608482E-03 Osmotic coef. = 0.9903 True ionic strength = .2621668E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.53982E-07 -7.2678 0.51889E-07 -7.2849 0.96124E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13260E-03 -3.8775 0.96112E+00 -0.0172 4 SO4-- 0.25234E-04 -4.5980 0.22724E-04 -4.6435 0.90052E+00 -0.0455 5 HCO3- 0.11782E-04 -4.9288 0.11325E-04 -4.9460 0.96115E+00 -0.0172 6 HS- 0.11852E-06 -6.9262 0.11391E-06 -6.9434 0.96113E+00 -0.0172 7 Al+++ 0.12934E-18 -18.8883 0.10446E-18 -18.9811 0.80759E+00 -0.0928 8 H4SiO4 0.51453E-04 -4.2886 0.51453E-04 -4.2886 0.10000E+01 0.0000 9 Ca++ 0.20280E-04 -4.6929 0.18260E-04 -4.7385 0.90040E+00 -0.0456 10 Mg++ 0.26376E-05 -5.5788 0.23746E-05 -5.6244 0.90032E+00 -0.0456 11 Fe++ 0.24097E-07 -7.6180 0.21696E-07 -7.6636 0.90033E+00 -0.0456 12 K+ 0.11036E-05 -5.9572 0.10608E-05 -5.9744 0.96116E+00 -0.0172 13 Na+ 0.16659E-03 -3.7784 0.16011E-03 -3.7956 0.96112E+00 -0.0172 14 Mn++ 0.83718E-07 -7.0772 0.75376E-07 -7.1228 0.90035E+00 -0.0456 15 HPO4-- 0.16222E-07 -7.7899 0.14608E-07 -7.8354 0.90052E+00 -0.0455 16 HSiO3- 0.96334E-06 -6.0162 0.92589E-06 -6.0334 0.96112E+00 -0.0172 17 Ca(HSiO3)+ 0.40058E-09 -9.3973 0.38502E-09 -9.4145 0.96116E+00 -0.0172 18 Mg(HSiO3)+ 0.64833E-10 -10.1882 0.62315E-10 -10.2054 0.96116E+00 -0.0172 19 NaHSiO3,aq 0.23977E-08 -8.6202 0.23977E-08 -8.6202 0.10000E+01 0.0000 20 AlO+ 0.54911E-11 -11.2603 0.52778E-11 -11.2775 0.96116E+00 -0.0172 21 AlOH+2 0.15146E-14 -14.8197 0.13637E-14 -14.8653 0.90037E+00 -0.0456 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.89909E-06 -6.0462 0.86410E-06 -6.0634 0.96109E+00 -0.0172 24 CH4,aq 0.55149E-13 -13.2585 0.55145E-13 -13.2585 0.99992E+00 0.0000 29 CO,aq 0.21190E-15 -15.6739 0.21190E-15 -15.6739 0.10000E+01 0.0000 30 CO2,aq 0.12557E-05 -5.9011 0.12556E-05 -5.9011 0.99992E+00 0.0000 31 CO3-2 0.21170E-07 -7.6743 0.19063E-07 -7.7198 0.90048E+00 -0.0455 32 CaCO3,aq 0.43646E-08 -8.3601 0.43646E-08 -8.3601 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.54917E-08 -8.2603 0.52784E-08 -8.2775 0.96116E+00 -0.0172 34 CaCl+ 0.40766E-08 -8.3897 0.39183E-08 -8.4069 0.96116E+00 -0.0172 35 CaCl2,aq 0.12344E-12 -12.9086 0.12344E-12 -12.9086 0.10000E+01 0.0000 36 CaOH+ 0.26093E-07 -7.5835 0.25079E-07 -7.6007 0.96116E+00 -0.0172 37 CaSO4,aq 0.13176E-06 -6.8802 0.13176E-06 -6.8802 0.10000E+01 0.0000 38 HCl,aq 0.12608E-11 -11.8993 0.12608E-11 -11.8993 0.10000E+01 0.0000 43 FeCl+ 0.47376E-11 -11.3244 0.45536E-11 -11.3416 0.96116E+00 -0.0172 44 FeCl2,aq 0.19116E-19 -19.7186 0.19116E-19 -19.7186 0.10000E+01 0.0000 46 FeO,aq 0.31317E-09 -9.5042 0.31317E-09 -9.5042 0.10000E+01 0.0000 47 FeOH+ 0.14160E-07 -7.8489 0.13610E-07 -7.8661 0.96116E+00 -0.0172 48 HFeO2- 0.65703E-10 -10.1824 0.63149E-10 -10.1996 0.96112E+00 -0.0172 49 FeO+ 0.41207E-12 -12.3850 0.39607E-12 -12.4022 0.96116E+00 -0.0172 50 FeOH+2 0.43591E-17 -17.3606 0.39248E-17 -17.4062 0.90037E+00 -0.0456 51 FeO2- 0.31317E-10 -10.5042 0.30100E-10 -10.5214 0.96112E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.67185E-08 -8.1727 0.67179E-08 -8.1728 0.99992E+00 0.0000 54 KCl,aq 0.25493E-11 -11.5936 0.25493E-11 -11.5936 0.10000E+01 0.0000 55 KHSO4,aq 0.35364E-17 -17.4514 0.35364E-17 -17.4514 0.10000E+01 0.0000 56 KOH,aq 0.87302E-11 -11.0590 0.87302E-11 -11.0590 0.10000E+01 0.0000 57 KSO4- 0.38917E-09 -9.4099 0.37404E-09 -9.4271 0.96112E+00 -0.0172 58 MgCO3,aq 0.14227E-09 -9.8469 0.14227E-09 -9.8469 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.72977E-09 -9.1368 0.70142E-09 -9.1540 0.96116E+00 -0.0172 60 MgCl+ 0.48051E-09 -9.3183 0.46184E-09 -9.3355 0.96116E+00 -0.0172 61 MgOH+ 0.18777E-07 -7.7264 0.18048E-07 -7.7436 0.96116E+00 -0.0172 63 MnO,aq 0.28991E-10 -10.5377 0.28991E-10 -10.5377 0.10000E+01 0.0000 64 MnOH+ 0.45701E-08 -8.3401 0.43926E-08 -8.3573 0.96116E+00 -0.0172 65 MnO2-2 0.39683E-18 -18.4014 0.35734E-18 -18.4469 0.90048E+00 -0.0455 66 HMnO2- 0.42266E-14 -14.3740 0.40623E-14 -14.3912 0.96112E+00 -0.0172 69 MnCl+ 0.64034E-10 -10.1936 0.61547E-10 -10.2108 0.96116E+00 -0.0172 70 MnSO4,aq 0.49448E-09 -9.3059 0.49448E-09 -9.3059 0.10000E+01 0.0000 71 NaCl,aq 0.70359E-08 -8.1527 0.70359E-08 -8.1527 0.10000E+01 0.0000 72 NaOH,aq 0.13257E-08 -8.8775 0.13257E-08 -8.8775 0.10000E+01 0.0000 74 OH- 0.11586E-04 -4.9361 0.11135E-04 -4.9533 0.96109E+00 -0.0172 79 HPO3-2 0.33963E-18 -18.4690 0.30583E-18 -18.5145 0.90048E+00 -0.0455 81 H2PO3- 0.33110E-19 -19.4800 0.31823E-19 -19.4973 0.96112E+00 -0.0172 82 H3PO4,aq 0.27510E-12 -12.5605 0.27510E-12 -12.5605 0.10000E+01 0.0000 83 H2PO4- 0.14549E-07 -7.8372 0.13983E-07 -7.8544 0.96114E+00 -0.0172 84 PO4-3 0.28415E-12 -12.5465 0.22970E-12 -12.6388 0.80837E+00 -0.0924 87 H2P2O7-2 0.17026E-16 -16.7689 0.15332E-16 -16.8144 0.90048E+00 -0.0455 88 HP2O7-3 0.73055E-16 -16.1363 0.58999E-16 -16.2292 0.80760E+00 -0.0928 89 P2O7-4 0.39148E-18 -18.4073 0.27163E-18 -18.5660 0.69385E+00 -0.1587 90 H2S,aq 0.18270E-07 -7.7383 0.18268E-07 -7.7383 0.99992E+00 0.0000 91 S2-2 0.47529E-16 -16.3230 0.42799E-16 -16.3686 0.90048E+00 -0.0455 96 SO2,aq 0.18356E-17 -17.7362 0.18356E-17 -17.7362 0.10000E+01 0.0000 97 SO3-2 0.22024E-13 -13.6571 0.19838E-13 -13.7025 0.90074E+00 -0.0454 98 HSO3- 0.67058E-13 -13.1736 0.64451E-13 -13.1908 0.96112E+00 -0.0172 99 HSO4- 0.11822E-08 -8.9273 0.11363E-08 -8.9445 0.96118E+00 -0.0172 101 S2O3-2 0.54152E-14 -14.2664 0.48763E-14 -14.3119 0.90048E+00 -0.0455 102 HS2O3- 0.47072E-19 -19.3272 0.45242E-19 -19.3445 0.96112E+00 -0.0172 Charge balance for all species = 0.9763E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5398196E-07 -.1495876E-04 -.1507729E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999821E+06 0.0000 3 Cl- 0.1379628E-03 0.1379745E-03 0.4891531E+01 3.4075 4 SO4-- 0.2523391E-04 0.2536608E-04 0.2436668E+01 9.9263 5 HCO3- 0.1178240E-04 0.1307003E-04 0.7974837E+00 2.3389 6 HS- 0.1185191E-06 0.1384396E-06 0.4578403E-02 0.3415 7 Al+++ 0.1293420E-18 0.9193485E-06 0.2480501E-01 2.8737 8 H4SiO4 0.5145304E-04 0.5241924E-04 0.5038216E+01 -4.2886 9 Ca++ 0.2027966E-04 0.2045184E-04 0.8196559E+00 9.8313 10 Mg++ 0.2637569E-05 0.2657763E-05 0.6461452E-01 8.9454 11 Fe++ 0.2409744E-07 0.3887149E-07 0.2170822E-02 6.9062 12 K+ 0.1103636E-05 0.1104036E-05 0.4316934E-01 1.3105 13 Na+ 0.1665878E-03 0.1665986E-03 0.3830008E+01 3.4893 14 Mn++ 0.8371830E-07 0.8887586E-07 0.4882584E-02 7.4471 15 HPO4-- 0.1622211E-07 0.3077146E-07 0.2953367E-02 6.7344 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7306428E-04 -.1495873E-04 -.5810555E-04 0.0000000E+00 2 H2O 0.5550819E+02 0.5550815E+02 0.3548497E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2564858E-04 0.2536603E-04 0.2825491E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1441097E-06 0.1384394E-06 -.2825491E-06 0.0000000E+00 7 Al+++ 0.1695586E-04 0.9193467E-06 0.1603651E-04 0.0000000E+00 8 H4SiO4 0.5414647E-04 0.5241914E-04 0.1727335E-05 0.0000000E+00 9 Ca++ 0.2045180E-04 0.2045180E-04 0.0000000E+00 0.0000000E+00 10 Mg++ 0.4126984E-05 0.2657758E-05 0.1469226E-05 0.0000000E+00 11 Fe++ 0.3707645E-05 0.3887141E-07 0.3668773E-05 0.0000000E+00 12 K+ 0.1104034E-05 0.1104034E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1665983E-03 0.1665983E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.9016070E-07 0.8887568E-07 0.1285017E-08 0.0000000E+00 15 HPO4-- 0.3077140E-07 0.3077140E-07 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.6831E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0052000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) clinochlore 0.2938E-06 -6.532 0.1633E-03 -3.787 11.36 0.6213E-04 daphnite 0.2817E-06 -6.550 0.2010E-03 -3.697 13.98 0.6090E-04 chlorite-Mn 0.2570E-09 -9.590 0.1822E-06 -6.739 0.1267E-01 0.5806E-07 diaspore 0.1488E-04 -4.827 0.8929E-03 -3.049 62.10 0.2658E-03 hematite 0.1130E-05 -5.947 0.1805E-03 -3.744 12.55 0.3421E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity clinochlore 0.5103E+00 0.5103E+00 1.0000 -0.292 daphnite 0.4892E+00 0.4892E+00 1.0000 -0.311 chlorite-Mn 0.4464E-03 0.4464E-03 1.0000 -3.350 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001438 g Volume = 0.000423 cm3 Porosity: 99.9578% V(tot) - V(min): 0.10017E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0052000 g log = -2.2840 Original solution: 1000.0103000 g Original solution / Rock added: 192309.67 (Water/Rock Ratio), log = 5.2840 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1307E-03 1.0071 0.1343E-03 0.1334E-03 CH4,gas 0.7856E-10 1.0125 0.8117E-10 0.8017E-10 H2,gas 0.8639E-05 1.0005 0.8820E-05 0.8815E-05 H2S,gas 0.4941E-06 0.9960 0.5022E-06 0.5042E-06 S2,gas 0.1192E-21 1.0000 0.1217E-21 0.1217E-21 CO,gas 0.3094E-12 1.0000 0.3158E-12 0.3158E-12 SO3,gas 0.2267E-34 1.0000 0.2313E-34 0.2313E-34 SO2,gas 0.7779E-17 1.0000 0.7938E-17 0.7938E-17 HCl,gas 0.2180E-14 1.0000 0.2225E-14 0.2225E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 46 clinochlore 39.07 39.07 0.00 0.000 0.24265E-10 47 daphnite 28.97 28.97 0.00 0.000 0.12132E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.24265E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 0.00000E+00 32 apatite-OH -18.15 -18.06 0.09 0.007 -0.16127E+03 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.23 -5.57 -1.857 0.95119E+04 -3.872 3 CH4,gas 4.54 -7.25 -11.79 -2.947 0.20130E+05 -10.091 4 H2,gas 8.00 1.25 -6.75 -3.859 0.11531E+05 -5.055 5 H2S,gas -6.23 -14.23 -8.00 -3.999 0.13657E+05 -6.299 6 S2,gas -7.34 -30.95 -23.61 -3.633 0.40320E+05 -21.915 7 CO,gas 3.21 -10.98 -14.20 -4.369 0.24245E+05 -12.501 8 SO3,gas 17.12 -19.21 -36.33 -9.084 0.62041E+05 -34.636 9 SO2,gas 0.83 -17.97 -18.80 -5.013 0.32099E+05 -17.100 10 HCl,gas 5.19 -11.16 -16.35 -8.176 0.27920E+05 -14.653 21 andalusite 5.00 1.46 -3.54 -0.354 0.60491E+04 24 anhydrite -5.32 -9.38 -4.07 -2.033 0.69413E+04 35 aragonite 0.97 -2.40 -3.37 -1.122 0.57475E+04 36 brucite 12.57 8.95 -3.62 -0.725 0.61864E+04 37 calcite 0.81 -2.40 -3.21 -1.070 0.54833E+04 40 carpholite-Mg 8.58 6.12 -2.47 -0.164 0.42114E+04 41 carpholite-Fe 6.71 4.08 -2.64 -0.176 0.45012E+04 50 chloritoid-Mg 13.20 10.40 -2.79 -0.186 0.47697E+04 51 chloritoid-Fe 9.17 8.37 -0.81 -0.054 0.13807E+04 52 chloritoid-Mn 11.40 8.91 -2.50 -0.166 0.42605E+04 54 coesite -2.38 -4.29 -1.91 -0.638 0.32656E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.29 -1.73 -0.576 0.29509E+04 78 fayalite 14.05 9.52 -4.52 -0.646 0.77210E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.14 -4.00 -0.333 0.68265E+04 92 hercynite 17.28 12.65 -4.62 -0.308 0.78969E+04 98 kaolinite -1.33 -2.83 -1.50 -0.136 0.25561E+04 99 kyanite 4.88 1.46 -3.42 -0.342 0.58350E+04 101 laumontite 2.88 -1.58 -4.46 -0.297 0.76137E+04 102 lawsonite 9.62 7.00 -2.61 -0.174 0.44642E+04 105 lizardite 23.24 18.26 -4.98 -0.415 0.85112E+04 106 magnesite 0.69 -3.29 -3.98 -1.325 0.67890E+04 107 magnetite 20.09 19.47 -0.61 -0.050 0.10501E+04 110 magnesioferrite 26.21 21.51 -4.70 -0.384 0.80264E+04 113 margarite 17.32 12.75 -4.57 -0.183 0.78111E+04 121 paragonite 4.24 -0.76 -4.99 -0.294 0.85284E+04 128 periclase-Fe 11.63 6.91 -4.72 -1.180 0.80599E+04 142 pyrite -21.25 -22.80 -1.55 -0.365 0.26463E+04 143 pyrrhotite -4.26 -7.32 -3.06 -1.021 0.52280E+04 144 pyrrhotiteFe0.875 -6.02 -8.34 -2.32 -0.854 0.39665E+04 145 pyroxmangite 7.40 3.16 -4.24 -0.848 0.72400E+04 147 quartz -2.99 -4.29 -1.30 -0.433 0.22183E+04 151 rhodochrosite -0.98 -4.78 -3.81 -1.269 0.65012E+04 152 rhodonite 7.45 3.16 -4.29 -0.857 0.73203E+04 155 siderite -2.61 -5.32 -2.72 -0.906 0.46384E+04 156 sillimanite 5.26 1.46 -3.80 -0.380 0.64930E+04 168 sudoite 21.08 16.52 -4.56 -0.147 0.77817E+04 177 topaz-H 4.62 1.46 -3.16 -0.287 0.53951E+04 178 tridymite -2.63 -4.29 -1.66 -0.554 0.28382E+04 181 troilite-low -4.41 -7.32 -2.91 -0.970 0.49708E+04 189 wollastonite 10.46 5.54 -4.92 -0.984 0.83980E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.29 -1.49 -0.495 0.25376E+04 205 nontronite-Ca 3.21 -0.60 -3.82 -0.248 0.65174E+04 206 nontronite-H 2.53 -2.22 -4.76 -0.319 0.81230E+04 208 nontronite-Mg 3.07 -0.75 -3.82 -0.248 0.65281E+04 209 nontronite-Na 3.52 -1.07 -4.59 -0.295 0.78421E+04 214 gypsum -4.96 -9.38 -4.43 -1.107 0.75588E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.91 -2.91 -0.726 0.49608E+04 240 silica-amorphous -2.09 -4.29 -2.20 -0.732 0.37517E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0052000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2608375E-03 Osmotic coef. = 0.9903 True ionic strength = .2621572E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.53991E-07 -7.2677 0.51898E-07 -7.2849 0.96124E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13260E-03 -3.8775 0.96112E+00 -0.0172 4 SO4-- 0.25234E-04 -4.5980 0.22724E-04 -4.6435 0.90052E+00 -0.0455 5 HCO3- 0.11782E-04 -4.9288 0.11324E-04 -4.9460 0.96115E+00 -0.0172 6 HS- 0.11857E-06 -6.9260 0.11396E-06 -6.9432 0.96113E+00 -0.0172 7 Al+++ 0.12940E-18 -18.8881 0.10451E-18 -18.9809 0.80760E+00 -0.0928 8 H4SiO4 0.51454E-04 -4.2886 0.51454E-04 -4.2886 0.10000E+01 0.0000 9 Ca++ 0.20276E-04 -4.6930 0.18257E-04 -4.7386 0.90040E+00 -0.0456 10 Mg++ 0.26383E-05 -5.5787 0.23753E-05 -5.6243 0.90032E+00 -0.0456 11 Fe++ 0.24106E-07 -7.6179 0.21704E-07 -7.6635 0.90034E+00 -0.0456 12 K+ 0.11036E-05 -5.9572 0.10608E-05 -5.9744 0.96116E+00 -0.0172 13 Na+ 0.16659E-03 -3.7784 0.16011E-03 -3.7956 0.96112E+00 -0.0172 14 Mn++ 0.83720E-07 -7.0772 0.75377E-07 -7.1228 0.90035E+00 -0.0456 15 HPO4-- 0.15095E-07 -7.8212 0.13594E-07 -7.8667 0.90053E+00 -0.0455 16 HSiO3- 0.96320E-06 -6.0163 0.92576E-06 -6.0335 0.96112E+00 -0.0172 17 Ca(HSiO3)+ 0.40046E-09 -9.3974 0.38490E-09 -9.4146 0.96116E+00 -0.0172 18 Mg(HSiO3)+ 0.64841E-10 -10.1882 0.62323E-10 -10.2054 0.96116E+00 -0.0172 19 NaHSiO3,aq 0.23973E-08 -8.6203 0.23973E-08 -8.6203 0.10000E+01 0.0000 20 AlO+ 0.54919E-11 -11.2603 0.52786E-11 -11.2775 0.96116E+00 -0.0172 21 AlOH+2 0.15150E-14 -14.8196 0.13641E-14 -14.8652 0.90037E+00 -0.0456 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.89894E-06 -6.0463 0.86396E-06 -6.0635 0.96109E+00 -0.0172 24 CH4,aq 0.55174E-13 -13.2583 0.55169E-13 -13.2583 0.99992E+00 0.0000 29 CO,aq 0.21195E-15 -15.6738 0.21195E-15 -15.6738 0.10000E+01 0.0000 30 CO2,aq 0.12559E-05 -5.9010 0.12558E-05 -5.9011 0.99992E+00 0.0000 31 CO3-2 0.21166E-07 -7.6744 0.19060E-07 -7.7199 0.90049E+00 -0.0455 32 CaCO3,aq 0.43631E-08 -8.3602 0.43631E-08 -8.3602 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.54907E-08 -8.2604 0.52774E-08 -8.2776 0.96116E+00 -0.0172 34 CaCl+ 0.40759E-08 -8.3898 0.39176E-08 -8.4070 0.96116E+00 -0.0172 35 CaCl2,aq 0.12342E-12 -12.9086 0.12342E-12 -12.9086 0.10000E+01 0.0000 36 CaOH+ 0.26084E-07 -7.5836 0.25071E-07 -7.6008 0.96116E+00 -0.0172 37 CaSO4,aq 0.13174E-06 -6.8803 0.13174E-06 -6.8803 0.10000E+01 0.0000 38 HCl,aq 0.12610E-11 -11.8993 0.12610E-11 -11.8993 0.10000E+01 0.0000 43 FeCl+ 0.47393E-11 -11.3243 0.45552E-11 -11.3415 0.96116E+00 -0.0172 44 FeCl2,aq 0.19123E-19 -19.7184 0.19123E-19 -19.7184 0.10000E+01 0.0000 46 FeO,aq 0.31318E-09 -9.5042 0.31318E-09 -9.5042 0.10000E+01 0.0000 47 FeOH+ 0.14163E-07 -7.8488 0.13613E-07 -7.8661 0.96116E+00 -0.0172 48 HFeO2- 0.65695E-10 -10.1825 0.63141E-10 -10.1997 0.96112E+00 -0.0172 49 FeO+ 0.41214E-12 -12.3850 0.39613E-12 -12.4022 0.96116E+00 -0.0172 50 FeOH+2 0.43605E-17 -17.3605 0.39260E-17 -17.4060 0.90037E+00 -0.0456 51 FeO2- 0.31312E-10 -10.5043 0.30095E-10 -10.5215 0.96112E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.67190E-08 -8.1727 0.67184E-08 -8.1727 0.99992E+00 0.0000 54 KCl,aq 0.25493E-11 -11.5936 0.25493E-11 -11.5936 0.10000E+01 0.0000 55 KHSO4,aq 0.35370E-17 -17.4514 0.35370E-17 -17.4514 0.10000E+01 0.0000 56 KOH,aq 0.87288E-11 -11.0590 0.87288E-11 -11.0590 0.10000E+01 0.0000 57 KSO4- 0.38917E-09 -9.4099 0.37404E-09 -9.4271 0.96112E+00 -0.0172 58 MgCO3,aq 0.14229E-09 -9.8468 0.14229E-09 -9.8468 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.72995E-09 -9.1367 0.70160E-09 -9.1539 0.96116E+00 -0.0172 60 MgCl+ 0.48063E-09 -9.3182 0.46197E-09 -9.3354 0.96116E+00 -0.0172 61 MgOH+ 0.18779E-07 -7.7263 0.18050E-07 -7.7435 0.96116E+00 -0.0172 63 MnO,aq 0.28982E-10 -10.5379 0.28982E-10 -10.5379 0.10000E+01 0.0000 64 MnOH+ 0.45694E-08 -8.3401 0.43919E-08 -8.3573 0.96116E+00 -0.0172 65 MnO2-2 0.39658E-18 -18.4017 0.35712E-18 -18.4472 0.90049E+00 -0.0455 66 HMnO2- 0.42246E-14 -14.3742 0.40604E-14 -14.3914 0.96112E+00 -0.0172 69 MnCl+ 0.64035E-10 -10.1936 0.61548E-10 -10.2108 0.96116E+00 -0.0172 70 MnSO4,aq 0.49449E-09 -9.3058 0.49449E-09 -9.3058 0.10000E+01 0.0000 71 NaCl,aq 0.70359E-08 -8.1527 0.70359E-08 -8.1527 0.10000E+01 0.0000 72 NaOH,aq 0.13255E-08 -8.8776 0.13255E-08 -8.8776 0.10000E+01 0.0000 74 OH- 0.11584E-04 -4.9362 0.11133E-04 -4.9534 0.96109E+00 -0.0172 79 HPO3-2 0.31606E-18 -18.5002 0.28461E-18 -18.5457 0.90049E+00 -0.0455 81 H2PO3- 0.30818E-19 -19.5112 0.29620E-19 -19.5284 0.96112E+00 -0.0172 82 H3PO4,aq 0.25607E-12 -12.5916 0.25607E-12 -12.5916 0.10000E+01 0.0000 83 H2PO4- 0.13540E-07 -7.8684 0.13014E-07 -7.8856 0.96114E+00 -0.0172 84 PO4-3 0.26437E-12 -12.5778 0.21371E-12 -12.6702 0.80837E+00 -0.0924 87 H2P2O7-2 0.14748E-16 -16.8313 0.13280E-16 -16.8768 0.90049E+00 -0.0455 88 HP2O7-3 0.63269E-16 -16.1988 0.51096E-16 -16.2916 0.80760E+00 -0.0928 89 P2O7-4 0.33898E-18 -18.4698 0.23521E-18 -18.6286 0.69386E+00 -0.1587 90 H2S,aq 0.18281E-07 -7.7380 0.18279E-07 -7.7380 0.99992E+00 0.0000 91 S2-2 0.47569E-16 -16.3227 0.42835E-16 -16.3682 0.90049E+00 -0.0455 96 SO2,aq 0.18364E-17 -17.7360 0.18364E-17 -17.7360 0.10000E+01 0.0000 97 SO3-2 0.22025E-13 -13.6571 0.19839E-13 -13.7025 0.90074E+00 -0.0454 98 HSO3- 0.67074E-13 -13.1734 0.64466E-13 -13.1907 0.96112E+00 -0.0172 99 HSO4- 0.11824E-08 -8.9272 0.11365E-08 -8.9444 0.96118E+00 -0.0172 101 S2O3-2 0.54186E-14 -14.2661 0.48794E-14 -14.3116 0.90049E+00 -0.0455 102 HS2O3- 0.47109E-19 -19.3269 0.45278E-19 -19.3441 0.96112E+00 -0.0172 Charge balance for all species = 0.9764E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5399063E-07 -.1495697E-04 -.1507549E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999821E+06 0.0000 3 Cl- 0.1379628E-03 0.1379745E-03 0.4891531E+01 3.4074 4 SO4-- 0.2523386E-04 0.2536602E-04 0.2436661E+01 9.9262 5 HCO3- 0.1178222E-04 0.1307003E-04 0.7974837E+00 2.3389 6 HS- 0.1185737E-06 0.1385056E-06 0.4580585E-02 0.3416 7 Al+++ 0.1294039E-18 0.9192036E-06 0.2480110E-01 2.8737 8 H4SiO4 0.5145392E-04 0.5241999E-04 0.5038288E+01 -4.2886 9 Ca++ 0.2027613E-04 0.2044828E-04 0.8195133E+00 9.8311 10 Mg++ 0.2638266E-05 0.2658463E-05 0.6463152E-01 8.9454 11 Fe++ 0.2410606E-07 0.3888291E-07 0.2171459E-02 6.9062 12 K+ 0.1103636E-05 0.1104036E-05 0.4316934E-01 1.3105 13 Na+ 0.1665878E-03 0.1665986E-03 0.3830008E+01 3.4893 14 Mn++ 0.8371987E-07 0.8887679E-07 0.4882635E-02 7.4469 15 HPO4-- 0.1509527E-07 0.2863618E-07 0.2748428E-02 6.7030 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7306428E-04 -.1495694E-04 -.5810734E-04 0.0000000E+00 2 H2O 0.5550819E+02 0.5550815E+02 0.3548600E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2564858E-04 0.2536596E-04 0.2826151E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1441097E-06 0.1385053E-06 -.2826151E-06 0.0000000E+00 7 Al+++ 0.1695586E-04 0.9192017E-06 0.1603665E-04 0.0000000E+00 8 H4SiO4 0.5414647E-04 0.5241988E-04 0.1726591E-05 0.0000000E+00 9 Ca++ 0.2045180E-04 0.2044824E-04 0.3558789E-08 0.0000000E+00 10 Mg++ 0.4126984E-05 0.2658458E-05 0.1468526E-05 0.0000000E+00 11 Fe++ 0.3707645E-05 0.3888283E-07 0.3668762E-05 0.0000000E+00 12 K+ 0.1104034E-05 0.1104034E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1665983E-03 0.1665983E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.9016070E-07 0.8887661E-07 0.1284090E-08 0.0000000E+00 15 HPO4-- 0.3077140E-07 0.2863613E-07 0.2135273E-08 0.0000000E+00 Chg. balance for solid moles: 0.4975E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0052000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) clinochlore 0.2937E-06 -6.532 0.1633E-03 -3.787 11.35 0.6210E-04 daphnite 0.2816E-06 -6.550 0.2009E-03 -3.697 13.97 0.6088E-04 chlorite-Mn 0.2568E-09 -9.590 0.1821E-06 -6.740 0.1266E-01 0.5802E-07 diaspore 0.1489E-04 -4.827 0.8930E-03 -3.049 62.09 0.2658E-03 hematite 0.1130E-05 -5.947 0.1805E-03 -3.743 12.55 0.3422E-04 apatite-OH 0.7118E-09 -9.148 0.3575E-06 -6.447 0.2486E-01 0.1136E-06 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity clinochlore 0.5103E+00 0.5103E+00 1.0000 -0.292 daphnite 0.4892E+00 0.4892E+00 1.0000 -0.310 chlorite-Mn 0.4462E-03 0.4462E-03 1.0000 -3.350 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001438 g Volume = 0.000423 cm3 Porosity: 99.9578% V(tot) - V(min): 0.10017E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0052000 g log = -2.2840 Original solution: 1000.0103000 g Original solution / Rock added: 192309.67 (Water/Rock Ratio), log = 5.2840 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1307E-03 1.0071 0.1344E-03 0.1334E-03 CH4,gas 0.7859E-10 1.0125 0.8121E-10 0.8020E-10 H2,gas 0.8639E-05 1.0005 0.8821E-05 0.8816E-05 H2S,gas 0.4944E-06 0.9960 0.5025E-06 0.5045E-06 S2,gas 0.1194E-21 1.0000 0.1218E-21 0.1218E-21 CO,gas 0.3095E-12 1.0000 0.3158E-12 0.3158E-12 SO3,gas 0.2268E-34 1.0000 0.2314E-34 0.2314E-34 SO2,gas 0.7782E-17 1.0000 0.7941E-17 0.7941E-17 HCl,gas 0.2181E-14 1.0000 0.2225E-14 0.2225E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 -0.24265E-10 47 daphnite 28.97 28.97 0.00 0.000 -0.60662E-11 48 chlorite-Mn 46.87 46.87 0.00 0.000 -0.24265E-10 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.23 -5.57 -1.857 0.95118E+04 -3.872 3 CH4,gas 4.54 -7.25 -11.79 -2.947 0.20130E+05 -10.090 4 H2,gas 8.00 1.25 -6.75 -3.859 0.11531E+05 -5.055 5 H2S,gas -6.23 -14.23 -8.00 -3.999 0.13656E+05 -6.299 6 S2,gas -7.34 -30.95 -23.61 -3.633 0.40319E+05 -21.914 7 CO,gas 3.21 -10.98 -14.20 -4.369 0.24245E+05 -12.501 8 SO3,gas 17.12 -19.21 -36.33 -9.084 0.62040E+05 -34.636 9 SO2,gas 0.83 -17.97 -18.80 -5.013 0.32099E+05 -17.100 10 HCl,gas 5.19 -11.16 -16.35 -8.176 0.27920E+05 -14.653 21 andalusite 5.00 1.46 -3.54 -0.354 0.60491E+04 24 anhydrite -5.32 -9.38 -4.07 -2.033 0.69414E+04 35 aragonite 0.97 -2.40 -3.37 -1.122 0.57477E+04 36 brucite 12.57 8.95 -3.62 -0.725 0.61864E+04 37 calcite 0.81 -2.40 -3.21 -1.070 0.54835E+04 40 carpholite-Mg 8.58 6.12 -2.47 -0.164 0.42114E+04 41 carpholite-Fe 6.71 4.08 -2.64 -0.176 0.45012E+04 50 chloritoid-Mg 13.20 10.40 -2.79 -0.186 0.47698E+04 51 chloritoid-Fe 9.17 8.37 -0.81 -0.054 0.13806E+04 52 chloritoid-Mn 11.40 8.91 -2.50 -0.166 0.42607E+04 54 coesite -2.38 -4.29 -1.91 -0.638 0.32656E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.29 -1.73 -0.576 0.29509E+04 78 fayalite 14.05 9.52 -4.52 -0.646 0.77209E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.14 -4.00 -0.333 0.68264E+04 92 hercynite 17.28 12.65 -4.62 -0.308 0.78969E+04 98 kaolinite -1.33 -2.83 -1.50 -0.136 0.25561E+04 99 kyanite 4.88 1.46 -3.42 -0.342 0.58350E+04 101 laumontite 2.88 -1.58 -4.46 -0.297 0.76140E+04 102 lawsonite 9.62 7.00 -2.61 -0.174 0.44646E+04 105 lizardite 23.24 18.26 -4.98 -0.415 0.85113E+04 106 magnesite 0.69 -3.29 -3.98 -1.325 0.67889E+04 107 magnetite 20.09 19.47 -0.61 -0.050 0.10501E+04 110 magnesioferrite 26.21 21.51 -4.70 -0.384 0.80265E+04 113 margarite 17.32 12.75 -4.57 -0.183 0.78115E+04 121 paragonite 4.24 -0.76 -4.99 -0.294 0.85285E+04 128 periclase-Fe 11.63 6.91 -4.72 -1.180 0.80599E+04 142 pyrite -21.25 -22.80 -1.55 -0.365 0.26454E+04 143 pyrrhotite -4.26 -7.32 -3.06 -1.021 0.52275E+04 144 pyrrhotiteFe0.875 -6.02 -8.34 -2.32 -0.854 0.39660E+04 145 pyroxmangite 7.40 3.16 -4.24 -0.848 0.72402E+04 147 quartz -2.99 -4.29 -1.30 -0.433 0.22183E+04 151 rhodochrosite -0.98 -4.78 -3.81 -1.269 0.65013E+04 152 rhodonite 7.45 3.16 -4.29 -0.857 0.73205E+04 155 siderite -2.61 -5.32 -2.72 -0.905 0.46383E+04 156 sillimanite 5.26 1.46 -3.80 -0.380 0.64930E+04 168 sudoite 21.08 16.52 -4.56 -0.147 0.77818E+04 177 topaz-H 4.62 1.46 -3.16 -0.287 0.53951E+04 178 tridymite -2.63 -4.29 -1.66 -0.554 0.28382E+04 181 troilite-low -4.41 -7.32 -2.91 -0.970 0.49703E+04 189 wollastonite 10.46 5.54 -4.92 -0.984 0.83984E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.29 -1.49 -0.495 0.25376E+04 205 nontronite-Ca 3.21 -0.60 -3.82 -0.248 0.65174E+04 206 nontronite-H 2.53 -2.22 -4.76 -0.319 0.81229E+04 208 nontronite-Mg 3.07 -0.75 -3.82 -0.248 0.65280E+04 209 nontronite-Na 3.52 -1.07 -4.59 -0.295 0.78421E+04 214 gypsum -4.96 -9.38 -4.43 -1.107 0.75590E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.91 -2.91 -0.726 0.49608E+04 240 silica-amorphous -2.09 -4.29 -2.20 -0.732 0.37517E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0052000 g New total amount of reactant added: 0.0054000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0054000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2612386E-03 Osmotic coef. = 0.9902 True ionic strength = .2626498E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.52707E-07 -7.2781 0.50663E-07 -7.2953 0.96122E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13260E-03 -3.8775 0.96110E+00 -0.0172 4 SO4-- 0.25257E-04 -4.5976 0.22743E-04 -4.6432 0.90045E+00 -0.0455 5 HCO3- 0.11809E-04 -4.9278 0.11350E-04 -4.9450 0.96113E+00 -0.0172 6 HS- 0.97244E-07 -7.0121 0.93462E-07 -7.0294 0.96111E+00 -0.0172 7 Al+++ 0.12041E-18 -18.9193 0.97223E-19 -19.0122 0.80745E+00 -0.0929 8 H4SiO4 0.53106E-04 -4.2749 0.53106E-04 -4.2749 0.10000E+01 0.0000 9 Ca++ 0.20499E-04 -4.6883 0.18455E-04 -4.7339 0.90032E+00 -0.0456 10 Mg++ 0.24739E-05 -5.6066 0.22271E-05 -5.6523 0.90024E+00 -0.0456 11 Fe++ 0.22477E-07 -7.6483 0.20235E-07 -7.6939 0.90026E+00 -0.0456 12 K+ 0.11461E-05 -5.9408 0.11015E-05 -5.9580 0.96114E+00 -0.0172 13 Na+ 0.16684E-03 -3.7777 0.16035E-03 -3.7949 0.96110E+00 -0.0172 14 Mn++ 0.86460E-07 -7.0632 0.77838E-07 -7.1088 0.90028E+00 -0.0456 15 HPO4-- 0.14358E-07 -7.8429 0.12929E-07 -7.8884 0.90045E+00 -0.0455 16 HSiO3- 0.10184E-05 -5.9921 0.97877E-06 -6.0093 0.96110E+00 -0.0172 17 Ca(HSiO3)+ 0.42801E-09 -9.3686 0.41137E-09 -9.3858 0.96114E+00 -0.0172 18 Mg(HSiO3)+ 0.64278E-10 -10.1919 0.61781E-10 -10.2091 0.96114E+00 -0.0172 19 NaHSiO3,aq 0.25384E-08 -8.5954 0.25384E-08 -8.5954 0.10000E+01 0.0000 20 AlO+ 0.53614E-11 -11.2707 0.51530E-11 -11.2879 0.96114E+00 -0.0172 21 AlOH+2 0.14439E-14 -14.8405 0.13000E-14 -14.8861 0.90030E+00 -0.0456 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.92087E-06 -6.0358 0.88502E-06 -6.0530 0.96107E+00 -0.0172 24 CH4,aq 0.45310E-13 -13.3438 0.45307E-13 -13.3438 0.99992E+00 0.0000 29 CO,aq 0.19848E-15 -15.7023 0.19848E-15 -15.7023 0.10000E+01 0.0000 30 CO2,aq 0.12288E-05 -5.9105 0.12287E-05 -5.9106 0.99992E+00 0.0000 31 CO3-2 0.21732E-07 -7.6629 0.19567E-07 -7.7085 0.90041E+00 -0.0456 32 CaCO3,aq 0.45281E-08 -8.3441 0.45281E-08 -8.3441 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.55629E-08 -8.2547 0.53467E-08 -8.2719 0.96114E+00 -0.0172 34 CaCl+ 0.41203E-08 -8.3851 0.39602E-08 -8.4023 0.96114E+00 -0.0172 35 CaCl2,aq 0.12475E-12 -12.9039 0.12475E-12 -12.9039 0.10000E+01 0.0000 36 CaOH+ 0.27011E-07 -7.5685 0.25962E-07 -7.5857 0.96114E+00 -0.0172 37 CaSO4,aq 0.13328E-06 -6.8752 0.13328E-06 -6.8752 0.10000E+01 0.0000 38 HCl,aq 0.12310E-11 -11.9097 0.12310E-11 -11.9097 0.10000E+01 0.0000 43 FeCl+ 0.44187E-11 -11.3547 0.42470E-11 -11.3719 0.96114E+00 -0.0172 44 FeCl2,aq 0.17829E-19 -19.7489 0.17829E-19 -19.7489 0.10000E+01 0.0000 46 FeO,aq 0.30640E-09 -9.5137 0.30640E-09 -9.5137 0.10000E+01 0.0000 47 FeOH+ 0.13527E-07 -7.8688 0.13001E-07 -7.8860 0.96114E+00 -0.0172 48 HFeO2- 0.65840E-10 -10.1815 0.63279E-10 -10.1987 0.96110E+00 -0.0172 49 FeO+ 0.40234E-12 -12.3954 0.38671E-12 -12.4126 0.96114E+00 -0.0172 50 FeOH+2 0.41558E-17 -17.3813 0.37414E-17 -17.4270 0.90030E+00 -0.0456 51 FeO2- 0.32076E-10 -10.4938 0.30828E-10 -10.5111 0.96110E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.64312E-08 -8.1917 0.64307E-08 -8.1917 0.99992E+00 0.0000 54 KCl,aq 0.26472E-11 -11.5772 0.26472E-11 -11.5772 0.10000E+01 0.0000 55 KHSO4,aq 0.35886E-17 -17.4451 0.35886E-17 -17.4451 0.10000E+01 0.0000 56 KOH,aq 0.92853E-11 -11.0322 0.92853E-11 -11.0322 0.10000E+01 0.0000 57 KSO4- 0.40448E-09 -9.3931 0.38875E-09 -9.4103 0.96110E+00 -0.0172 58 MgCO3,aq 0.13697E-09 -9.8634 0.13697E-09 -9.8634 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.68595E-09 -9.1637 0.65929E-09 -9.1809 0.96114E+00 -0.0172 60 MgCl+ 0.45065E-09 -9.3462 0.43314E-09 -9.3634 0.96114E+00 -0.0172 61 MgOH+ 0.18037E-07 -7.7438 0.17336E-07 -7.7610 0.96114E+00 -0.0172 63 MnO,aq 0.31405E-10 -10.5030 0.31405E-10 -10.5030 0.10000E+01 0.0000 64 MnOH+ 0.48337E-08 -8.3157 0.46459E-08 -8.3329 0.96114E+00 -0.0172 65 MnO2-2 0.45097E-18 -18.3459 0.40606E-18 -18.3914 0.90041E+00 -0.0456 66 HMnO2- 0.46895E-14 -14.3289 0.45071E-14 -14.3461 0.96110E+00 -0.0172 69 MnCl+ 0.66126E-10 -10.1796 0.63557E-10 -10.1968 0.96114E+00 -0.0172 70 MnSO4,aq 0.51106E-09 -9.2915 0.51106E-09 -9.2915 0.10000E+01 0.0000 71 NaCl,aq 0.70462E-08 -8.1520 0.70462E-08 -8.1520 0.10000E+01 0.0000 72 NaOH,aq 0.13598E-08 -8.8665 0.13598E-08 -8.8665 0.10000E+01 0.0000 74 OH- 0.11866E-04 -4.9257 0.11404E-04 -4.9429 0.96107E+00 -0.0172 79 HPO3-2 0.28775E-18 -18.5410 0.25909E-18 -18.5865 0.90041E+00 -0.0456 81 H2PO3- 0.27388E-19 -19.5624 0.26323E-19 -19.5797 0.96110E+00 -0.0172 82 H3PO4,aq 0.23209E-12 -12.6343 0.23209E-12 -12.6343 0.10000E+01 0.0000 83 H2PO4- 0.12572E-07 -7.9006 0.12083E-07 -7.9178 0.96112E+00 -0.0172 84 PO4-3 0.25761E-12 -12.5890 0.20821E-12 -12.6815 0.80823E+00 -0.0925 87 H2P2O7-2 0.12714E-16 -16.8957 0.11448E-16 -16.9413 0.90041E+00 -0.0456 88 HP2O7-3 0.55878E-16 -16.2528 0.45119E-16 -16.3456 0.80746E+00 -0.0929 89 P2O7-4 0.30673E-18 -18.5132 0.21276E-18 -18.6721 0.69364E+00 -0.1589 90 H2S,aq 0.14636E-07 -7.8346 0.14634E-07 -7.8346 0.99992E+00 0.0000 91 S2-2 0.33428E-16 -16.4759 0.30099E-16 -16.5215 0.90041E+00 -0.0456 96 SO2,aq 0.16765E-17 -17.7756 0.16765E-17 -17.7756 0.10000E+01 0.0000 97 SO3-2 0.21102E-13 -13.6757 0.19006E-13 -13.7211 0.90067E+00 -0.0454 98 HSO3- 0.62728E-13 -13.2025 0.60288E-13 -13.2198 0.96110E+00 -0.0172 99 HSO4- 0.11553E-08 -8.9373 0.11104E-08 -8.9545 0.96116E+00 -0.0172 101 S2O3-2 0.43421E-14 -14.3623 0.39097E-14 -14.4079 0.90041E+00 -0.0456 102 HS2O3- 0.36850E-19 -19.4336 0.35416E-19 -19.4508 0.96110E+00 -0.0172 Charge balance for all species = 0.9763E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5270715E-07 -.1541615E-04 -.1553830E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999819E+06 0.0000 3 Cl- 0.1379628E-03 0.1379745E-03 0.4891530E+01 3.4178 4 SO4-- 0.2525729E-04 0.2539106E-04 0.2439067E+01 9.9475 5 HCO3- 0.1180863E-04 0.1307003E-04 0.7974836E+00 2.3503 6 HS- 0.9724447E-07 0.1134590E-06 0.3752256E-02 0.2659 7 Al+++ 0.1204074E-18 0.9411305E-06 0.2539270E-01 2.8737 8 H4SiO4 0.5310597E-04 0.5412738E-04 0.5202391E+01 -4.2749 9 Ca++ 0.2049856E-04 0.2067350E-04 0.8285391E+00 9.8567 10 Mg++ 0.2473879E-05 0.2493254E-05 0.6061502E-01 8.9384 11 Fe++ 0.2247712E-07 0.3661177E-07 0.2044624E-02 6.8967 12 K+ 0.1146083E-05 0.1146499E-05 0.4482969E-01 1.3373 13 Na+ 0.1668387E-03 0.1668497E-03 0.3835779E+01 3.5004 14 Mn++ 0.8646011E-07 0.9190241E-07 0.5048853E-02 7.4818 15 HPO4-- 0.1435797E-07 0.2693032E-07 0.2584704E-02 6.7022 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7637598E-04 -.1541611E-04 -.6095987E-04 0.0000000E+00 2 H2O 0.5550818E+02 0.5550815E+02 0.3684149E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2565412E-04 0.2539101E-04 0.2631112E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1496524E-06 0.1134588E-06 -.2631112E-06 0.0000000E+00 7 Al+++ 0.1760800E-04 0.9411285E-06 0.1666688E-04 0.0000000E+00 8 H4SiO4 0.5622903E-04 0.5412727E-04 0.2101762E-05 0.0000000E+00 9 Ca++ 0.2068183E-04 0.2067346E-04 0.8374413E-08 0.0000000E+00 10 Mg++ 0.4285714E-05 0.2493249E-05 0.1792465E-05 0.0000000E+00 11 Fe++ 0.3850246E-05 0.3661169E-07 0.3813635E-05 0.0000000E+00 12 K+ 0.1146497E-05 0.1146497E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1668493E-03 0.1668493E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.9362842E-07 0.9190222E-07 0.1726203E-08 0.0000000E+00 15 HPO4-- 0.3195491E-07 0.2693027E-07 0.5024648E-08 0.0000000E+00 Chg. balance for solid moles: -.8851E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0054000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.1675E-08 -8.776 0.8413E-06 -6.075 0.5506E-01 0.2673E-06 clinochlore 0.3585E-06 -6.446 0.1993E-03 -3.701 13.04 0.7579E-04 daphnite 0.3417E-06 -6.466 0.2438E-03 -3.613 15.96 0.7389E-04 chlorite-Mn 0.3452E-09 -9.462 0.2448E-06 -6.611 0.1602E-01 0.7800E-07 diaspore 0.1527E-04 -4.816 0.9158E-03 -3.038 59.93 0.2726E-03 hematite 0.1052E-05 -5.978 0.1681E-03 -3.774 11.00 0.3186E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5117E+00 0.5117E+00 1.0000 -0.291 daphnite 0.4878E+00 0.4878E+00 1.0000 -0.312 chlorite-Mn 0.4928E-03 0.4928E-03 1.0000 -3.307 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001528 g Volume = 0.000455 cm3 Porosity: 99.9546% V(tot) - V(min): 0.10017E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0054000 g log = -2.2676 Original solution: 1000.0103000 g Original solution / Rock added: 185187.09 (Water/Rock Ratio), log = 5.2676 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1279E-03 1.0071 0.1315E-03 0.1305E-03 CH4,gas 0.6454E-10 1.0125 0.6669E-10 0.6586E-10 H2,gas 0.8269E-05 1.0005 0.8443E-05 0.8438E-05 H2S,gas 0.3958E-06 0.9960 0.4023E-06 0.4039E-06 S2,gas 0.8352E-22 1.0000 0.8522E-22 0.8522E-22 CO,gas 0.2899E-12 1.0000 0.2958E-12 0.2958E-12 SO3,gas 0.2163E-34 1.0000 0.2207E-34 0.2207E-34 SO2,gas 0.7105E-17 1.0000 0.7250E-17 0.7250E-17 HCl,gas 0.2129E-14 1.0000 0.2172E-14 0.2172E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.00000E+00 47 daphnite 28.97 28.97 0.00 0.000 0.12132E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.00000E+00 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.24 -5.58 -1.860 0.95280E+04 -3.881 3 CH4,gas 4.54 -7.33 -11.87 -2.969 0.20276E+05 -10.176 4 H2,gas 8.00 1.23 -6.77 -3.870 0.11564E+05 -5.074 5 H2S,gas -6.23 -14.32 -8.09 -4.047 0.13821E+05 -6.395 6 S2,gas -7.34 -31.10 -23.77 -3.657 0.40584E+05 -22.069 7 CO,gas 3.21 -11.01 -14.23 -4.378 0.24294E+05 -12.529 8 SO3,gas 17.12 -19.23 -36.36 -9.089 0.62075E+05 -34.656 9 SO2,gas 0.83 -18.01 -18.84 -5.024 0.32166E+05 -17.140 10 HCl,gas 5.19 -11.17 -16.36 -8.181 0.27938E+05 -14.663 21 andalusite 5.00 1.47 -3.53 -0.353 0.60256E+04 24 anhydrite -5.32 -9.38 -4.06 -2.030 0.69327E+04 35 aragonite 0.97 -2.38 -3.35 -1.117 0.57202E+04 36 brucite 12.57 8.94 -3.63 -0.726 0.61985E+04 37 calcite 0.81 -2.38 -3.20 -1.065 0.54560E+04 40 carpholite-Mg 8.58 6.14 -2.45 -0.163 0.41766E+04 41 carpholite-Fe 6.71 4.09 -2.62 -0.175 0.44706E+04 50 chloritoid-Mg 13.20 10.41 -2.79 -0.186 0.47584E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.054 0.13734E+04 52 chloritoid-Mn 11.40 8.95 -2.45 -0.163 0.41777E+04 54 coesite -2.38 -4.27 -1.90 -0.633 0.32421E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.27 -1.71 -0.572 0.29275E+04 78 fayalite 14.05 9.52 -4.53 -0.647 0.77300E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.14 -4.00 -0.333 0.68282E+04 92 hercynite 17.28 12.64 -4.63 -0.309 0.79131E+04 98 kaolinite -1.33 -2.80 -1.47 -0.134 0.25092E+04 99 kyanite 4.88 1.47 -3.40 -0.340 0.58116E+04 101 laumontite 2.88 -1.50 -4.38 -0.292 0.74765E+04 102 lawsonite 9.62 7.05 -2.56 -0.171 0.43740E+04 105 lizardite 23.24 18.27 -4.98 -0.415 0.85006E+04 106 magnesite 0.69 -3.30 -3.99 -1.331 0.68172E+04 107 magnetite 20.09 19.46 -0.62 -0.051 0.10663E+04 110 magnesioferrite 26.21 21.50 -4.71 -0.384 0.80385E+04 113 margarite 17.32 12.80 -4.52 -0.181 0.77208E+04 121 paragonite 4.24 -0.70 -4.94 -0.291 0.84392E+04 128 periclase-Fe 11.63 6.90 -4.73 -1.182 0.80761E+04 142 pyrite -21.25 -22.98 -1.73 -0.408 0.29590E+04 143 pyrrhotite -4.26 -7.43 -3.17 -1.056 0.54086E+04 144 pyrrhotiteFe0.875 -6.02 -8.44 -2.43 -0.892 0.41411E+04 145 pyroxmangite 7.40 3.21 -4.19 -0.838 0.71573E+04 147 quartz -2.99 -4.27 -1.29 -0.428 0.21948E+04 151 rhodochrosite -0.98 -4.76 -3.78 -1.261 0.64580E+04 152 rhodonite 7.45 3.21 -4.24 -0.848 0.72375E+04 155 siderite -2.61 -5.34 -2.74 -0.912 0.46707E+04 156 sillimanite 5.26 1.47 -3.79 -0.379 0.64696E+04 168 sudoite 21.08 16.55 -4.53 -0.146 0.77356E+04 177 topaz-H 4.62 1.47 -3.15 -0.286 0.53716E+04 178 tridymite -2.63 -4.27 -1.65 -0.550 0.28148E+04 181 troilite-low -4.41 -7.43 -3.02 -1.006 0.51514E+04 189 wollastonite 10.46 5.58 -4.88 -0.976 0.83312E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.27 -1.47 -0.491 0.25141E+04 205 nontronite-Ca 3.21 -0.55 -3.76 -0.244 0.64242E+04 206 nontronite-H 2.53 -2.17 -4.71 -0.315 0.80369E+04 208 nontronite-Mg 3.07 -0.70 -3.77 -0.245 0.64440E+04 209 nontronite-Na 3.52 -1.02 -4.54 -0.291 0.77499E+04 214 gypsum -4.96 -9.38 -4.42 -1.105 0.75503E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.90 -2.91 -0.729 0.49770E+04 240 silica-amorphous -2.09 -4.27 -2.18 -0.728 0.37283E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0054000 g New total amount of reactant added: 0.0056000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0056000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2616654E-03 Osmotic coef. = 0.9902 True ionic strength = .2631737E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.51398E-07 -7.2891 0.49404E-07 -7.3062 0.96120E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13259E-03 -3.8775 0.96108E+00 -0.0172 4 SO4-- 0.25278E-04 -4.5973 0.22759E-04 -4.6428 0.90038E+00 -0.0456 5 HCO3- 0.11836E-04 -4.9268 0.11375E-04 -4.9440 0.96111E+00 -0.0172 6 HS- 0.78362E-07 -7.1059 0.75313E-07 -7.1231 0.96109E+00 -0.0172 7 Al+++ 0.11167E-18 -18.9521 0.90151E-19 -19.0450 0.80730E+00 -0.0930 8 H4SiO4 0.54775E-04 -4.2614 0.54775E-04 -4.2614 0.10000E+01 0.0000 9 Ca++ 0.20721E-04 -4.6836 0.18654E-04 -4.7292 0.90025E+00 -0.0456 10 Mg++ 0.23209E-05 -5.6344 0.20892E-05 -5.6800 0.90017E+00 -0.0457 11 Fe++ 0.20870E-07 -7.6805 0.18787E-07 -7.7262 0.90019E+00 -0.0457 12 K+ 0.11885E-05 -5.9250 0.11423E-05 -5.9422 0.96112E+00 -0.0172 13 Na+ 0.16709E-03 -3.7771 0.16059E-03 -3.7943 0.96108E+00 -0.0172 14 Mn++ 0.89130E-07 -7.0500 0.80235E-07 -7.0956 0.90020E+00 -0.0457 15 HPO4-- 0.13640E-07 -7.8652 0.12281E-07 -7.9108 0.90038E+00 -0.0456 16 HSiO3- 0.10772E-05 -5.9677 0.10353E-05 -5.9849 0.96108E+00 -0.0172 17 Ca(HSiO3)+ 0.45760E-09 -9.3395 0.43981E-09 -9.3567 0.96112E+00 -0.0172 18 Mg(HSiO3)+ 0.63780E-10 -10.1953 0.61300E-10 -10.2125 0.96112E+00 -0.0172 19 NaHSiO3,aq 0.26889E-08 -8.5704 0.26889E-08 -8.5704 0.10000E+01 0.0000 20 AlO+ 0.52282E-11 -11.2816 0.50249E-11 -11.2989 0.96112E+00 -0.0172 21 AlOH+2 0.13731E-14 -14.8623 0.12361E-14 -14.9079 0.90022E+00 -0.0457 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.94437E-06 -6.0249 0.90758E-06 -6.0421 0.96105E+00 -0.0173 24 CH4,aq 0.36568E-13 -13.4369 0.36565E-13 -13.4369 0.99992E+00 0.0000 29 CO,aq 0.18492E-15 -15.7330 0.18492E-15 -15.7330 0.10000E+01 0.0000 30 CO2,aq 0.12009E-05 -5.9205 0.12008E-05 -5.9205 0.99992E+00 0.0000 31 CO3-2 0.22338E-07 -7.6510 0.20112E-07 -7.6965 0.90034E+00 -0.0456 32 CaCO3,aq 0.47042E-08 -8.3275 0.47042E-08 -8.3275 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.56357E-08 -8.2491 0.54165E-08 -8.2663 0.96112E+00 -0.0172 34 CaCl+ 0.41647E-08 -8.3804 0.40028E-08 -8.3976 0.96112E+00 -0.0172 35 CaCl2,aq 0.12609E-12 -12.8993 0.12609E-12 -12.8993 0.10000E+01 0.0000 36 CaOH+ 0.27999E-07 -7.5529 0.26910E-07 -7.5701 0.96112E+00 -0.0172 37 CaSO4,aq 0.13482E-06 -6.8703 0.13482E-06 -6.8703 0.10000E+01 0.0000 38 HCl,aq 0.12004E-11 -11.9207 0.12004E-11 -11.9207 0.10000E+01 0.0000 43 FeCl+ 0.41023E-11 -11.3870 0.39428E-11 -11.4042 0.96112E+00 -0.0172 44 FeCl2,aq 0.16552E-19 -19.7812 0.16552E-19 -19.7812 0.10000E+01 0.0000 46 FeO,aq 0.29916E-09 -9.5241 0.29916E-09 -9.5241 0.10000E+01 0.0000 47 FeOH+ 0.12879E-07 -7.8901 0.12378E-07 -7.9073 0.96112E+00 -0.0172 48 HFeO2- 0.65924E-10 -10.1810 0.63358E-10 -10.1982 0.96108E+00 -0.0172 49 FeO+ 0.39235E-12 -12.4063 0.37709E-12 -12.4236 0.96112E+00 -0.0172 50 FeOH+2 0.39521E-17 -17.4032 0.35577E-17 -17.4488 0.90022E+00 -0.0457 51 FeO2- 0.32894E-10 -10.4829 0.31614E-10 -10.5001 0.96108E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.61306E-08 -8.2125 0.61301E-08 -8.2125 0.99992E+00 0.0000 54 KCl,aq 0.27452E-11 -11.5614 0.27452E-11 -11.5614 0.10000E+01 0.0000 55 KHSO4,aq 0.36315E-17 -17.4399 0.36315E-17 -17.4399 0.10000E+01 0.0000 56 KOH,aq 0.98745E-11 -11.0055 0.98745E-11 -11.0055 0.10000E+01 0.0000 57 KSO4- 0.41977E-09 -9.3770 0.40343E-09 -9.3942 0.96108E+00 -0.0172 58 MgCO3,aq 0.13206E-09 -9.8792 0.13206E-09 -9.8792 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.64493E-09 -9.1905 0.61986E-09 -9.2077 0.96112E+00 -0.0172 60 MgCl+ 0.42274E-09 -9.3739 0.40630E-09 -9.3911 0.96112E+00 -0.0172 61 MgOH+ 0.17352E-07 -7.7607 0.16677E-07 -7.7779 0.96112E+00 -0.0172 63 MnO,aq 0.34044E-10 -10.4680 0.34044E-10 -10.4680 0.10000E+01 0.0000 64 MnOH+ 0.51097E-08 -8.2916 0.49110E-08 -8.3088 0.96112E+00 -0.0172 65 MnO2-2 0.51415E-18 -18.2889 0.46291E-18 -18.3345 0.90034E+00 -0.0456 66 HMnO2- 0.52132E-14 -14.2829 0.50103E-14 -14.3001 0.96108E+00 -0.0172 69 MnCl+ 0.68162E-10 -10.1665 0.65512E-10 -10.1837 0.96112E+00 -0.0172 70 MnSO4,aq 0.52718E-09 -9.2780 0.52718E-09 -9.2780 0.10000E+01 0.0000 71 NaCl,aq 0.70565E-08 -8.1514 0.70565E-08 -8.1514 0.10000E+01 0.0000 72 NaOH,aq 0.13966E-08 -8.8549 0.13966E-08 -8.8549 0.10000E+01 0.0000 74 OH- 0.12169E-04 -4.9147 0.11695E-04 -4.9320 0.96105E+00 -0.0173 79 HPO3-2 0.26058E-18 -18.5841 0.23461E-18 -18.6297 0.90034E+00 -0.0456 81 H2PO3- 0.24183E-19 -19.6165 0.23242E-19 -19.6337 0.96108E+00 -0.0172 82 H3PO4,aq 0.20963E-12 -12.6785 0.20963E-12 -12.6785 0.10000E+01 0.0000 83 H2PO4- 0.11645E-07 -7.9339 0.11192E-07 -7.9511 0.96110E+00 -0.0172 84 PO4-3 0.25098E-12 -12.6004 0.20281E-12 -12.6929 0.80808E+00 -0.0925 87 H2P2O7-2 0.10909E-16 -16.9622 0.98220E-17 -17.0078 0.90034E+00 -0.0456 88 HP2O7-3 0.49174E-16 -16.3083 0.39698E-16 -16.4012 0.80730E+00 -0.0930 89 P2O7-4 0.27685E-18 -18.5578 0.19196E-18 -18.7168 0.69340E+00 -0.1590 90 H2S,aq 0.11500E-07 -7.9393 0.11499E-07 -7.9393 0.99992E+00 0.0000 91 S2-2 0.22772E-16 -16.6426 0.20502E-16 -16.6882 0.90034E+00 -0.0456 96 SO2,aq 0.15208E-17 -17.8179 0.15208E-17 -17.8179 0.10000E+01 0.0000 97 SO3-2 0.20132E-13 -13.6961 0.18130E-13 -13.7416 0.90059E+00 -0.0455 98 HSO3- 0.58353E-13 -13.2339 0.56082E-13 -13.2512 0.96108E+00 -0.0172 99 HSO4- 0.11274E-08 -8.9479 0.10836E-08 -8.9651 0.96114E+00 -0.0172 101 S2O3-2 0.34147E-14 -14.4666 0.30744E-14 -14.5122 0.90034E+00 -0.0456 102 HS2O3- 0.28257E-19 -19.5489 0.27157E-19 -19.5661 0.96108E+00 -0.0172 Charge balance for all species = 0.9763E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5139786E-07 -.1590582E-04 -.1603185E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999817E+06 0.0000 3 Cl- 0.1379628E-03 0.1379745E-03 0.4891529E+01 3.4288 4 SO4-- 0.2527777E-04 0.2541316E-04 0.2441189E+01 9.9696 5 HCO3- 0.1183565E-04 0.1307003E-04 0.7974835E+00 2.3622 6 HS- 0.7836218E-07 0.9136617E-07 0.3021613E-02 0.1831 7 Al+++ 0.1116697E-18 0.9646282E-06 0.2602669E-01 2.8737 8 H4SiO4 0.5477537E-04 0.5585577E-04 0.5368513E+01 -4.2614 9 Ca++ 0.2072104E-04 0.2089882E-04 0.8375691E+00 9.8833 10 Mg++ 0.2320854E-05 0.2339469E-05 0.5687624E-01 8.9325 11 Fe++ 0.2086972E-07 0.3434975E-07 0.1918299E-02 6.8863 12 K+ 0.1188530E-05 0.1188962E-05 0.4649004E-01 1.3640 13 Na+ 0.1670896E-03 0.1671007E-03 0.3841550E+01 3.5120 14 Mn++ 0.8912974E-07 0.9486880E-07 0.5211817E-02 7.5168 15 HPO4-- 0.1363953E-07 0.2528515E-07 0.2426804E-02 6.7017 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.7968769E-04 -.1590578E-04 -.6378190E-04 0.0000000E+00 2 H2O 0.5550818E+02 0.5550814E+02 0.3820345E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2565967E-04 0.2541310E-04 0.2465611E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1551951E-06 0.9136598E-07 -.2465611E-06 0.0000000E+00 7 Al+++ 0.1826015E-04 0.9646261E-06 0.1729553E-04 0.0000000E+00 8 H4SiO4 0.5831158E-04 0.5585565E-04 0.2455931E-05 0.0000000E+00 9 Ca++ 0.2091186E-04 0.2089877E-04 0.1308889E-07 0.0000000E+00 10 Mg++ 0.4444444E-05 0.2339464E-05 0.2104981E-05 0.0000000E+00 11 Fe++ 0.3992848E-05 0.3434967E-07 0.3958498E-05 0.0000000E+00 12 K+ 0.1188960E-05 0.1188960E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1671004E-03 0.1671004E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.9709614E-07 0.9486859E-07 0.2227546E-08 0.0000000E+00 15 HPO4-- 0.3313843E-07 0.2528510E-07 0.7853334E-08 0.0000000E+00 Chg. balance for solid moles: 0.9615E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0056000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.2618E-08 -8.582 0.1315E-05 -5.881 0.8138E-01 0.4178E-06 clinochlore 0.4210E-06 -6.376 0.2340E-03 -3.631 14.48 0.8901E-04 daphnite 0.3972E-06 -6.401 0.2834E-03 -3.548 17.54 0.8588E-04 chlorite-Mn 0.4455E-09 -9.351 0.3159E-06 -6.501 0.1955E-01 0.1007E-06 diaspore 0.1566E-04 -4.805 0.9393E-03 -3.027 58.13 0.2796E-03 hematite 0.9862E-06 -6.006 0.1575E-03 -3.803 9.747 0.2985E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5143E+00 0.5143E+00 1.0000 -0.289 daphnite 0.4852E+00 0.4852E+00 1.0000 -0.314 chlorite-Mn 0.5442E-03 0.5442E-03 1.0000 -3.264 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001616 g Volume = 0.000485 cm3 Porosity: 99.9516% V(tot) - V(min): 0.10018E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0056000 g log = -2.2518 Original solution: 1000.0103000 g Original solution / Rock added: 178573.27 (Water/Rock Ratio), log = 5.2518 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1250E-03 1.0071 0.1285E-03 0.1276E-03 CH4,gas 0.5209E-10 1.0125 0.5382E-10 0.5316E-10 H2,gas 0.7883E-05 1.0005 0.8048E-05 0.8044E-05 H2S,gas 0.3110E-06 0.9960 0.3161E-06 0.3174E-06 S2,gas 0.5675E-22 1.0000 0.5791E-22 0.5791E-22 CO,gas 0.2700E-12 1.0000 0.2756E-12 0.2756E-12 SO3,gas 0.2058E-34 1.0000 0.2100E-34 0.2100E-34 SO2,gas 0.6445E-17 1.0000 0.6576E-17 0.6576E-17 HCl,gas 0.2076E-14 1.0000 0.2118E-14 0.2118E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.24265E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 -0.36397E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.25 -5.59 -1.863 0.95450E+04 -3.891 3 CH4,gas 4.54 -7.42 -11.97 -2.992 0.20435E+05 -10.269 4 H2,gas 8.00 1.21 -6.79 -3.882 0.11599E+05 -5.094 5 H2S,gas -6.23 -14.43 -8.20 -4.100 0.14000E+05 -6.500 6 S2,gas -7.34 -31.27 -23.94 -3.682 0.40870E+05 -22.237 7 CO,gas 3.21 -11.04 -14.26 -4.387 0.24346E+05 -12.560 8 SO3,gas 17.12 -19.26 -36.38 -9.094 0.62112E+05 -34.678 9 SO2,gas 0.83 -18.05 -18.88 -5.035 0.32239E+05 -17.182 10 HCl,gas 5.19 -11.18 -16.37 -8.187 0.27957E+05 -14.674 21 andalusite 5.00 1.49 -3.52 -0.352 0.60027E+04 24 anhydrite -5.32 -9.37 -4.06 -2.028 0.69242E+04 35 aragonite 0.97 -2.37 -3.33 -1.111 0.56919E+04 36 brucite 12.57 8.93 -3.64 -0.727 0.62086E+04 37 calcite 0.81 -2.37 -3.18 -1.060 0.54277E+04 40 carpholite-Mg 8.58 6.16 -2.43 -0.162 0.41407E+04 41 carpholite-Fe 6.71 4.11 -2.60 -0.173 0.44424E+04 50 chloritoid-Mg 13.20 10.42 -2.78 -0.185 0.47455E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13682E+04 52 chloritoid-Mn 11.40 9.00 -2.40 -0.160 0.40949E+04 54 coesite -2.38 -4.26 -1.89 -0.628 0.32192E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.26 -1.70 -0.567 0.29045E+04 78 fayalite 14.05 9.51 -4.53 -0.648 0.77425E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.14 -4.00 -0.334 0.68356E+04 92 hercynite 17.28 12.63 -4.64 -0.310 0.79309E+04 98 kaolinite -1.33 -2.78 -1.44 -0.131 0.24633E+04 99 kyanite 4.88 1.49 -3.39 -0.339 0.57886E+04 101 laumontite 2.88 -1.42 -4.30 -0.287 0.73394E+04 102 lawsonite 9.62 7.11 -2.51 -0.167 0.42828E+04 105 lizardite 23.24 18.27 -4.97 -0.414 0.84850E+04 106 magnesite 0.69 -3.32 -4.01 -1.336 0.68443E+04 107 magnetite 20.09 19.45 -0.63 -0.052 0.10840E+04 110 magnesioferrite 26.21 21.50 -4.71 -0.385 0.80486E+04 113 margarite 17.32 12.86 -4.47 -0.179 0.76297E+04 121 paragonite 4.24 -0.65 -4.89 -0.288 0.83506E+04 128 periclase-Fe 11.63 6.89 -4.74 -1.185 0.80938E+04 142 pyrite -21.25 -23.18 -1.93 -0.455 0.32988E+04 143 pyrrhotite -4.26 -7.54 -3.28 -1.094 0.56052E+04 144 pyrrhotiteFe0.875 -6.02 -8.55 -2.54 -0.933 0.43310E+04 145 pyroxmangite 7.40 3.26 -4.14 -0.829 0.70745E+04 147 quartz -2.99 -4.26 -1.27 -0.424 0.21719E+04 151 rhodochrosite -0.98 -4.73 -3.76 -1.252 0.64152E+04 152 rhodonite 7.45 3.26 -4.19 -0.838 0.71547E+04 155 siderite -2.61 -5.36 -2.76 -0.919 0.47054E+04 156 sillimanite 5.26 1.49 -3.78 -0.378 0.64466E+04 168 sudoite 21.08 16.58 -4.50 -0.145 0.76869E+04 177 topaz-H 4.62 1.49 -3.13 -0.285 0.53487E+04 178 tridymite -2.63 -4.26 -1.64 -0.545 0.27918E+04 181 troilite-low -4.41 -7.54 -3.13 -1.044 0.53480E+04 189 wollastonite 10.46 5.62 -4.84 -0.968 0.82630E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.26 -1.46 -0.486 0.24912E+04 205 nontronite-Ca 3.21 -0.49 -3.71 -0.241 0.63325E+04 206 nontronite-H 2.53 -2.12 -4.66 -0.312 0.79527E+04 208 nontronite-Mg 3.07 -0.65 -3.73 -0.242 0.63615E+04 209 nontronite-Na 3.52 -0.97 -4.49 -0.288 0.76591E+04 214 gypsum -4.96 -9.37 -4.42 -1.104 0.75418E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.89 -2.93 -0.731 0.49948E+04 240 silica-amorphous -2.09 -4.26 -2.17 -0.723 0.37053E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0056000 g New total amount of reactant added: 0.0058000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0058000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2621160E-03 Osmotic coef. = 0.9902 True ionic strength = .2637267E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.50075E-07 -7.3004 0.48131E-07 -7.3176 0.96118E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13259E-03 -3.8775 0.96106E+00 -0.0172 4 SO4-- 0.25295E-04 -4.5970 0.22773E-04 -4.6426 0.90029E+00 -0.0456 5 HCO3- 0.11863E-04 -4.9258 0.11401E-04 -4.9430 0.96109E+00 -0.0172 6 HS- 0.62140E-07 -7.2066 0.59721E-07 -7.2239 0.96107E+00 -0.0172 7 Al+++ 0.10328E-18 -18.9860 0.83360E-19 -19.0790 0.80713E+00 -0.0931 8 H4SiO4 0.56463E-04 -4.2482 0.56463E-04 -4.2482 0.10000E+01 0.0000 9 Ca++ 0.20944E-04 -4.6789 0.18853E-04 -4.7246 0.90017E+00 -0.0457 10 Mg++ 0.21785E-05 -5.6618 0.19608E-05 -5.7076 0.90009E+00 -0.0457 11 Fe++ 0.19305E-07 -7.7143 0.17377E-07 -7.7600 0.90011E+00 -0.0457 12 K+ 0.12310E-05 -5.9098 0.11831E-05 -5.9270 0.96109E+00 -0.0172 13 Na+ 0.16734E-03 -3.7764 0.16082E-03 -3.7936 0.96106E+00 -0.0172 14 Mn++ 0.91725E-07 -7.0375 0.82563E-07 -7.0832 0.90012E+00 -0.0457 15 HPO4-- 0.12944E-07 -7.8879 0.11653E-07 -7.9336 0.90030E+00 -0.0456 16 HSiO3- 0.11398E-05 -5.9432 0.10954E-05 -5.9604 0.96106E+00 -0.0172 17 Ca(HSiO3)+ 0.48934E-09 -9.3104 0.47030E-09 -9.3276 0.96110E+00 -0.0172 18 Mg(HSiO3)+ 0.63339E-10 -10.1983 0.60875E-10 -10.2156 0.96110E+00 -0.0172 19 NaHSiO3,aq 0.28492E-08 -8.5453 0.28492E-08 -8.5453 0.10000E+01 0.0000 20 AlO+ 0.50936E-11 -11.2930 0.48955E-11 -11.3102 0.96110E+00 -0.0172 21 AlOH+2 0.13034E-14 -14.8849 0.11733E-14 -14.9306 0.90014E+00 -0.0457 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.96936E-06 -6.0135 0.93159E-06 -6.0308 0.96103E+00 -0.0173 24 CH4,aq 0.29046E-13 -13.5369 0.29044E-13 -13.5369 0.99992E+00 0.0000 29 CO,aq 0.17148E-15 -15.7658 0.17148E-15 -15.7658 0.10000E+01 0.0000 30 CO2,aq 0.11727E-05 -5.9308 0.11726E-05 -5.9309 0.99992E+00 0.0000 31 CO3-2 0.22983E-07 -7.6386 0.20691E-07 -7.6842 0.90026E+00 -0.0456 32 CaCO3,aq 0.48912E-08 -8.3106 0.48912E-08 -8.3106 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.57089E-08 -8.2435 0.54868E-08 -8.2607 0.96110E+00 -0.0172 34 CaCl+ 0.42090E-08 -8.3758 0.40453E-08 -8.3930 0.96110E+00 -0.0172 35 CaCl2,aq 0.12743E-12 -12.8947 0.12743E-12 -12.8947 0.10000E+01 0.0000 36 CaOH+ 0.29046E-07 -7.5369 0.27916E-07 -7.5541 0.96110E+00 -0.0172 37 CaSO4,aq 0.13633E-06 -6.8654 0.13633E-06 -6.8654 0.10000E+01 0.0000 38 HCl,aq 0.11694E-11 -11.9320 0.11694E-11 -11.9320 0.10000E+01 0.0000 43 FeCl+ 0.37945E-11 -11.4209 0.36468E-11 -11.4381 0.96110E+00 -0.0172 44 FeCl2,aq 0.15309E-19 -19.8151 0.15309E-19 -19.8151 0.10000E+01 0.0000 46 FeO,aq 0.29154E-09 -9.5353 0.29154E-09 -9.5353 0.10000E+01 0.0000 47 FeOH+ 0.12228E-07 -7.9127 0.11752E-07 -7.9299 0.96110E+00 -0.0172 48 HFeO2- 0.65945E-10 -10.1808 0.63377E-10 -10.1981 0.96106E+00 -0.0172 49 FeO+ 0.38225E-12 -12.4177 0.36738E-12 -12.4349 0.96110E+00 -0.0172 50 FeOH+2 0.37514E-17 -17.4258 0.33767E-17 -17.4715 0.90014E+00 -0.0457 51 FeO2- 0.33765E-10 -10.4715 0.32450E-10 -10.4888 0.96106E+00 -0.0172 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.58222E-08 -8.2349 0.58218E-08 -8.2349 0.99992E+00 0.0000 54 KCl,aq 0.28431E-11 -11.5462 0.28431E-11 -11.5462 0.10000E+01 0.0000 55 KHSO4,aq 0.36664E-17 -17.4358 0.36664E-17 -17.4358 0.10000E+01 0.0000 56 KOH,aq 0.10497E-10 -10.9789 0.10497E-10 -10.9789 0.10000E+01 0.0000 57 KSO4- 0.43502E-09 -9.3615 0.41808E-09 -9.3787 0.96106E+00 -0.0172 58 MgCO3,aq 0.12751E-09 -9.8944 0.12751E-09 -9.8944 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.60672E-09 -9.2170 0.58311E-09 -9.2342 0.96110E+00 -0.0172 60 MgCl+ 0.39677E-09 -9.4015 0.38134E-09 -9.4187 0.96110E+00 -0.0172 61 MgOH+ 0.16717E-07 -7.7768 0.16066E-07 -7.7941 0.96110E+00 -0.0172 63 MnO,aq 0.36909E-10 -10.4329 0.36909E-10 -10.4329 0.10000E+01 0.0000 64 MnOH+ 0.53971E-08 -8.2678 0.51872E-08 -8.2851 0.96110E+00 -0.0172 65 MnO2-2 0.58735E-18 -18.2311 0.52877E-18 -18.2767 0.90026E+00 -0.0456 66 HMnO2- 0.58016E-14 -14.2365 0.55757E-14 -14.2537 0.96106E+00 -0.0172 69 MnCl+ 0.70140E-10 -10.1540 0.67412E-10 -10.1713 0.96110E+00 -0.0172 70 MnSO4,aq 0.54280E-09 -9.2654 0.54280E-09 -9.2654 0.10000E+01 0.0000 71 NaCl,aq 0.70668E-08 -8.1508 0.70668E-08 -8.1508 0.10000E+01 0.0000 72 NaOH,aq 0.14356E-08 -8.8430 0.14356E-08 -8.8430 0.10000E+01 0.0000 74 OH- 0.12491E-04 -4.9034 0.12004E-04 -4.9207 0.96103E+00 -0.0173 79 HPO3-2 0.23484E-18 -18.6292 0.21142E-18 -18.6749 0.90026E+00 -0.0456 81 H2PO3- 0.21232E-19 -19.6730 0.20405E-19 -19.6903 0.96106E+00 -0.0172 82 H3PO4,aq 0.18880E-12 -12.7240 0.18880E-12 -12.7240 0.10000E+01 0.0000 83 H2PO4- 0.10766E-07 -7.9680 0.10347E-07 -7.9852 0.96108E+00 -0.0172 84 PO4-3 0.24450E-12 -12.6117 0.19754E-12 -12.7043 0.80792E+00 -0.0926 87 H2P2O7-2 0.93239E-17 -17.0304 0.83939E-17 -17.0760 0.90026E+00 -0.0456 88 HP2O7-3 0.43144E-16 -16.3651 0.34823E-16 -16.4581 0.80714E+00 -0.0931 89 P2O7-4 0.24936E-18 -18.6032 0.17285E-18 -18.7623 0.69315E+00 -0.1592 90 H2S,aq 0.88844E-08 -8.0514 0.88837E-08 -8.0514 0.99992E+00 0.0000 91 S2-2 0.15079E-16 -16.8216 0.13575E-16 -16.8673 0.90026E+00 -0.0456 96 SO2,aq 0.13716E-17 -17.8628 0.13716E-17 -17.8628 0.10000E+01 0.0000 97 SO3-2 0.19132E-13 -13.7182 0.17229E-13 -13.7637 0.90051E+00 -0.0455 98 HSO3- 0.54023E-13 -13.2674 0.51920E-13 -13.2847 0.96106E+00 -0.0172 99 HSO4- 0.10990E-08 -8.9590 0.10563E-08 -8.9762 0.96112E+00 -0.0172 101 S2O3-2 0.26398E-14 -14.5784 0.23765E-14 -14.6241 0.90026E+00 -0.0456 102 HS2O3- 0.21280E-19 -19.6720 0.20452E-19 -19.6893 0.96106E+00 -0.0172 Charge balance for all species = 0.9763E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.5007469E-07 -.1642462E-04 -.1655476E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999815E+06 0.0000 3 Cl- 0.1379627E-03 0.1379745E-03 0.4891529E+01 3.4401 4 SO4-- 0.2529509E-04 0.2543208E-04 0.2443006E+01 9.9926 5 HCO3- 0.1186305E-04 0.1307003E-04 0.7974834E+00 2.3745 6 HS- 0.6214042E-07 0.7245136E-07 0.2396072E-02 0.0937 7 Al+++ 0.1032793E-18 0.9896255E-06 0.2670114E-01 2.8737 8 H4SiO4 0.5646267E-04 0.5760583E-04 0.5536717E+01 -4.2482 9 Ca++ 0.2094357E-04 0.2112425E-04 0.8466036E+00 9.9105 10 Mg++ 0.2178480E-05 0.2196391E-05 0.5339777E-01 8.9276 11 Fe++ 0.1930521E-07 0.3212697E-07 0.1794165E-02 6.8751 12 K+ 0.1230977E-05 0.1231425E-05 0.4815040E-01 1.3906 13 Na+ 0.1673404E-03 0.1673518E-03 0.3847321E+01 3.5239 14 Mn++ 0.9172470E-07 0.9777170E-07 0.5371293E-02 7.5519 15 HPO4-- 0.1294362E-07 0.2370960E-07 0.2275586E-02 6.7016 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.8299939E-04 -.1642459E-04 -.6657480E-04 0.0000000E+00 2 H2O 0.5550818E+02 0.5550814E+02 0.3957336E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2566521E-04 0.2543202E-04 0.2331890E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1607378E-06 0.7245119E-07 -.2331890E-06 0.0000000E+00 7 Al+++ 0.1891230E-04 0.9896233E-06 0.1792268E-04 0.0000000E+00 8 H4SiO4 0.6039414E-04 0.5760571E-04 0.2788435E-05 0.0000000E+00 9 Ca++ 0.2114189E-04 0.2112420E-04 0.1768733E-07 0.0000000E+00 10 Mg++ 0.4603175E-05 0.2196386E-05 0.2406789E-05 0.0000000E+00 11 Fe++ 0.4135450E-05 0.3212689E-07 0.4103323E-05 0.0000000E+00 12 K+ 0.1231423E-05 0.1231423E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1673514E-03 0.1673514E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1005639E-06 0.9777148E-07 0.2792380E-08 0.0000000E+00 15 HPO4-- 0.3432194E-07 0.2370954E-07 0.1061240E-07 0.0000000E+00 Chg. balance for solid moles: 0.8484E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0058000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.3537E-08 -8.451 0.1777E-05 -5.750 0.1044 0.5646E-06 clinochlore 0.4814E-06 -6.318 0.2676E-03 -3.573 15.72 0.1018E-03 daphnite 0.4476E-06 -6.349 0.3193E-03 -3.496 18.77 0.9677E-04 chlorite-Mn 0.5585E-09 -9.253 0.3959E-06 -6.402 0.2327E-01 0.1262E-06 diaspore 0.1606E-04 -4.794 0.9637E-03 -3.016 56.63 0.2869E-03 hematite 0.9328E-06 -6.030 0.1490E-03 -3.827 8.754 0.2823E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5179E+00 0.5179E+00 1.0000 -0.286 daphnite 0.4815E+00 0.4815E+00 1.0000 -0.317 chlorite-Mn 0.6008E-03 0.6008E-03 1.0000 -3.221 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001702 g Volume = 0.000514 cm3 Porosity: 99.9487% V(tot) - V(min): 0.10018E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0058000 g log = -2.2366 Original solution: 1000.0103000 g Original solution / Rock added: 172415.57 (Water/Rock Ratio), log = 5.2366 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1221E-03 1.0071 0.1255E-03 0.1246E-03 CH4,gas 0.4138E-10 1.0125 0.4275E-10 0.4222E-10 H2,gas 0.7486E-05 1.0005 0.7643E-05 0.7639E-05 H2S,gas 0.2403E-06 0.9960 0.2442E-06 0.2452E-06 S2,gas 0.3755E-22 1.0000 0.3832E-22 0.3832E-22 CO,gas 0.2504E-12 1.0000 0.2555E-12 0.2555E-12 SO3,gas 0.1955E-34 1.0000 0.1995E-34 0.1995E-34 SO2,gas 0.5813E-17 1.0000 0.5931E-17 0.5931E-17 HCl,gas 0.2022E-14 1.0000 0.2063E-14 0.2063E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 0.24265E-10 47 daphnite 28.97 28.97 0.00 0.000 0.18198E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.12132E-10 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 0.00000E+00 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.26 -5.60 -1.867 0.95627E+04 -3.902 3 CH4,gas 4.54 -7.52 -12.07 -3.017 0.20606E+05 -10.369 4 H2,gas 8.00 1.18 -6.82 -3.895 0.11638E+05 -5.117 5 H2S,gas -6.23 -14.54 -8.31 -4.156 0.14191E+05 -6.612 6 S2,gas -7.34 -31.45 -24.12 -3.710 0.41177E+05 -22.417 7 CO,gas 3.21 -11.08 -14.29 -4.397 0.24402E+05 -12.593 8 SO3,gas 17.12 -19.28 -36.40 -9.100 0.62150E+05 -34.700 9 SO2,gas 0.83 -18.09 -18.93 -5.047 0.32315E+05 -17.227 10 HCl,gas 5.19 -11.20 -16.38 -8.192 0.27976E+05 -14.685 21 andalusite 5.00 1.50 -3.50 -0.350 0.59802E+04 24 anhydrite -5.32 -9.37 -4.05 -2.025 0.69160E+04 35 aragonite 0.97 -2.35 -3.32 -1.106 0.56630E+04 36 brucite 12.57 8.93 -3.64 -0.728 0.62169E+04 37 calcite 0.81 -2.35 -3.16 -1.054 0.53988E+04 40 carpholite-Mg 8.58 6.18 -2.40 -0.160 0.41040E+04 41 carpholite-Fe 6.71 4.13 -2.59 -0.172 0.44165E+04 50 chloritoid-Mg 13.20 10.43 -2.77 -0.185 0.47313E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13648E+04 52 chloritoid-Mn 11.40 9.05 -2.35 -0.157 0.40125E+04 54 coesite -2.38 -4.25 -1.87 -0.624 0.31967E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.25 -1.69 -0.563 0.28820E+04 78 fayalite 14.05 9.50 -4.54 -0.649 0.77583E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.13 -4.01 -0.334 0.68480E+04 92 hercynite 17.28 12.62 -4.66 -0.310 0.79500E+04 98 kaolinite -1.33 -2.75 -1.42 -0.129 0.24183E+04 99 kyanite 4.88 1.50 -3.38 -0.338 0.57661E+04 101 laumontite 2.88 -1.34 -4.22 -0.281 0.72029E+04 102 lawsonite 9.62 7.16 -2.45 -0.164 0.41912E+04 105 lizardite 23.24 18.29 -4.96 -0.413 0.84649E+04 106 magnesite 0.69 -3.33 -4.02 -1.341 0.68702E+04 107 magnetite 20.09 19.44 -0.65 -0.053 0.11032E+04 110 magnesioferrite 26.21 21.49 -4.72 -0.385 0.80569E+04 113 margarite 17.32 12.91 -4.41 -0.177 0.75381E+04 121 paragonite 4.24 -0.60 -4.84 -0.285 0.82627E+04 128 periclase-Fe 11.63 6.88 -4.75 -1.188 0.81130E+04 142 pyrite -21.25 -23.39 -2.14 -0.505 0.36624E+04 143 pyrrhotite -4.26 -7.67 -3.41 -1.135 0.58157E+04 144 pyrrhotiteFe0.875 -6.02 -8.67 -2.66 -0.977 0.45344E+04 145 pyroxmangite 7.40 3.30 -4.09 -0.819 0.69921E+04 147 quartz -2.99 -4.25 -1.26 -0.420 0.21494E+04 151 rhodochrosite -0.98 -4.71 -3.73 -1.244 0.63729E+04 152 rhodonite 7.45 3.30 -4.14 -0.828 0.70723E+04 155 siderite -2.61 -5.39 -2.78 -0.926 0.47422E+04 156 sillimanite 5.26 1.50 -3.76 -0.376 0.64241E+04 168 sudoite 21.08 16.61 -4.47 -0.144 0.76360E+04 177 topaz-H 4.62 1.50 -3.12 -0.284 0.53262E+04 178 tridymite -2.63 -4.25 -1.62 -0.541 0.27694E+04 181 troilite-low -4.41 -7.67 -3.26 -1.085 0.55585E+04 189 wollastonite 10.46 5.66 -4.80 -0.960 0.81939E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.25 -1.45 -0.482 0.24687E+04 205 nontronite-Ca 3.21 -0.44 -3.66 -0.237 0.62422E+04 206 nontronite-H 2.53 -2.08 -4.61 -0.309 0.78701E+04 207 nontronite-K 3.34 -1.62 -4.96 -0.318 0.84662E+04 208 nontronite-Mg 3.07 -0.60 -3.68 -0.239 0.62803E+04 209 nontronite-Na 3.52 -0.91 -4.43 -0.285 0.75698E+04 214 gypsum -4.96 -9.37 -4.41 -1.103 0.75335E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.88 -2.94 -0.734 0.50139E+04 240 silica-amorphous -2.09 -4.25 -2.16 -0.719 0.36828E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0058000 g New total amount of reactant added: 0.0060000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0060000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2625882E-03 Osmotic coef. = 0.9902 True ionic strength = .2643063E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.48750E-07 -7.3120 0.46856E-07 -7.3292 0.96115E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13259E-03 -3.8775 0.96104E+00 -0.0173 4 SO4-- 0.25309E-04 -4.5967 0.22784E-04 -4.6424 0.90021E+00 -0.0457 5 HCO3- 0.11891E-04 -4.9248 0.11428E-04 -4.9420 0.96107E+00 -0.0172 6 HS- 0.48617E-07 -7.3132 0.46723E-07 -7.3305 0.96104E+00 -0.0173 7 Al+++ 0.95308E-19 -19.0209 0.76910E-19 -19.1140 0.80696E+00 -0.0931 8 H4SiO4 0.58167E-04 -4.2353 0.58167E-04 -4.2353 0.10000E+01 0.0000 9 Ca++ 0.21166E-04 -4.6744 0.19051E-04 -4.7201 0.90008E+00 -0.0457 10 Mg++ 0.20459E-05 -5.6891 0.18413E-05 -5.7349 0.90000E+00 -0.0458 11 Fe++ 0.17804E-07 -7.7495 0.16024E-07 -7.7952 0.90002E+00 -0.0457 12 K+ 0.12734E-05 -5.8950 0.12239E-05 -5.9123 0.96107E+00 -0.0172 13 Na+ 0.16759E-03 -3.7757 0.16106E-03 -3.7930 0.96104E+00 -0.0173 14 Mn++ 0.94241E-07 -7.0258 0.84820E-07 -7.0715 0.90004E+00 -0.0457 15 HPO4-- 0.12273E-07 -7.9110 0.11049E-07 -7.9567 0.90021E+00 -0.0457 16 HSiO3- 0.12062E-05 -5.9186 0.11592E-05 -5.9359 0.96104E+00 -0.0173 17 Ca(HSiO3)+ 0.52329E-09 -9.2813 0.50292E-09 -9.2985 0.96108E+00 -0.0172 18 Mg(HSiO3)+ 0.62944E-10 -10.2010 0.60494E-10 -10.2183 0.96108E+00 -0.0172 19 NaHSiO3,aq 0.30195E-08 -8.5201 0.30195E-08 -8.5201 0.10000E+01 0.0000 20 AlO+ 0.49588E-11 -11.3046 0.47658E-11 -11.3219 0.96108E+00 -0.0172 21 AlOH+2 0.12354E-14 -14.9082 0.11119E-14 -14.9539 0.90005E+00 -0.0457 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.99576E-06 -6.0018 0.95693E-06 -6.0191 0.96101E+00 -0.0173 24 CH4,aq 0.22766E-13 -13.6427 0.22764E-13 -13.6427 0.99992E+00 0.0000 29 CO,aq 0.15841E-15 -15.8002 0.15841E-15 -15.8002 0.10000E+01 0.0000 30 CO2,aq 0.11442E-05 -5.9415 0.11441E-05 -5.9415 0.99992E+00 0.0000 31 CO3-2 0.23665E-07 -7.6259 0.21303E-07 -7.6716 0.90017E+00 -0.0457 32 CaCO3,aq 0.50889E-08 -8.2934 0.50889E-08 -8.2934 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.57824E-08 -8.2379 0.55573E-08 -8.2551 0.96108E+00 -0.0172 34 CaCl+ 0.42534E-08 -8.3713 0.40878E-08 -8.3885 0.96108E+00 -0.0172 35 CaCl2,aq 0.12877E-12 -12.8902 0.12877E-12 -12.8902 0.10000E+01 0.0000 36 CaOH+ 0.30151E-07 -7.5207 0.28978E-07 -7.5379 0.96108E+00 -0.0172 37 CaSO4,aq 0.13783E-06 -6.8606 0.13783E-06 -6.8606 0.10000E+01 0.0000 38 HCl,aq 0.11384E-11 -11.9437 0.11384E-11 -11.9437 0.10000E+01 0.0000 43 FeCl+ 0.34990E-11 -11.4561 0.33628E-11 -11.4733 0.96108E+00 -0.0172 44 FeCl2,aq 0.14116E-19 -19.8503 0.14116E-19 -19.8503 0.10000E+01 0.0000 46 FeO,aq 0.28366E-09 -9.5472 0.28366E-09 -9.5472 0.10000E+01 0.0000 47 FeOH+ 0.11583E-07 -7.9362 0.11132E-07 -7.9534 0.96108E+00 -0.0172 48 HFeO2- 0.65911E-10 -10.1810 0.63343E-10 -10.1983 0.96104E+00 -0.0173 49 FeO+ 0.37213E-12 -12.4293 0.35765E-12 -12.4465 0.96108E+00 -0.0172 50 FeOH+2 0.35556E-17 -17.4491 0.32002E-17 -17.4948 0.90005E+00 -0.0457 51 FeO2- 0.34684E-10 -10.4599 0.33333E-10 -10.4771 0.96104E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.55119E-08 -8.2587 0.55115E-08 -8.2587 0.99992E+00 0.0000 54 KCl,aq 0.29410E-11 -11.5315 0.29410E-11 -11.5315 0.10000E+01 0.0000 55 KHSO4,aq 0.36940E-17 -17.4325 0.36940E-17 -17.4325 0.10000E+01 0.0000 56 KOH,aq 0.11155E-10 -10.9525 0.11155E-10 -10.9525 0.10000E+01 0.0000 57 KSO4- 0.45023E-09 -9.3466 0.43269E-09 -9.3638 0.96104E+00 -0.0173 58 MgCO3,aq 0.12329E-09 -9.9091 0.12329E-09 -9.9091 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.57107E-09 -9.2433 0.54884E-09 -9.2606 0.96108E+00 -0.0172 60 MgCl+ 0.37259E-09 -9.4288 0.35809E-09 -9.4460 0.96108E+00 -0.0172 61 MgOH+ 0.16126E-07 -7.7925 0.15498E-07 -7.8097 0.96108E+00 -0.0172 63 MnO,aq 0.40010E-10 -10.3978 0.40010E-10 -10.3978 0.10000E+01 0.0000 64 MnOH+ 0.56956E-08 -8.2445 0.54740E-08 -8.2617 0.96108E+00 -0.0172 65 MnO2-2 0.67187E-18 -18.1727 0.60480E-18 -18.2184 0.90017E+00 -0.0457 66 HMnO2- 0.64601E-14 -14.1898 0.62085E-14 -14.2070 0.96104E+00 -0.0173 69 MnCl+ 0.72058E-10 -10.1423 0.69253E-10 -10.1596 0.96108E+00 -0.0172 70 MnSO4,aq 0.55790E-09 -9.2534 0.55790E-09 -9.2534 0.10000E+01 0.0000 71 NaCl,aq 0.70770E-08 -8.1501 0.70770E-08 -8.1501 0.10000E+01 0.0000 72 NaOH,aq 0.14769E-08 -8.8307 0.14769E-08 -8.8307 0.10000E+01 0.0000 74 OH- 0.12831E-04 -4.8917 0.12331E-04 -4.9090 0.96101E+00 -0.0173 79 HPO3-2 0.21081E-18 -18.6761 0.18977E-18 -18.7218 0.90017E+00 -0.0457 81 H2PO3- 0.18554E-19 -19.7316 0.17831E-19 -19.7488 0.96104E+00 -0.0173 82 H3PO4,aq 0.16965E-12 -12.7704 0.16965E-12 -12.7704 0.10000E+01 0.0000 83 H2PO4- 0.99371E-08 -8.0027 0.95501E-08 -8.0200 0.96106E+00 -0.0173 84 PO4-3 0.23818E-12 -12.6231 0.19239E-12 -12.7158 0.80775E+00 -0.0927 87 H2P2O7-2 0.79445E-17 -17.0999 0.71514E-17 -17.1456 0.90017E+00 -0.0457 88 HP2O7-3 0.37765E-16 -16.4229 0.30476E-16 -16.5160 0.80697E+00 -0.0931 89 P2O7-4 0.22425E-18 -18.6493 0.15538E-18 -18.8086 0.69289E+00 -0.1593 90 H2S,aq 0.67666E-08 -8.1696 0.67661E-08 -8.1697 0.99992E+00 0.0000 91 S2-2 0.97497E-17 -17.0110 0.87765E-17 -17.0567 0.90017E+00 -0.0457 96 SO2,aq 0.12312E-17 -17.9097 0.12312E-17 -17.9097 0.10000E+01 0.0000 97 SO3-2 0.18122E-13 -13.7418 0.16318E-13 -13.7873 0.90043E+00 -0.0455 98 HSO3- 0.49814E-13 -13.3027 0.47873E-13 -13.3199 0.96104E+00 -0.0173 99 HSO4- 0.10705E-08 -8.9704 0.10288E-08 -8.9877 0.96109E+00 -0.0172 101 S2O3-2 0.20117E-14 -14.6964 0.18108E-14 -14.7421 0.90017E+00 -0.0457 102 HS2O3- 0.15786E-19 -19.8017 0.15171E-19 -19.8190 0.96104E+00 -0.0173 Charge balance for all species = 0.9763E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4874953E-07 -.1697068E-04 -.1710514E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999813E+06 0.0000 3 Cl- 0.1379627E-03 0.1379745E-03 0.4891528E+01 3.4517 4 SO4-- 0.2530923E-04 0.2544780E-04 0.2444515E+01 10.0161 5 HCO3- 0.1189057E-04 0.1307003E-04 0.7974834E+00 2.3872 6 HS- 0.4861672E-07 0.5673217E-07 0.1876215E-02 -0.0012 7 Al+++ 0.9530835E-19 0.1016022E-05 0.2741334E-01 2.8737 8 H4SiO4 0.5816741E-04 0.5937716E-04 0.5706964E+01 -4.2353 9 Ca++ 0.2116617E-04 0.2134981E-04 0.8556433E+00 9.9384 10 Mg++ 0.2045935E-05 0.2063191E-05 0.5015945E-01 8.9236 11 Fe++ 0.1780355E-07 0.2997286E-07 0.1673866E-02 6.8632 12 K+ 0.1273424E-05 0.1273888E-05 0.4981075E-01 1.4170 13 Na+ 0.1675913E-03 0.1676029E-03 0.3853092E+01 3.5362 14 Mn++ 0.9424081E-07 0.1006064E-06 0.5527024E-02 7.5870 15 HPO4-- 0.1227347E-07 0.2221098E-07 0.2131752E-02 6.7018 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.8631109E-04 -.1697064E-04 -.6934045E-04 0.0000000E+00 2 H2O 0.5550817E+02 0.5550813E+02 0.4095184E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2567075E-04 0.2544774E-04 0.2230125E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1662805E-06 0.5673204E-07 -.2230125E-06 0.0000000E+00 7 Al+++ 0.1956445E-04 0.1016020E-05 0.1854843E-04 0.0000000E+00 8 H4SiO4 0.6247670E-04 0.5937702E-04 0.3099674E-05 0.0000000E+00 9 Ca++ 0.2137192E-04 0.2134976E-04 0.2215756E-07 0.0000000E+00 10 Mg++ 0.4761905E-05 0.2063186E-05 0.2698719E-05 0.0000000E+00 11 Fe++ 0.4278052E-05 0.2997279E-07 0.4248079E-05 0.0000000E+00 12 K+ 0.1273885E-05 0.1273885E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1676025E-03 0.1676025E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1040316E-06 0.1006062E-06 0.3425379E-08 0.0000000E+00 15 HPO4-- 0.3550546E-07 0.2221092E-07 0.1329454E-07 0.0000000E+00 Chg. balance for solid moles: 0.6621E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0060000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.4432E-08 -8.353 0.2226E-05 -5.652 0.1247 0.7074E-06 clinochlore 0.5397E-06 -6.268 0.3000E-03 -3.523 16.80 0.1141E-03 daphnite 0.4928E-06 -6.307 0.3516E-03 -3.454 19.69 0.1065E-03 chlorite-Mn 0.6851E-09 -9.164 0.4857E-06 -6.314 0.2720E-01 0.1548E-06 diaspore 0.1648E-04 -4.783 0.9888E-03 -3.005 55.38 0.2944E-03 hematite 0.8920E-06 -6.050 0.1425E-03 -3.846 7.979 0.2700E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5224E+00 0.5224E+00 1.0000 -0.282 daphnite 0.4769E+00 0.4769E+00 1.0000 -0.322 chlorite-Mn 0.6630E-03 0.6630E-03 1.0000 -3.178 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001786 g Volume = 0.000543 cm3 Porosity: 99.9458% V(tot) - V(min): 0.10019E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0060000 g log = -2.2218 Original solution: 1000.0103000 g Original solution / Rock added: 166668.38 (Water/Rock Ratio), log = 5.2219 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1191E-03 1.0071 0.1224E-03 0.1215E-03 CH4,gas 0.3243E-10 1.0125 0.3351E-10 0.3309E-10 H2,gas 0.7087E-05 1.0005 0.7236E-05 0.7232E-05 H2S,gas 0.1830E-06 0.9960 0.1860E-06 0.1867E-06 S2,gas 0.2430E-22 1.0000 0.2480E-22 0.2480E-22 CO,gas 0.2313E-12 1.0000 0.2361E-12 0.2361E-12 SO3,gas 0.1853E-34 1.0000 0.1891E-34 0.1891E-34 SO2,gas 0.5218E-17 1.0000 0.5324E-17 0.5324E-17 HCl,gas 0.1969E-14 1.0000 0.2009E-14 0.2009E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 -0.36397E-10 47 daphnite 28.97 28.97 0.00 0.000 -0.60662E-11 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.00000E+00 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.27 -5.61 -1.870 0.95809E+04 -3.912 3 CH4,gas 4.54 -7.63 -12.17 -3.043 0.20786E+05 -10.475 4 H2,gas 8.00 1.16 -6.84 -3.908 0.11678E+05 -5.141 5 H2S,gas -6.23 -14.66 -8.43 -4.215 0.14393E+05 -6.730 6 S2,gas -7.34 -31.64 -24.30 -3.739 0.41499E+05 -22.606 7 CO,gas 3.21 -11.11 -14.33 -4.408 0.24461E+05 -12.627 8 SO3,gas 17.12 -19.30 -36.42 -9.106 0.62190E+05 -34.723 9 SO2,gas 0.83 -18.14 -18.97 -5.059 0.32395E+05 -17.274 10 HCl,gas 5.19 -11.21 -16.40 -8.198 0.27996E+05 -14.697 21 andalusite 5.00 1.51 -3.49 -0.349 0.59581E+04 24 anhydrite -5.32 -9.36 -4.05 -2.023 0.69078E+04 35 aragonite 0.97 -2.33 -3.30 -1.100 0.56336E+04 36 brucite 12.57 8.92 -3.64 -0.729 0.62237E+04 37 calcite 0.81 -2.33 -3.14 -1.048 0.53694E+04 40 carpholite-Mg 8.58 6.20 -2.38 -0.159 0.40667E+04 41 carpholite-Fe 6.71 4.14 -2.57 -0.172 0.43927E+04 50 chloritoid-Mg 13.20 10.44 -2.76 -0.184 0.47161E+04 51 chloritoid-Fe 9.17 8.38 -0.80 -0.053 0.13631E+04 52 chloritoid-Mn 11.40 9.10 -2.30 -0.153 0.39306E+04 54 coesite -2.38 -4.24 -1.86 -0.620 0.31746E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.24 -1.67 -0.558 0.28600E+04 78 fayalite 14.05 9.49 -4.55 -0.651 0.77768E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.12 -4.02 -0.335 0.68648E+04 92 hercynite 17.28 12.61 -4.67 -0.311 0.79703E+04 98 kaolinite -1.33 -2.72 -1.39 -0.126 0.23742E+04 99 kyanite 4.88 1.51 -3.36 -0.336 0.57440E+04 101 laumontite 2.88 -1.26 -4.14 -0.276 0.70671E+04 102 lawsonite 9.62 7.22 -2.40 -0.160 0.40995E+04 105 lizardite 23.24 18.30 -4.94 -0.412 0.84412E+04 106 magnesite 0.69 -3.35 -4.04 -1.346 0.68952E+04 107 magnetite 20.09 19.43 -0.66 -0.054 0.11235E+04 110 magnesioferrite 26.21 21.49 -4.72 -0.386 0.80637E+04 113 margarite 17.32 12.96 -4.36 -0.174 0.74464E+04 121 paragonite 4.24 -0.55 -4.79 -0.282 0.81755E+04 128 periclase-Fe 11.63 6.86 -4.76 -1.191 0.81333E+04 142 pyrite -21.25 -23.62 -2.37 -0.558 0.40459E+04 143 pyrrhotite -4.26 -7.80 -3.54 -1.179 0.60379E+04 144 pyrrhotiteFe0.875 -6.02 -8.80 -2.78 -1.023 0.47490E+04 145 pyroxmangite 7.40 3.35 -4.05 -0.809 0.69102E+04 147 quartz -2.99 -4.24 -1.25 -0.415 0.21273E+04 151 rhodochrosite -0.98 -4.68 -3.71 -1.236 0.63313E+04 152 rhodonite 7.45 3.35 -4.09 -0.819 0.69904E+04 155 siderite -2.61 -5.41 -2.80 -0.933 0.47808E+04 156 sillimanite 5.26 1.51 -3.75 -0.375 0.64021E+04 168 sudoite 21.08 16.64 -4.44 -0.143 0.75834E+04 177 topaz-H 4.62 1.51 -3.11 -0.282 0.53041E+04 178 tridymite -2.63 -4.24 -1.61 -0.536 0.27473E+04 181 troilite-low -4.41 -7.80 -3.39 -1.129 0.57807E+04 189 wollastonite 10.46 5.70 -4.76 -0.952 0.81243E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.24 -1.43 -0.478 0.24466E+04 205 nontronite-Ca 3.21 -0.39 -3.60 -0.234 0.61534E+04 206 nontronite-H 2.53 -2.03 -4.56 -0.306 0.77892E+04 207 nontronite-K 3.34 -1.56 -4.90 -0.315 0.83704E+04 208 nontronite-Mg 3.07 -0.56 -3.63 -0.236 0.62004E+04 209 nontronite-Na 3.52 -0.86 -4.38 -0.281 0.74819E+04 214 gypsum -4.96 -9.36 -4.41 -1.102 0.75254E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.86 -2.95 -0.737 0.50342E+04 240 silica-amorphous -2.09 -4.24 -2.14 -0.715 0.36608E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0060000 g New total amount of reactant added: 0.0062000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0062000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2630801E-03 Osmotic coef. = 0.9902 True ionic strength = .2649102E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.47434E-07 -7.3239 0.45590E-07 -7.3411 0.96113E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13258E-03 -3.8775 0.96102E+00 -0.0173 4 SO4-- 0.25320E-04 -4.5965 0.22791E-04 -4.6422 0.90012E+00 -0.0457 5 HCO3- 0.11918E-04 -4.9238 0.11454E-04 -4.9411 0.96104E+00 -0.0173 6 HS- 0.37657E-07 -7.4242 0.36189E-07 -7.4414 0.96102E+00 -0.0173 7 Al+++ 0.87809E-19 -19.0565 0.70844E-19 -19.1497 0.80679E+00 -0.0932 8 H4SiO4 0.59888E-04 -4.2227 0.59888E-04 -4.2227 0.10000E+01 0.0000 9 Ca++ 0.21389E-04 -4.6698 0.19250E-04 -4.7156 0.90000E+00 -0.0458 10 Mg++ 0.19223E-05 -5.7162 0.17299E-05 -5.7620 0.89992E+00 -0.0458 11 Fe++ 0.16382E-07 -7.7856 0.14742E-07 -7.8314 0.89993E+00 -0.0458 12 K+ 0.13159E-05 -5.8808 0.12646E-05 -5.8980 0.96105E+00 -0.0173 13 Na+ 0.16784E-03 -3.7751 0.16130E-03 -3.7924 0.96101E+00 -0.0173 14 Mn++ 0.96674E-07 -7.0147 0.87001E-07 -7.0605 0.89995E+00 -0.0458 15 HPO4-- 0.11632E-07 -7.9344 0.10470E-07 -7.9801 0.90013E+00 -0.0457 16 HSiO3- 0.12763E-05 -5.8940 0.12266E-05 -5.9113 0.96102E+00 -0.0173 17 Ca(HSiO3)+ 0.55952E-09 -9.2522 0.53773E-09 -9.2694 0.96105E+00 -0.0173 18 Mg(HSiO3)+ 0.62578E-10 -10.2036 0.60141E-10 -10.2208 0.96105E+00 -0.0173 19 NaHSiO3,aq 0.31999E-08 -8.4949 0.31999E-08 -8.4949 0.10000E+01 0.0000 20 AlO+ 0.48250E-11 -11.3165 0.46370E-11 -11.3338 0.96105E+00 -0.0173 21 AlOH+2 0.11697E-14 -14.9319 0.10527E-14 -14.9777 0.89997E+00 -0.0458 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.10234E-05 -5.9899 0.98350E-06 -6.0072 0.96098E+00 -0.0173 24 CH4,aq 0.17667E-13 -13.7528 0.17666E-13 -13.7529 0.99992E+00 0.0000 29 CO,aq 0.14591E-15 -15.8359 0.14591E-15 -15.8359 0.10000E+01 0.0000 30 CO2,aq 0.11159E-05 -5.9524 0.11158E-05 -5.9524 0.99992E+00 0.0000 31 CO3-2 0.24380E-07 -7.6130 0.21944E-07 -7.6587 0.90009E+00 -0.0457 32 CaCO3,aq 0.52967E-08 -8.2760 0.52967E-08 -8.2760 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.58561E-08 -8.2324 0.56280E-08 -8.2496 0.96105E+00 -0.0173 34 CaCl+ 0.42977E-08 -8.3668 0.41303E-08 -8.3840 0.96105E+00 -0.0173 35 CaCl2,aq 0.13010E-12 -12.8857 0.13010E-12 -12.8857 0.10000E+01 0.0000 36 CaOH+ 0.31312E-07 -7.5043 0.30093E-07 -7.5215 0.96105E+00 -0.0173 37 CaSO4,aq 0.13932E-06 -6.8560 0.13932E-06 -6.8560 0.10000E+01 0.0000 38 HCl,aq 0.11076E-11 -11.9556 0.11076E-11 -11.9556 0.10000E+01 0.0000 43 FeCl+ 0.32192E-11 -11.4923 0.30938E-11 -11.5095 0.96105E+00 -0.0173 44 FeCl2,aq 0.12987E-19 -19.8865 0.12987E-19 -19.8865 0.10000E+01 0.0000 46 FeO,aq 0.27567E-09 -9.5596 0.27567E-09 -9.5596 0.10000E+01 0.0000 47 FeOH+ 0.10953E-07 -7.9605 0.10526E-07 -7.9777 0.96105E+00 -0.0173 48 HFeO2- 0.65835E-10 -10.1815 0.63269E-10 -10.1988 0.96102E+00 -0.0173 49 FeO+ 0.36208E-12 -12.4412 0.34798E-12 -12.4584 0.96105E+00 -0.0173 50 FeOH+2 0.33664E-17 -17.4728 0.30296E-17 -17.5186 0.89997E+00 -0.0458 51 FeO2- 0.35648E-10 -10.4480 0.34259E-10 -10.4652 0.96102E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.52060E-08 -8.2835 0.52056E-08 -8.2835 0.99992E+00 0.0000 54 KCl,aq 0.30389E-11 -11.5173 0.30389E-11 -11.5173 0.10000E+01 0.0000 55 KHSO4,aq 0.37152E-17 -17.4300 0.37152E-17 -17.4300 0.10000E+01 0.0000 56 KOH,aq 0.11846E-10 -10.9264 0.11846E-10 -10.9264 0.10000E+01 0.0000 57 KSO4- 0.46540E-09 -9.3322 0.44725E-09 -9.3494 0.96102E+00 -0.0173 58 MgCO3,aq 0.11931E-09 -9.9233 0.11931E-09 -9.9233 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.53776E-09 -9.2694 0.51681E-09 -9.2867 0.96105E+00 -0.0173 60 MgCl+ 0.35005E-09 -9.4559 0.33642E-09 -9.4731 0.96105E+00 -0.0173 61 MgOH+ 0.15571E-07 -7.8077 0.14965E-07 -7.8249 0.96105E+00 -0.0173 63 MnO,aq 0.43349E-10 -10.3630 0.43349E-10 -10.3630 0.10000E+01 0.0000 64 MnOH+ 0.60045E-08 -8.2215 0.57706E-08 -8.2388 0.96105E+00 -0.0173 65 MnO2-2 0.76901E-18 -18.1141 0.69217E-18 -18.1598 0.90009E+00 -0.0457 66 HMnO2- 0.71939E-14 -14.1430 0.69135E-14 -14.1603 0.96102E+00 -0.0173 69 MnCl+ 0.73910E-10 -10.1313 0.71032E-10 -10.1485 0.96105E+00 -0.0173 70 MnSO4,aq 0.57244E-09 -9.2423 0.57244E-09 -9.2423 0.10000E+01 0.0000 71 NaCl,aq 0.70873E-08 -8.1495 0.70873E-08 -8.1495 0.10000E+01 0.0000 72 NaOH,aq 0.15201E-08 -8.8181 0.15201E-08 -8.8181 0.10000E+01 0.0000 74 OH- 0.13188E-04 -4.8798 0.12673E-04 -4.8971 0.96098E+00 -0.0173 79 HPO3-2 0.18870E-18 -18.7242 0.16985E-18 -18.7699 0.90009E+00 -0.0457 81 H2PO3- 0.16158E-19 -19.7916 0.15528E-19 -19.8089 0.96102E+00 -0.0173 82 H3PO4,aq 0.15220E-12 -12.8176 0.15220E-12 -12.8176 0.10000E+01 0.0000 83 H2PO4- 0.91624E-08 -8.0380 0.88054E-08 -8.0553 0.96103E+00 -0.0173 84 PO4-3 0.23202E-12 -12.6345 0.18738E-12 -12.7273 0.80757E+00 -0.0928 87 H2P2O7-2 0.67544E-17 -17.1704 0.60795E-17 -17.2161 0.90009E+00 -0.0457 88 HP2O7-3 0.33004E-16 -16.4814 0.26627E-16 -16.5747 0.80679E+00 -0.0932 89 P2O7-4 0.20145E-18 -18.6958 0.13953E-18 -18.8553 0.69263E+00 -0.1595 90 H2S,aq 0.50995E-08 -8.2925 0.50991E-08 -8.2925 0.99992E+00 0.0000 91 S2-2 0.61934E-17 -17.2081 0.55746E-17 -17.2538 0.90009E+00 -0.0457 96 SO2,aq 0.11013E-17 -17.9581 0.11013E-17 -17.9581 0.10000E+01 0.0000 97 SO3-2 0.17124E-13 -13.7664 0.15417E-13 -13.8120 0.90034E+00 -0.0456 98 HSO3- 0.45794E-13 -13.3392 0.44009E-13 -13.3565 0.96102E+00 -0.0173 99 HSO4- 0.10419E-08 -8.9822 0.10014E-08 -8.9994 0.96107E+00 -0.0172 101 S2O3-2 0.15167E-14 -14.8191 0.13652E-14 -14.8648 0.90009E+00 -0.0457 102 HS2O3- 0.11580E-19 -19.9363 0.11128E-19 -19.9536 0.96102E+00 -0.0173 Charge balance for all species = 0.9764E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4743359E-07 -.1754174E-04 -.1768072E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999811E+06 0.0000 3 Cl- 0.1379627E-03 0.1379745E-03 0.4891528E+01 3.4636 4 SO4-- 0.2532038E-04 0.2546050E-04 0.2445735E+01 10.0400 5 HCO3- 0.1191799E-04 0.1307003E-04 0.7974833E+00 2.4001 6 HS- 0.3765680E-07 0.4402847E-07 0.1456085E-02 -0.1003 7 Al+++ 0.8780946E-19 0.1043697E-05 0.2816004E-01 2.8737 8 H4SiO4 0.5988820E-04 0.6116837E-04 0.5879124E+01 -4.2227 9 Ca++ 0.2138886E-04 0.2157551E-04 0.8646885E+00 9.9667 10 Mg++ 0.1922346E-05 0.1938987E-05 0.4713985E-01 8.9203 11 Fe++ 0.1638168E-07 0.2791369E-07 0.1558870E-02 6.8508 12 K+ 0.1315871E-05 0.1316351E-05 0.5147110E-01 1.4431 13 Na+ 0.1678421E-03 0.1678539E-03 0.3858863E+01 3.5488 14 Mn++ 0.9667358E-07 0.1033678E-06 0.5678722E-02 7.6218 15 HPO4-- 0.1163174E-07 0.2079454E-07 0.1995806E-02 6.7022 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.8962280E-04 -.1754170E-04 -.7208110E-04 0.0000000E+00 2 H2O 0.5550817E+02 0.5550813E+02 0.4233860E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2567629E-04 0.2546044E-04 0.2158515E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1718231E-06 0.4402836E-07 -.2158515E-06 0.0000000E+00 7 Al+++ 0.2021660E-04 0.1043695E-05 0.1917290E-04 0.0000000E+00 8 H4SiO4 0.6455925E-04 0.6116823E-04 0.3391027E-05 0.0000000E+00 9 Ca++ 0.2160194E-04 0.2157545E-04 0.2649080E-07 0.0000000E+00 10 Mg++ 0.4920635E-05 0.1938982E-05 0.2981653E-05 0.0000000E+00 11 Fe++ 0.4420653E-05 0.2791363E-07 0.4392740E-05 0.0000000E+00 12 K+ 0.1316348E-05 0.1316348E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1678535E-03 0.1678535E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1074993E-06 0.1033675E-06 0.4131780E-08 0.0000000E+00 15 HPO4-- 0.3668898E-07 0.2079449E-07 0.1589448E-07 0.0000000E+00 Chg. balance for solid moles: 0.8166E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0062000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.5298E-08 -8.276 0.2661E-05 -5.575 0.1425 0.8457E-06 clinochlore 0.5963E-06 -6.225 0.3315E-03 -3.480 17.75 0.1261E-03 daphnite 0.5332E-06 -6.273 0.3804E-03 -3.420 20.37 0.1153E-03 chlorite-Mn 0.8264E-09 -9.083 0.5859E-06 -6.232 0.3137E-01 0.1867E-06 diaspore 0.1691E-04 -4.772 0.1015E-02 -2.994 54.32 0.3020E-03 hematite 0.8634E-06 -6.064 0.1379E-03 -3.860 7.383 0.2613E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5276E+00 0.5276E+00 1.0000 -0.278 daphnite 0.4717E+00 0.4717E+00 1.0000 -0.326 chlorite-Mn 0.7311E-03 0.7311E-03 1.0000 -3.136 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001868 g Volume = 0.000571 cm3 Porosity: 99.9431% V(tot) - V(min): 0.10019E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0062000 g log = -2.2076 Original solution: 1000.0103000 g Original solution / Rock added: 161291.98 (Water/Rock Ratio), log = 5.2076 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1162E-03 1.0071 0.1194E-03 0.1185E-03 CH4,gas 0.2517E-10 1.0125 0.2600E-10 0.2568E-10 H2,gas 0.6694E-05 1.0005 0.6834E-05 0.6831E-05 H2S,gas 0.1379E-06 0.9960 0.1402E-06 0.1407E-06 S2,gas 0.1547E-22 1.0000 0.1579E-22 0.1579E-22 CO,gas 0.2131E-12 1.0000 0.2174E-12 0.2174E-12 SO3,gas 0.1755E-34 1.0000 0.1791E-34 0.1791E-34 SO2,gas 0.4667E-17 1.0000 0.4762E-17 0.4762E-17 HCl,gas 0.1915E-14 1.0000 0.1954E-14 0.1954E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 -0.60662E-11 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.12132E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 -0.60662E-11 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.28 -5.62 -1.874 0.95995E+04 -3.923 3 CH4,gas 4.54 -7.74 -12.28 -3.071 0.20975E+05 -10.585 4 H2,gas 8.00 1.14 -6.86 -3.922 0.11721E+05 -5.165 5 H2S,gas -6.23 -14.78 -8.55 -4.276 0.14603E+05 -6.853 6 S2,gas -7.34 -31.84 -24.50 -3.769 0.41834E+05 -22.802 7 CO,gas 3.21 -11.15 -14.36 -4.419 0.24522E+05 -12.663 8 SO3,gas 17.12 -19.32 -36.45 -9.111 0.62230E+05 -34.747 9 SO2,gas 0.83 -18.19 -19.02 -5.072 0.32478E+05 -17.322 10 HCl,gas 5.19 -11.22 -16.41 -8.204 0.28016E+05 -14.709 21 andalusite 5.00 1.52 -3.48 -0.348 0.59365E+04 24 anhydrite -5.32 -9.36 -4.04 -2.020 0.68999E+04 35 aragonite 0.97 -2.32 -3.28 -1.094 0.56039E+04 36 brucite 12.57 8.92 -3.65 -0.730 0.62293E+04 37 calcite 0.81 -2.32 -3.13 -1.042 0.53397E+04 40 carpholite-Mg 8.58 6.22 -2.36 -0.157 0.40292E+04 41 carpholite-Fe 6.71 4.15 -2.56 -0.171 0.43707E+04 50 chloritoid-Mg 13.20 10.45 -2.75 -0.184 0.47001E+04 51 chloritoid-Fe 9.17 8.38 -0.80 -0.053 0.13627E+04 52 chloritoid-Mn 11.40 9.15 -2.25 -0.150 0.38496E+04 54 coesite -2.38 -4.22 -1.85 -0.616 0.31530E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.22 -1.66 -0.554 0.28384E+04 78 fayalite 14.05 9.48 -4.57 -0.652 0.77976E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.11 -4.03 -0.336 0.68851E+04 92 hercynite 17.28 12.60 -4.68 -0.312 0.79915E+04 98 kaolinite -1.33 -2.70 -1.37 -0.124 0.23310E+04 99 kyanite 4.88 1.52 -3.35 -0.335 0.57224E+04 101 laumontite 2.88 -1.18 -4.06 -0.271 0.69323E+04 102 lawsonite 9.62 7.27 -2.35 -0.156 0.40080E+04 105 lizardite 23.24 18.32 -4.93 -0.411 0.84149E+04 106 magnesite 0.69 -3.36 -4.05 -1.351 0.69195E+04 107 magnetite 20.09 19.42 -0.67 -0.055 0.11447E+04 110 magnesioferrite 26.21 21.49 -4.73 -0.386 0.80694E+04 113 margarite 17.32 13.02 -4.31 -0.172 0.73549E+04 121 paragonite 4.24 -0.50 -4.74 -0.279 0.80892E+04 128 periclase-Fe 11.63 6.85 -4.78 -1.194 0.81545E+04 142 pyrite -21.25 -23.85 -2.60 -0.612 0.44443E+04 143 pyrrhotite -4.26 -7.93 -3.67 -1.224 0.62688E+04 144 pyrrhotiteFe0.875 -6.02 -8.93 -2.91 -1.071 0.49720E+04 145 pyroxmangite 7.40 3.40 -4.00 -0.800 0.68291E+04 146 pyrophyllite -6.18 -11.14 -4.97 -0.310 0.84818E+04 147 quartz -2.99 -4.22 -1.23 -0.411 0.21057E+04 151 rhodochrosite -0.98 -4.66 -3.68 -1.228 0.62905E+04 152 rhodonite 7.45 3.40 -4.05 -0.809 0.69094E+04 155 siderite -2.61 -5.43 -2.82 -0.941 0.48206E+04 156 sillimanite 5.26 1.52 -3.74 -0.374 0.63805E+04 168 sudoite 21.08 16.67 -4.41 -0.142 0.75299E+04 177 topaz-H 4.62 1.52 -3.09 -0.281 0.52825E+04 178 tridymite -2.63 -4.22 -1.60 -0.532 0.27257E+04 181 troilite-low -4.41 -7.93 -3.52 -1.174 0.60116E+04 189 wollastonite 10.46 5.74 -4.72 -0.943 0.80543E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.22 -1.42 -0.473 0.24250E+04 205 nontronite-Ca 3.21 -0.34 -3.55 -0.230 0.60661E+04 206 nontronite-H 2.53 -1.98 -4.52 -0.303 0.77098E+04 207 nontronite-K 3.34 -1.51 -4.85 -0.311 0.82763E+04 208 nontronite-Mg 3.07 -0.51 -3.59 -0.233 0.61220E+04 209 nontronite-Na 3.52 -0.81 -4.33 -0.278 0.73955E+04 214 gypsum -4.96 -9.36 -4.40 -1.101 0.75175E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.85 -2.96 -0.740 0.50554E+04 240 silica-amorphous -2.09 -4.22 -2.13 -0.710 0.36392E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0062000 g New total amount of reactant added: 0.0064000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9763E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0064000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2635900E-03 Osmotic coef. = 0.9902 True ionic strength = .2655362E-03 Chg. balance for total moles = 0.9763E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.46137E-07 -7.3360 0.44342E-07 -7.3532 0.96111E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13258E-03 -3.8775 0.96099E+00 -0.0173 4 SO4-- 0.25329E-04 -4.5964 0.22797E-04 -4.6421 0.90003E+00 -0.0457 5 HCO3- 0.11945E-04 -4.9228 0.11479E-04 -4.9401 0.96102E+00 -0.0173 6 HS- 0.28991E-07 -7.5377 0.27861E-07 -7.5550 0.96099E+00 -0.0173 7 Al+++ 0.80814E-19 -19.0925 0.65185E-19 -19.1859 0.80660E+00 -0.0933 8 H4SiO4 0.61623E-04 -4.2103 0.61623E-04 -4.2103 0.10000E+01 0.0000 9 Ca++ 0.21612E-04 -4.6653 0.19448E-04 -4.7111 0.89990E+00 -0.0458 10 Mg++ 0.18069E-05 -5.7431 0.16259E-05 -5.7889 0.89982E+00 -0.0458 11 Fe++ 0.15052E-07 -7.8224 0.13544E-07 -7.8682 0.89984E+00 -0.0458 12 K+ 0.13583E-05 -5.8670 0.13054E-05 -5.8843 0.96102E+00 -0.0173 13 Na+ 0.16809E-03 -3.7745 0.16154E-03 -3.7917 0.96099E+00 -0.0173 14 Mn++ 0.99018E-07 -7.0043 0.89102E-07 -7.0501 0.89986E+00 -0.0458 15 HPO4-- 0.11020E-07 -7.9578 0.99187E-08 -8.0035 0.90004E+00 -0.0457 16 HSiO3- 0.13503E-05 -5.8696 0.12976E-05 -5.8868 0.96099E+00 -0.0173 17 Ca(HSiO3)+ 0.59805E-09 -9.2233 0.57474E-09 -9.2405 0.96103E+00 -0.0173 18 Mg(HSiO3)+ 0.62220E-10 -10.2061 0.59796E-10 -10.2233 0.96103E+00 -0.0173 19 NaHSiO3,aq 0.33902E-08 -8.4698 0.33902E-08 -8.4698 0.10000E+01 0.0000 20 AlO+ 0.46930E-11 -11.3285 0.45101E-11 -11.3458 0.96103E+00 -0.0173 21 AlOH+2 0.11066E-14 -14.9560 0.99582E-15 -15.0018 0.89988E+00 -0.0458 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.10523E-05 -5.9779 0.10112E-05 -5.9952 0.96096E+00 -0.0173 24 CH4,aq 0.13629E-13 -13.8655 0.13628E-13 -13.8656 0.99992E+00 0.0000 29 CO,aq 0.13415E-15 -15.8724 0.13415E-15 -15.8724 0.10000E+01 0.0000 30 CO2,aq 0.10878E-05 -5.9635 0.10877E-05 -5.9635 0.99992E+00 0.0000 31 CO3-2 0.25125E-07 -7.5999 0.22612E-07 -7.6457 0.89999E+00 -0.0458 32 CaCO3,aq 0.55143E-08 -8.2585 0.55143E-08 -8.2585 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.59300E-08 -8.2269 0.56989E-08 -8.2442 0.96103E+00 -0.0173 34 CaCl+ 0.43420E-08 -8.3623 0.41728E-08 -8.3796 0.96103E+00 -0.0173 35 CaCl2,aq 0.13144E-12 -12.8813 0.13144E-12 -12.8813 0.10000E+01 0.0000 36 CaOH+ 0.32526E-07 -7.4878 0.31259E-07 -7.5050 0.96103E+00 -0.0173 37 CaSO4,aq 0.14079E-06 -6.8514 0.14079E-06 -6.8514 0.10000E+01 0.0000 38 HCl,aq 0.10773E-11 -11.9677 0.10773E-11 -11.9677 0.10000E+01 0.0000 43 FeCl+ 0.29576E-11 -11.5291 0.28424E-11 -11.5463 0.96103E+00 -0.0173 44 FeCl2,aq 0.11931E-19 -19.9233 0.11931E-19 -19.9233 0.10000E+01 0.0000 46 FeO,aq 0.26773E-09 -9.5723 0.26773E-09 -9.5723 0.10000E+01 0.0000 47 FeOH+ 0.10346E-07 -7.9852 0.99428E-08 -8.0025 0.96103E+00 -0.0173 48 HFeO2- 0.65738E-10 -10.1822 0.63174E-10 -10.1995 0.96099E+00 -0.0173 49 FeO+ 0.35218E-12 -12.4532 0.33846E-12 -12.4705 0.96103E+00 -0.0173 50 FeOH+2 0.31850E-17 -17.4969 0.28661E-17 -17.5427 0.89988E+00 -0.0458 51 FeO2- 0.36652E-10 -10.4359 0.35223E-10 -10.4532 0.96099E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.49101E-08 -8.3089 0.49097E-08 -8.3089 0.99992E+00 0.0000 54 KCl,aq 0.31367E-11 -11.5035 0.31367E-11 -11.5035 0.10000E+01 0.0000 55 KHSO4,aq 0.37309E-17 -17.4282 0.37309E-17 -17.4282 0.10000E+01 0.0000 56 KOH,aq 0.12572E-10 -10.9006 0.12572E-10 -10.9006 0.10000E+01 0.0000 57 KSO4- 0.48052E-09 -9.3183 0.46178E-09 -9.3356 0.96099E+00 -0.0173 58 MgCO3,aq 0.11555E-09 -9.9372 0.11555E-09 -9.9372 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.50655E-09 -9.2954 0.48681E-09 -9.3126 0.96103E+00 -0.0173 60 MgCl+ 0.32899E-09 -9.4828 0.31617E-09 -9.5001 0.96103E+00 -0.0173 61 MgOH+ 0.15046E-07 -7.8226 0.14460E-07 -7.8398 0.96103E+00 -0.0173 63 MnO,aq 0.46930E-10 -10.3286 0.46930E-10 -10.3286 0.10000E+01 0.0000 64 MnOH+ 0.63227E-08 -8.1991 0.60763E-08 -8.2164 0.96103E+00 -0.0173 65 MnO2-2 0.88012E-18 -18.0555 0.79211E-18 -18.1012 0.89999E+00 -0.0458 66 HMnO2- 0.80074E-14 -14.0965 0.76950E-14 -14.1138 0.96099E+00 -0.0173 69 MnCl+ 0.75695E-10 -10.1209 0.72745E-10 -10.1382 0.96103E+00 -0.0173 70 MnSO4,aq 0.58640E-09 -9.2318 0.58640E-09 -9.2318 0.10000E+01 0.0000 71 NaCl,aq 0.70975E-08 -8.1489 0.70975E-08 -8.1489 0.10000E+01 0.0000 72 NaOH,aq 0.15652E-08 -8.8054 0.15652E-08 -8.8054 0.10000E+01 0.0000 74 OH- 0.13559E-04 -4.8678 0.13030E-04 -4.8851 0.96096E+00 -0.0173 79 HPO3-2 0.16862E-18 -18.7731 0.15176E-18 -18.8188 0.89999E+00 -0.0458 81 H2PO3- 0.14042E-19 -19.8526 0.13494E-19 -19.8698 0.96099E+00 -0.0173 82 H3PO4,aq 0.13640E-12 -12.8652 0.13640E-12 -12.8652 0.10000E+01 0.0000 83 H2PO4- 0.84426E-08 -8.0735 0.81134E-08 -8.0908 0.96101E+00 -0.0173 84 PO4-3 0.22604E-12 -12.6458 0.18250E-12 -12.7387 0.80739E+00 -0.0929 87 H2P2O7-2 0.57351E-17 -17.2415 0.51615E-17 -17.2872 0.89999E+00 -0.0458 88 HP2O7-3 0.28815E-16 -16.5404 0.23243E-16 -16.6337 0.80661E+00 -0.0933 89 P2O7-4 0.18087E-18 -18.7426 0.12522E-18 -18.9023 0.69235E+00 -0.1597 90 H2S,aq 0.38185E-08 -8.4181 0.38182E-08 -8.4181 0.99992E+00 0.0000 91 S2-2 0.38924E-17 -17.4098 0.35031E-17 -17.4555 0.89999E+00 -0.0458 96 SO2,aq 0.98284E-18 -18.0075 0.98284E-18 -18.0075 0.10000E+01 0.0000 97 SO3-2 0.16156E-13 -13.7917 0.14545E-13 -13.8373 0.90025E+00 -0.0456 98 HSO3- 0.42021E-13 -13.3765 0.40382E-13 -13.3938 0.96099E+00 -0.0173 99 HSO4- 0.10137E-08 -8.9941 0.97418E-09 -9.0114 0.96105E+00 -0.0173 101 S2O3-2 0.11361E-14 -14.9446 0.10225E-14 -14.9904 0.89999E+00 -0.0458 Charge balance for all species = 0.9764E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4613662E-07 -.1813538E-04 -.1827907E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999810E+06 0.0000 3 Cl- 0.1379627E-03 0.1379745E-03 0.4891527E+01 3.4757 4 SO4-- 0.2532885E-04 0.2547053E-04 0.2446698E+01 10.0642 5 HCO3- 0.1194509E-04 0.1307003E-04 0.7974832E+00 2.4131 6 HS- 0.2899145E-07 0.3400803E-07 0.1124694E-02 -0.2018 7 Al+++ 0.8081400E-19 0.1072520E-05 0.2893771E-01 2.8737 8 H4SiO4 0.6162301E-04 0.6297737E-04 0.6052992E+01 -4.2103 9 Ca++ 0.2161165E-04 0.2180134E-04 0.8737394E+00 9.9952 10 Mg++ 0.1806861E-05 0.1822920E-05 0.4431808E-01 8.9174 11 Fe++ 0.1505205E-07 0.2597016E-07 0.1450331E-02 6.8381 12 K+ 0.1358318E-05 0.1358814E-05 0.5313145E-01 1.4689 13 Na+ 0.1680929E-03 0.1681050E-03 0.3864634E+01 3.5615 14 Mn++ 0.9901814E-07 0.1060498E-06 0.5826067E-02 7.6563 15 HPO4-- 0.1102029E-07 0.1946323E-07 0.1868029E-02 6.7028 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.9293450E-04 -.1813534E-04 -.7479916E-04 0.0000000E+00 2 H2O 0.5550817E+02 0.5550813E+02 0.4373265E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2568184E-04 0.2547046E-04 0.2113738E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1773658E-06 0.3400795E-07 -.2113738E-06 0.0000000E+00 7 Al+++ 0.2086875E-04 0.1072518E-05 0.1979623E-04 0.0000000E+00 8 H4SiO4 0.6664181E-04 0.6297721E-04 0.3664597E-05 0.0000000E+00 9 Ca++ 0.2183197E-04 0.2180129E-04 0.3068218E-07 0.0000000E+00 10 Mg++ 0.5079365E-05 0.1822916E-05 0.3256449E-05 0.0000000E+00 11 Fe++ 0.4563255E-05 0.2597009E-07 0.4537285E-05 0.0000000E+00 12 K+ 0.1358811E-05 0.1358811E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1681046E-03 0.1681046E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1109670E-06 0.1060496E-06 0.4917432E-08 0.0000000E+00 15 HPO4-- 0.3787249E-07 0.1946318E-07 0.1840931E-07 0.0000000E+00 Chg. balance for solid moles: -.1628E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0064000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.6136E-08 -8.212 0.3082E-05 -5.511 0.1582 0.9795E-06 clinochlore 0.6513E-06 -6.186 0.3620E-03 -3.441 18.58 0.1377E-03 daphnite 0.5693E-06 -6.245 0.4062E-03 -3.391 20.85 0.1231E-03 chlorite-Mn 0.9835E-09 -9.007 0.6973E-06 -6.157 0.3579E-01 0.2222E-06 diaspore 0.1735E-04 -4.761 0.1041E-02 -2.983 53.44 0.3099E-03 hematite 0.8455E-06 -6.073 0.1350E-03 -3.870 6.931 0.2559E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5332E+00 0.5332E+00 1.0000 -0.273 daphnite 0.4660E+00 0.4660E+00 1.0000 -0.332 chlorite-Mn 0.8051E-03 0.8051E-03 1.0000 -3.094 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.001948 g Volume = 0.000597 cm3 Porosity: 99.9404% V(tot) - V(min): 0.10020E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0064000 g log = -2.1938 Original solution: 1000.0103000 g Original solution / Rock added: 156251.61 (Water/Rock Ratio), log = 5.1938 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1132E-03 1.0071 0.1164E-03 0.1155E-03 CH4,gas 0.1941E-10 1.0125 0.2006E-10 0.1981E-10 H2,gas 0.6313E-05 1.0005 0.6446E-05 0.6442E-05 H2S,gas 0.1033E-06 0.9960 0.1050E-06 0.1054E-06 S2,gas 0.9753E-23 1.0000 0.9952E-23 0.9952E-23 CO,gas 0.1959E-12 1.0000 0.1999E-12 0.1999E-12 SO3,gas 0.1661E-34 1.0000 0.1695E-34 0.1695E-34 SO2,gas 0.4165E-17 1.0000 0.4250E-17 0.4250E-17 HCl,gas 0.1863E-14 1.0000 0.1901E-14 0.1901E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 0.00000E+00 47 daphnite 28.97 28.97 0.00 0.000 0.00000E+00 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.12132E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 0.00 0.000 -0.60662E-11 The following gases and minerals are presently EXCLUDED from matrix (Gases and minerals with log(Q/K) less than -5 are not listed below) Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.29 -5.63 -1.878 0.96184E+04 -3.934 3 CH4,gas 4.54 -7.85 -12.40 -3.099 0.21167E+05 -10.698 4 H2,gas 8.00 1.11 -6.89 -3.937 0.11764E+05 -5.191 5 H2S,gas -6.23 -14.91 -8.68 -4.339 0.14817E+05 -6.979 6 S2,gas -7.34 -32.04 -24.70 -3.800 0.42176E+05 -23.002 7 CO,gas 3.21 -11.18 -14.40 -4.430 0.24584E+05 -12.699 8 SO3,gas 17.12 -19.35 -36.47 -9.117 0.62271E+05 -34.771 9 SO2,gas 0.83 -18.24 -19.07 -5.085 0.32562E+05 -17.372 10 HCl,gas 5.19 -11.23 -16.42 -8.210 0.28037E+05 -14.721 21 andalusite 5.00 1.54 -3.46 -0.346 0.59153E+04 24 anhydrite -5.32 -9.35 -4.04 -2.018 0.68921E+04 35 aragonite 0.97 -2.30 -3.26 -1.088 0.55741E+04 36 brucite 12.57 8.92 -3.65 -0.730 0.62342E+04 37 calcite 0.81 -2.30 -3.11 -1.037 0.53099E+04 40 carpholite-Mg 8.58 6.24 -2.34 -0.156 0.39917E+04 41 carpholite-Fe 6.71 4.17 -2.55 -0.170 0.43500E+04 50 chloritoid-Mg 13.20 10.45 -2.74 -0.183 0.46838E+04 51 chloritoid-Fe 9.17 8.38 -0.80 -0.053 0.13632E+04 52 chloritoid-Mn 11.40 9.19 -2.21 -0.147 0.37696E+04 54 coesite -2.38 -4.21 -1.83 -0.611 0.31318E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.21 -1.65 -0.550 0.28172E+04 78 fayalite 14.05 9.47 -4.58 -0.654 0.78198E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.09 -4.05 -0.337 0.69078E+04 92 hercynite 17.28 12.59 -4.69 -0.313 0.80132E+04 98 kaolinite -1.33 -2.67 -1.34 -0.122 0.22886E+04 99 kyanite 4.88 1.54 -3.34 -0.334 0.57012E+04 101 laumontite 2.88 -1.10 -3.98 -0.265 0.67988E+04 102 lawsonite 9.62 7.32 -2.29 -0.153 0.39168E+04 105 lizardite 23.24 18.33 -4.91 -0.409 0.83871E+04 106 magnesite 0.69 -3.38 -4.07 -1.355 0.69433E+04 107 magnetite 20.09 19.40 -0.68 -0.056 0.11663E+04 110 magnesioferrite 26.21 21.48 -4.73 -0.386 0.80742E+04 113 margarite 17.32 13.07 -4.25 -0.170 0.72637E+04 121 paragonite 4.24 -0.45 -4.69 -0.276 0.80041E+04 128 periclase-Fe 11.63 6.84 -4.79 -1.197 0.81762E+04 142 pyrite -21.25 -24.09 -2.84 -0.669 0.48516E+04 143 pyrrhotite -4.26 -8.07 -3.81 -1.270 0.65050E+04 144 pyrrhotiteFe0.875 -6.02 -9.06 -3.05 -1.120 0.52002E+04 145 pyroxmangite 7.40 3.45 -3.95 -0.791 0.67491E+04 146 pyrophyllite -6.18 -11.09 -4.92 -0.307 0.83971E+04 147 quartz -2.99 -4.21 -1.22 -0.407 0.20845E+04 151 rhodochrosite -0.98 -4.64 -3.66 -1.220 0.62505E+04 152 rhodonite 7.45 3.45 -4.00 -0.800 0.68293E+04 155 siderite -2.61 -5.46 -2.85 -0.949 0.48612E+04 156 sillimanite 5.26 1.54 -3.72 -0.372 0.63593E+04 168 sudoite 21.08 16.70 -4.38 -0.141 0.74761E+04 177 topaz-H 4.62 1.54 -3.08 -0.280 0.52613E+04 178 tridymite -2.63 -4.21 -1.58 -0.528 0.27045E+04 181 troilite-low -4.41 -8.07 -3.66 -1.220 0.62478E+04 189 wollastonite 10.46 5.78 -4.68 -0.935 0.79844E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.21 -1.41 -0.469 0.24038E+04 205 nontronite-Ca 3.21 -0.29 -3.50 -0.227 0.59804E+04 206 nontronite-H 2.53 -1.94 -4.47 -0.300 0.76321E+04 207 nontronite-K 3.34 -1.45 -4.79 -0.308 0.81841E+04 208 nontronite-Mg 3.07 -0.47 -3.54 -0.230 0.60451E+04 209 nontronite-Na 3.52 -0.76 -4.28 -0.275 0.73106E+04 214 gypsum -4.96 -9.35 -4.40 -1.100 0.75097E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.84 -2.97 -0.743 0.50771E+04 240 silica-amorphous -2.09 -4.21 -2.12 -0.706 0.36180E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0064000 g New total amount of reactant added: 0.0066000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9764E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0066000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2641163E-03 Osmotic coef. = 0.9902 True ionic strength = .2661825E-03 Chg. balance for total moles = 0.9764E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.44866E-07 -7.3481 0.43120E-07 -7.3653 0.96108E+00 -0.0172 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13258E-03 -3.8775 0.96097E+00 -0.0173 4 SO4-- 0.25335E-04 -4.5963 0.22800E-04 -4.6421 0.89994E+00 -0.0458 5 HCO3- 0.11972E-04 -4.9218 0.11505E-04 -4.9391 0.96099E+00 -0.0173 6 HS- 0.22274E-07 -7.6522 0.21405E-07 -7.6695 0.96097E+00 -0.0173 7 Al+++ 0.74333E-19 -19.1288 0.59943E-19 -19.2223 0.80642E+00 -0.0934 8 H4SiO4 0.63369E-04 -4.1981 0.63369E-04 -4.1981 0.10000E+01 0.0000 9 Ca++ 0.21835E-04 -4.6609 0.19647E-04 -4.7067 0.89981E+00 -0.0458 10 Mg++ 0.16987E-05 -5.7699 0.15284E-05 -5.8158 0.89973E+00 -0.0459 11 Fe++ 0.13822E-07 -7.8594 0.12436E-07 -7.9053 0.89975E+00 -0.0459 12 K+ 0.14008E-05 -5.8536 0.13461E-05 -5.8709 0.96100E+00 -0.0173 13 Na+ 0.16834E-03 -3.7738 0.16177E-03 -3.7911 0.96096E+00 -0.0173 14 Mn++ 0.10127E-06 -6.9945 0.91118E-07 -7.0404 0.89976E+00 -0.0459 15 HPO4-- 0.10440E-07 -7.9813 0.93955E-08 -8.0271 0.89994E+00 -0.0458 16 HSiO3- 0.14280E-05 -5.8453 0.13722E-05 -5.8626 0.96097E+00 -0.0173 17 Ca(HSiO3)+ 0.63889E-09 -9.1946 0.61398E-09 -9.2118 0.96100E+00 -0.0173 18 Mg(HSiO3)+ 0.61854E-10 -10.2086 0.59442E-10 -10.2259 0.96100E+00 -0.0173 19 NaHSiO3,aq 0.35903E-08 -8.4449 0.35903E-08 -8.4449 0.10000E+01 0.0000 20 AlO+ 0.45638E-11 -11.3407 0.43859E-11 -11.3579 0.96100E+00 -0.0173 21 AlOH+2 0.10466E-14 -14.9802 0.94170E-15 -15.0261 0.89978E+00 -0.0459 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.10821E-05 -5.9657 0.10398E-05 -5.9830 0.96093E+00 -0.0173 24 CH4,aq 0.10492E-13 -13.9791 0.10492E-13 -13.9792 0.99992E+00 0.0000 29 CO,aq 0.12326E-15 -15.9092 0.12326E-15 -15.9092 0.10000E+01 0.0000 30 CO2,aq 0.10601E-05 -5.9746 0.10600E-05 -5.9747 0.99992E+00 0.0000 31 CO3-2 0.25897E-07 -7.5868 0.23304E-07 -7.6326 0.89990E+00 -0.0458 32 CaCO3,aq 0.57411E-08 -8.2410 0.57411E-08 -8.2410 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.60038E-08 -8.2216 0.57697E-08 -8.2388 0.96100E+00 -0.0173 34 CaCl+ 0.43863E-08 -8.3579 0.42153E-08 -8.3752 0.96100E+00 -0.0173 35 CaCl2,aq 0.13277E-12 -12.8769 0.13277E-12 -12.8769 0.10000E+01 0.0000 36 CaOH+ 0.33790E-07 -7.4712 0.32473E-07 -7.4885 0.96100E+00 -0.0173 37 CaSO4,aq 0.14225E-06 -6.8470 0.14225E-06 -6.8470 0.10000E+01 0.0000 38 HCl,aq 0.10476E-11 -11.9798 0.10476E-11 -11.9798 0.10000E+01 0.0000 43 FeCl+ 0.27156E-11 -11.5661 0.26097E-11 -11.5834 0.96100E+00 -0.0173 44 FeCl2,aq 0.10954E-19 -19.9604 0.10954E-19 -19.9604 0.10000E+01 0.0000 46 FeO,aq 0.25995E-09 -9.5851 0.25995E-09 -9.5851 0.10000E+01 0.0000 47 FeOH+ 0.97690E-08 -8.0102 0.93880E-08 -8.0274 0.96100E+00 -0.0173 48 HFeO2- 0.65639E-10 -10.1828 0.63077E-10 -10.2001 0.96097E+00 -0.0173 49 FeO+ 0.34249E-12 -12.4654 0.32913E-12 -12.4826 0.96100E+00 -0.0173 50 FeOH+2 0.30122E-17 -17.5211 0.27103E-17 -17.5670 0.89978E+00 -0.0459 51 FeO2- 0.37692E-10 -10.4238 0.36221E-10 -10.4410 0.96097E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.46290E-08 -8.3345 0.46287E-08 -8.3345 0.99992E+00 0.0000 54 KCl,aq 0.32346E-11 -11.4902 0.32346E-11 -11.4902 0.10000E+01 0.0000 55 KHSO4,aq 0.37419E-17 -17.4269 0.37419E-17 -17.4269 0.10000E+01 0.0000 56 KOH,aq 0.13332E-10 -10.8751 0.13332E-10 -10.8751 0.10000E+01 0.0000 57 KSO4- 0.49561E-09 -9.3049 0.47626E-09 -9.3222 0.96097E+00 -0.0173 58 MgCO3,aq 0.11195E-09 -9.9510 0.11195E-09 -9.9510 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.47724E-09 -9.3213 0.45863E-09 -9.3385 0.96100E+00 -0.0173 60 MgCl+ 0.30927E-09 -9.5097 0.29721E-09 -9.5269 0.96100E+00 -0.0173 61 MgOH+ 0.14546E-07 -7.8373 0.13978E-07 -7.8545 0.96100E+00 -0.0173 63 MnO,aq 0.50750E-10 -10.2946 0.50750E-10 -10.2946 0.10000E+01 0.0000 64 MnOH+ 0.66491E-08 -8.1772 0.63898E-08 -8.1945 0.96100E+00 -0.0173 65 MnO2-2 0.10066E-17 -17.9972 0.90582E-18 -18.0430 0.89990E+00 -0.0458 66 HMnO2- 0.89048E-14 -14.0504 0.85572E-14 -14.0677 0.96097E+00 -0.0173 69 MnCl+ 0.77408E-10 -10.1112 0.74389E-10 -10.1285 0.96100E+00 -0.0173 70 MnSO4,aq 0.59976E-09 -9.2220 0.59976E-09 -9.2220 0.10000E+01 0.0000 71 NaCl,aq 0.71077E-08 -8.1483 0.71077E-08 -8.1483 0.10000E+01 0.0000 72 NaOH,aq 0.16119E-08 -8.7927 0.16119E-08 -8.7927 0.10000E+01 0.0000 74 OH- 0.13944E-04 -4.8556 0.13399E-04 -4.8729 0.96093E+00 -0.0173 79 HPO3-2 0.15060E-18 -18.8222 0.13553E-18 -18.8680 0.89990E+00 -0.0458 81 H2PO3- 0.12195E-19 -19.9138 0.11719E-19 -19.9311 0.96097E+00 -0.0173 82 H3PO4,aq 0.12218E-12 -12.9130 0.12218E-12 -12.9130 0.10000E+01 0.0000 83 H2PO4- 0.77771E-08 -8.1092 0.74737E-08 -8.1265 0.96098E+00 -0.0173 84 PO4-3 0.22024E-12 -12.6571 0.17778E-12 -12.7501 0.80720E+00 -0.0930 87 H2P2O7-2 0.48669E-17 -17.3127 0.43797E-17 -17.3586 0.89990E+00 -0.0458 88 HP2O7-3 0.25149E-16 -16.5995 0.20281E-16 -16.6929 0.80642E+00 -0.0934 89 P2O7-4 0.16236E-18 -18.7895 0.11236E-18 -18.9494 0.69206E+00 -0.1599 90 H2S,aq 0.28528E-08 -8.5447 0.28526E-08 -8.5448 0.99992E+00 0.0000 91 S2-2 0.24372E-17 -17.6131 0.21933E-17 -17.6589 0.89990E+00 -0.0458 96 SO2,aq 0.87634E-18 -18.0573 0.87634E-18 -18.0573 0.10000E+01 0.0000 97 SO3-2 0.15235E-13 -13.8172 0.13714E-13 -13.8628 0.90016E+00 -0.0457 98 HSO3- 0.38530E-13 -13.4142 0.37026E-13 -13.4315 0.96097E+00 -0.0173 99 HSO4- 0.98590E-09 -9.0062 0.94747E-09 -9.0234 0.96102E+00 -0.0173 101 S2O3-2 0.84898E-15 -15.0711 0.76400E-15 -15.1169 0.89990E+00 -0.0458 Charge balance for all species = 0.9764E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4486647E-07 -.1874929E-04 -.1889783E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999808E+06 0.0000 3 Cl- 0.1379626E-03 0.1379745E-03 0.4891527E+01 3.4878 4 SO4-- 0.2533508E-04 0.2547828E-04 0.2447442E+01 10.0886 5 HCO3- 0.1197169E-04 0.1307003E-04 0.7974831E+00 2.4262 6 HS- 0.2227399E-07 0.2625449E-07 0.8682736E-03 -0.3042 7 Al+++ 0.7433322E-19 0.1102366E-05 0.2974296E-01 2.8737 8 H4SiO4 0.6336944E-04 0.6480169E-04 0.6228333E+01 -4.1981 9 Ca++ 0.2183452E-04 0.2202733E-04 0.8827960E+00 10.0239 10 Mg++ 0.1698713E-05 0.1714219E-05 0.4167537E-01 8.9149 11 Fe++ 0.1382196E-07 0.2415592E-07 0.1349012E-02 6.8253 12 K+ 0.1400765E-05 0.1401277E-05 0.5479181E-01 1.4944 13 Na+ 0.1683437E-03 0.1683560E-03 0.3870405E+01 3.5742 14 Mn++ 0.1012692E-06 0.1086463E-06 0.5968707E-02 7.6902 15 HPO4-- 0.1044016E-07 0.1821764E-07 0.1748481E-02 6.7036 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.9624620E-04 -.1874924E-04 -.7749696E-04 0.0000000E+00 2 H2O 0.5550817E+02 0.5550812E+02 0.4513254E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2568738E-04 0.2547822E-04 0.2091629E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1829085E-06 0.2625443E-07 -.2091629E-06 0.0000000E+00 7 Al+++ 0.2152089E-04 0.1102363E-05 0.2041853E-04 0.0000000E+00 8 H4SiO4 0.6872437E-04 0.6480153E-04 0.3922840E-05 0.0000000E+00 9 Ca++ 0.2206200E-04 0.2202727E-04 0.3473069E-07 0.0000000E+00 10 Mg++ 0.5238095E-05 0.1714215E-05 0.3523881E-05 0.0000000E+00 11 Fe++ 0.4705857E-05 0.2415585E-07 0.4681701E-05 0.0000000E+00 12 K+ 0.1401274E-05 0.1401274E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1683556E-03 0.1683556E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1144347E-06 0.1086460E-06 0.5788721E-08 0.0000000E+00 15 HPO4-- 0.3905601E-07 0.1821759E-07 0.2083841E-07 0.0000000E+00 Chg. balance for solid moles: 0.7279E-22 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0066000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.6946E-08 -8.158 0.3489E-05 -5.457 0.1721 0.1109E-05 clinochlore 0.7048E-06 -6.152 0.3917E-03 -3.407 19.33 0.1490E-03 daphnite 0.6017E-06 -6.221 0.4293E-03 -3.367 21.18 0.1301E-03 chlorite-Mn 0.1158E-08 -8.936 0.8208E-06 -6.086 0.4049E-01 0.2616E-06 diaspore 0.1780E-04 -4.749 0.1068E-02 -2.971 52.69 0.3180E-03 hematite 0.8367E-06 -6.077 0.1336E-03 -3.874 6.592 0.2532E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5390E+00 0.5390E+00 1.0000 -0.268 daphnite 0.4601E+00 0.4601E+00 1.0000 -0.337 chlorite-Mn 0.8854E-03 0.8854E-03 1.0000 -3.053 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002027 g Volume = 0.000624 cm3 Porosity: 99.9378% V(tot) - V(min): 0.10020E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0066000 g log = -2.1805 Original solution: 1000.0103000 g Original solution / Rock added: 151516.71 (Water/Rock Ratio), log = 5.1805 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1104E-03 1.0071 0.1134E-03 0.1126E-03 CH4,gas 0.1495E-10 1.0125 0.1544E-10 0.1525E-10 H2,gas 0.5952E-05 1.0005 0.6077E-05 0.6074E-05 H2S,gas 0.7715E-07 0.9960 0.7842E-07 0.7873E-07 S2,gas 0.6125E-23 1.0000 0.6250E-23 0.6250E-23 CO,gas 0.1800E-12 1.0000 0.1837E-12 0.1837E-12 SO3,gas 0.1571E-34 1.0000 0.1603E-34 0.1603E-34 SO2,gas 0.3714E-17 1.0000 0.3790E-17 0.3790E-17 HCl,gas 0.1811E-14 1.0000 0.1848E-14 0.1848E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.60662E-10 47 daphnite 28.97 28.97 0.00 0.000 0.72794E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.24265E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.30 -5.64 -1.881 0.96375E+04 -3.945 3 CH4,gas 4.54 -7.97 -12.51 -3.128 0.21361E+05 -10.811 4 H2,gas 8.00 1.08 -6.92 -3.952 0.11808E+05 -5.216 5 H2S,gas -6.23 -15.03 -8.80 -4.402 0.15034E+05 -7.106 6 S2,gas -7.34 -32.24 -24.90 -3.831 0.42521E+05 -23.204 7 CO,gas 3.21 -11.22 -14.43 -4.442 0.24647E+05 -12.736 8 SO3,gas 17.12 -19.37 -36.49 -9.124 0.62313E+05 -34.795 9 SO2,gas 0.83 -18.29 -19.12 -5.099 0.32648E+05 -17.421 10 HCl,gas 5.19 -11.24 -16.43 -8.216 0.28057E+05 -14.733 21 andalusite 5.00 1.55 -3.45 -0.345 0.58946E+04 24 anhydrite -5.32 -9.35 -4.03 -2.016 0.68845E+04 35 aragonite 0.97 -2.28 -3.25 -1.082 0.55442E+04 36 brucite 12.57 8.91 -3.65 -0.731 0.62386E+04 37 calcite 0.81 -2.28 -3.09 -1.031 0.52800E+04 40 carpholite-Mg 8.58 6.27 -2.32 -0.154 0.39546E+04 41 carpholite-Fe 6.71 4.18 -2.54 -0.169 0.43304E+04 50 chloritoid-Mg 13.20 10.46 -2.73 -0.182 0.46675E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13643E+04 52 chloritoid-Mn 11.40 9.24 -2.16 -0.144 0.36908E+04 54 coesite -2.38 -4.20 -1.82 -0.607 0.31111E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.20 -1.64 -0.546 0.27965E+04 78 fayalite 14.05 9.45 -4.59 -0.656 0.78428E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.08 -4.06 -0.338 0.69319E+04 92 hercynite 17.28 12.57 -4.71 -0.314 0.80351E+04 98 kaolinite -1.33 -2.65 -1.32 -0.120 0.22472E+04 99 kyanite 4.88 1.55 -3.33 -0.333 0.56805E+04 101 laumontite 2.88 -1.02 -3.90 -0.260 0.66669E+04 102 lawsonite 9.62 7.38 -2.24 -0.149 0.38264E+04 105 lizardite 23.24 18.35 -4.90 -0.408 0.83589E+04 106 magnesite 0.69 -3.39 -4.08 -1.360 0.69668E+04 107 magnetite 20.09 19.39 -0.70 -0.057 0.11882E+04 110 magnesioferrite 26.21 21.48 -4.73 -0.386 0.80786E+04 113 margarite 17.32 13.12 -4.20 -0.168 0.71733E+04 121 paragonite 4.24 -0.40 -4.64 -0.273 0.79201E+04 128 periclase-Fe 11.63 6.83 -4.80 -1.200 0.81980E+04 142 pyrite -21.25 -24.33 -3.08 -0.725 0.52621E+04 143 pyrrhotite -4.26 -8.21 -3.95 -1.316 0.67431E+04 144 pyrrhotiteFe0.875 -6.02 -9.20 -3.18 -1.170 0.54301E+04 145 pyroxmangite 7.40 3.49 -3.91 -0.781 0.66703E+04 146 pyrophyllite -6.18 -11.05 -4.87 -0.304 0.83142E+04 147 quartz -2.99 -4.20 -1.21 -0.403 0.20638E+04 151 rhodochrosite -0.98 -4.61 -3.64 -1.213 0.62116E+04 152 rhodonite 7.45 3.49 -3.95 -0.791 0.67506E+04 155 siderite -2.61 -5.48 -2.87 -0.957 0.49021E+04 156 sillimanite 5.26 1.55 -3.71 -0.371 0.63386E+04 168 sudoite 21.08 16.73 -4.35 -0.140 0.74227E+04 177 topaz-H 4.62 1.55 -3.07 -0.279 0.52406E+04 178 tridymite -2.63 -4.20 -1.57 -0.524 0.26838E+04 181 troilite-low -4.41 -8.21 -3.80 -1.266 0.64859E+04 187 wairakite 3.95 -1.02 -4.97 -0.292 0.84889E+04 189 wollastonite 10.46 5.83 -4.64 -0.927 0.79147E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.20 -1.40 -0.465 0.23831E+04 205 nontronite-Ca 3.21 -0.24 -3.45 -0.224 0.58962E+04 206 nontronite-H 2.53 -1.89 -4.43 -0.297 0.75561E+04 207 nontronite-K 3.34 -1.40 -4.74 -0.304 0.80937E+04 208 nontronite-Mg 3.07 -0.42 -3.50 -0.227 0.59698E+04 209 nontronite-Na 3.52 -0.71 -4.23 -0.272 0.72274E+04 214 gypsum -4.96 -9.35 -4.39 -1.098 0.75021E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.83 -2.99 -0.747 0.50989E+04 240 silica-amorphous -2.09 -4.20 -2.11 -0.702 0.35973E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0066000 g New total amount of reactant added: 0.0068000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9764E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Magmatic gas scrubbing preliminary calculation. React meteoric water with andesite, Getahun et al. 1996 J. Volc. Geotherm. Res. 71(73-107). Table 1 page 82 sample MAF-1 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0068000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2646580E-03 Osmotic coef. = 0.9902 True ionic strength = .2668475E-03 Chg. balance for total moles = 0.9764E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.43629E-07 -7.3602 0.41930E-07 -7.3775 0.96106E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13257E-03 -3.8775 0.96094E+00 -0.0173 4 SO4-- 0.25339E-04 -4.5962 0.22802E-04 -4.6420 0.89984E+00 -0.0458 5 HCO3- 0.11998E-04 -4.9209 0.11529E-04 -4.9382 0.96097E+00 -0.0173 6 HS- 0.17139E-07 -7.7660 0.16470E-07 -7.7833 0.96094E+00 -0.0173 7 Al+++ 0.68361E-19 -19.1652 0.55114E-19 -19.2587 0.80622E+00 -0.0935 8 H4SiO4 0.65125E-04 -4.1863 0.65125E-04 -4.1863 0.10000E+01 0.0000 9 Ca++ 0.22057E-04 -4.6564 0.19845E-04 -4.7023 0.89972E+00 -0.0459 10 Mg++ 0.15973E-05 -5.7966 0.14369E-05 -5.8426 0.89963E+00 -0.0459 11 Fe++ 0.12694E-07 -7.8964 0.11420E-07 -7.9423 0.89965E+00 -0.0459 12 K+ 0.14432E-05 -5.8407 0.13869E-05 -5.8580 0.96097E+00 -0.0173 13 Na+ 0.16859E-03 -3.7732 0.16201E-03 -3.7905 0.96094E+00 -0.0173 14 Mn++ 0.10342E-06 -6.9854 0.93045E-07 -7.0313 0.89967E+00 -0.0459 15 HPO4-- 0.98916E-08 -8.0047 0.89009E-08 -8.0506 0.89985E+00 -0.0458 16 HSiO3- 0.15092E-05 -5.8212 0.14503E-05 -5.8385 0.96094E+00 -0.0173 17 Ca(HSiO3)+ 0.68208E-09 -9.1662 0.65546E-09 -9.1835 0.96098E+00 -0.0173 18 Mg(HSiO3)+ 0.61463E-10 -10.2114 0.59065E-10 -10.2287 0.96098E+00 -0.0173 19 NaHSiO3,aq 0.38001E-08 -8.4202 0.38001E-08 -8.4202 0.10000E+01 0.0000 20 AlO+ 0.44379E-11 -11.3528 0.42648E-11 -11.3701 0.96098E+00 -0.0173 21 AlOH+2 0.98970E-15 -15.0045 0.89042E-15 -15.0504 0.89969E+00 -0.0459 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.11129E-05 -5.9536 0.10694E-05 -5.9709 0.96091E+00 -0.0173 24 CH4,aq 0.80900E-14 -14.0921 0.80893E-14 -14.0921 0.99992E+00 0.0000 29 CO,aq 0.11328E-15 -15.9458 0.11328E-15 -15.9458 0.10000E+01 0.0000 30 CO2,aq 0.10331E-05 -5.9859 0.10330E-05 -5.9859 0.99992E+00 0.0000 31 CO3-2 0.26692E-07 -7.5736 0.24017E-07 -7.6195 0.89981E+00 -0.0459 32 CaCO3,aq 0.59765E-08 -8.2236 0.59765E-08 -8.2236 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.60777E-08 -8.2163 0.58405E-08 -8.2335 0.96098E+00 -0.0173 34 CaCl+ 0.44307E-08 -8.3535 0.42578E-08 -8.3708 0.96098E+00 -0.0173 35 CaCl2,aq 0.13411E-12 -12.8726 0.13411E-12 -12.8726 0.10000E+01 0.0000 36 CaOH+ 0.35102E-07 -7.4547 0.33732E-07 -7.4720 0.96098E+00 -0.0173 37 CaSO4,aq 0.14369E-06 -6.8426 0.14369E-06 -6.8426 0.10000E+01 0.0000 38 HCl,aq 0.10186E-11 -11.9920 0.10186E-11 -11.9920 0.10000E+01 0.0000 43 FeCl+ 0.24937E-11 -11.6032 0.23964E-11 -11.6204 0.96098E+00 -0.0173 44 FeCl2,aq 0.10058E-19 -19.9975 0.10058E-19 -19.9975 0.10000E+01 0.0000 46 FeO,aq 0.25245E-09 -9.5978 0.25245E-09 -9.5978 0.10000E+01 0.0000 47 FeOH+ 0.92255E-08 -8.0350 0.88655E-08 -8.0523 0.96098E+00 -0.0173 48 HFeO2- 0.65557E-10 -10.1834 0.62997E-10 -10.2007 0.96094E+00 -0.0173 49 FeO+ 0.33304E-12 -12.4775 0.32005E-12 -12.4948 0.96098E+00 -0.0173 50 FeOH+2 0.28485E-17 -17.5454 0.25627E-17 -17.5913 0.89969E+00 -0.0459 51 FeO2- 0.38763E-10 -10.4116 0.37249E-10 -10.4289 0.96094E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.43658E-08 -8.3599 0.43655E-08 -8.3600 0.99992E+00 0.0000 54 KCl,aq 0.33324E-11 -11.4772 0.33324E-11 -11.4772 0.10000E+01 0.0000 55 KHSO4,aq 0.37490E-17 -17.4261 0.37490E-17 -17.4261 0.10000E+01 0.0000 56 KOH,aq 0.14126E-10 -10.8500 0.14126E-10 -10.8500 0.10000E+01 0.0000 57 KSO4- 0.51066E-09 -9.2919 0.49072E-09 -9.3092 0.96094E+00 -0.0173 58 MgCO3,aq 0.10847E-09 -9.9647 0.10847E-09 -9.9647 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.44967E-09 -9.3471 0.43212E-09 -9.3644 0.96098E+00 -0.0173 60 MgCl+ 0.29076E-09 -9.5365 0.27942E-09 -9.5537 0.96098E+00 -0.0173 61 MgOH+ 0.14064E-07 -7.8519 0.13515E-07 -7.8692 0.96098E+00 -0.0173 63 MnO,aq 0.54807E-10 -10.2612 0.54807E-10 -10.2612 0.10000E+01 0.0000 64 MnOH+ 0.69827E-08 -8.1560 0.67102E-08 -8.1733 0.96098E+00 -0.0173 65 MnO2-2 0.11498E-17 -17.9394 0.10346E-17 -17.9852 0.89981E+00 -0.0459 66 HMnO2- 0.98901E-14 -14.0048 0.95038E-14 -14.0221 0.96094E+00 -0.0173 69 MnCl+ 0.79045E-10 -10.1021 0.75960E-10 -10.1194 0.96098E+00 -0.0173 70 MnSO4,aq 0.61248E-09 -9.2129 0.61248E-09 -9.2129 0.10000E+01 0.0000 71 NaCl,aq 0.71179E-08 -8.1476 0.71179E-08 -8.1476 0.10000E+01 0.0000 72 NaOH,aq 0.16601E-08 -8.7799 0.16601E-08 -8.7799 0.10000E+01 0.0000 74 OH- 0.14340E-04 -4.8434 0.13780E-04 -4.8608 0.96091E+00 -0.0173 79 HPO3-2 0.13457E-18 -18.8710 0.12109E-18 -18.9169 0.89981E+00 -0.0459 81 H2PO3- 0.10595E-19 -19.9749 0.10182E-19 -19.9922 0.96094E+00 -0.0173 82 H3PO4,aq 0.10945E-12 -12.9608 0.10945E-12 -12.9608 0.10000E+01 0.0000 83 H2PO4- 0.71645E-08 -8.1448 0.68848E-08 -8.1621 0.96096E+00 -0.0173 84 PO4-3 0.21462E-12 -12.6683 0.17320E-12 -12.7615 0.80701E+00 -0.0931 87 H2P2O7-2 0.41305E-17 -17.3840 0.37166E-17 -17.4298 0.89981E+00 -0.0459 88 HP2O7-3 0.21953E-16 -16.6585 0.17699E-16 -16.7520 0.80623E+00 -0.0935 89 P2O7-4 0.14577E-18 -18.8363 0.10084E-18 -18.9964 0.69177E+00 -0.1600 90 H2S,aq 0.21344E-08 -8.6707 0.21343E-08 -8.6708 0.99992E+00 0.0000 91 S2-2 0.15301E-17 -17.8153 0.13768E-17 -17.8611 0.89981E+00 -0.0459 96 SO2,aq 0.78155E-18 -18.1070 0.78155E-18 -18.1070 0.10000E+01 0.0000 97 SO3-2 0.14371E-13 -13.8425 0.12935E-13 -13.8882 0.90007E+00 -0.0457 98 HSO3- 0.35339E-13 -13.4517 0.33959E-13 -13.4690 0.96094E+00 -0.0173 99 HSO4- 0.95877E-09 -9.0183 0.92138E-09 -9.0356 0.96100E+00 -0.0173 101 S2O3-2 0.63531E-15 -15.1970 0.57166E-15 -15.2429 0.89981E+00 -0.0459 Charge balance for all species = 0.9764E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4362893E-07 -.1938139E-04 -.1953494E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999806E+06 0.0000 3 Cl- 0.1379626E-03 0.1379745E-03 0.4891526E+01 3.4999 4 SO4-- 0.2533949E-04 0.2548420E-04 0.2448010E+01 10.1129 5 HCO3- 0.1199768E-04 0.1307003E-04 0.7974830E+00 2.4393 6 HS- 0.1713888E-07 0.2033509E-07 0.6725103E-03 -0.4058 7 Al+++ 0.6836138E-19 0.1133119E-05 0.3057272E-01 2.8737 8 H4SiO4 0.6512510E-04 0.6663888E-04 0.6404910E+01 -4.1863 9 Ca++ 0.2205749E-04 0.2225345E-04 0.8918582E+00 10.0526 10 Mg++ 0.1597260E-05 0.1612234E-05 0.3919596E-01 8.9124 11 Fe++ 0.1269364E-07 0.2247737E-07 0.1255272E-02 6.8126 12 K+ 0.1443212E-05 0.1443741E-05 0.5645216E-01 1.5195 13 Na+ 0.1685945E-03 0.1686071E-03 0.3876176E+01 3.5870 14 Mn++ 0.1034213E-06 0.1111503E-06 0.6106271E-02 7.7236 15 HPO4-- 0.9891563E-08 0.1705636E-07 0.1637024E-02 6.7044 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.9955790E-04 -.1938134E-04 -.8017656E-04 0.0000000E+00 2 H2O 0.5550816E+02 0.5550812E+02 0.4653669E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2569292E-04 0.2548413E-04 0.2087862E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1884512E-06 0.2033504E-07 -.2087862E-06 0.0000000E+00 7 Al+++ 0.2217304E-04 0.1133116E-05 0.2103993E-04 0.0000000E+00 8 H4SiO4 0.7080692E-04 0.6663870E-04 0.4168223E-05 0.0000000E+00 9 Ca++ 0.2229203E-04 0.2225339E-04 0.3863868E-07 0.0000000E+00 10 Mg++ 0.5396825E-05 0.1612230E-05 0.3784595E-05 0.0000000E+00 11 Fe++ 0.4848458E-05 0.2247732E-07 0.4825981E-05 0.0000000E+00 12 K+ 0.1443737E-05 0.1443737E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1686067E-03 0.1686067E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1179025E-06 0.1111501E-06 0.6752397E-08 0.0000000E+00 15 HPO4-- 0.4023952E-07 0.1705632E-07 0.2318321E-07 0.0000000E+00 Chg. balance for solid moles: 0.7319E-20 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0068000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.7728E-08 -8.112 0.3882E-05 -5.411 0.1844 0.1233E-05 clinochlore 0.7569E-06 -6.121 0.4207E-03 -3.376 19.99 0.1600E-03 daphnite 0.6311E-06 -6.200 0.4503E-03 -3.346 21.40 0.1365E-03 chlorite-Mn 0.1350E-08 -8.870 0.9574E-06 -6.019 0.4549E-01 0.3051E-06 diaspore 0.1826E-04 -4.738 0.1095E-02 -2.960 52.05 0.3261E-03 hematite 0.8351E-06 -6.078 0.1334E-03 -3.875 6.337 0.2528E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5448E+00 0.5448E+00 1.0000 -0.264 daphnite 0.4542E+00 0.4542E+00 1.0000 -0.343 chlorite-Mn 0.9720E-03 0.9720E-03 1.0000 -3.012 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002105 g Volume = 0.000649 cm3 Porosity: 99.9352% V(tot) - V(min): 0.10021E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0068000 g log = -2.1675 Original solution: 1000.0103000 g Original solution / Rock added: 147060.34 (Water/Rock Ratio), log = 5.1675 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1075E-03 1.0071 0.1105E-03 0.1097E-03 CH4,gas 0.1152E-10 1.0125 0.1191E-10 0.1176E-10 H2,gas 0.5614E-05 1.0005 0.5731E-05 0.5728E-05 H2S,gas 0.5772E-07 0.9960 0.5867E-07 0.5890E-07 S2,gas 0.3855E-23 1.0000 0.3933E-23 0.3933E-23 CO,gas 0.1654E-12 1.0000 0.1688E-12 0.1688E-12 SO3,gas 0.1485E-34 1.0000 0.1516E-34 0.1516E-34 SO2,gas 0.3312E-17 1.0000 0.3380E-17 0.3380E-17 HCl,gas 0.1761E-14 1.0000 0.1797E-14 0.1797E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.12132E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.00000E+00 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.32 -5.66 -1.885 0.96567E+04 -3.957 3 CH4,gas 4.54 -8.08 -12.62 -3.156 0.21554E+05 -10.924 4 H2,gas 8.00 1.06 -6.94 -3.966 0.11851E+05 -5.242 5 H2S,gas -6.23 -15.16 -8.93 -4.465 0.15249E+05 -7.232 6 S2,gas -7.34 -32.44 -25.10 -3.862 0.42865E+05 -23.405 7 CO,gas 3.21 -11.26 -14.47 -4.453 0.24710E+05 -12.773 8 SO3,gas 17.12 -19.40 -36.52 -9.130 0.62354E+05 -34.819 9 SO2,gas 0.83 -18.34 -19.17 -5.112 0.32732E+05 -17.471 10 HCl,gas 5.19 -11.26 -16.44 -8.222 0.28078E+05 -14.745 21 andalusite 5.00 1.56 -3.44 -0.344 0.58744E+04 24 anhydrite -5.32 -9.34 -4.03 -2.014 0.68770E+04 35 aragonite 0.97 -2.26 -3.23 -1.077 0.55144E+04 36 brucite 12.57 8.91 -3.66 -0.731 0.62428E+04 37 calcite 0.81 -2.26 -3.07 -1.025 0.52502E+04 40 carpholite-Mg 8.58 6.29 -2.29 -0.153 0.39183E+04 41 carpholite-Fe 6.71 4.19 -2.53 -0.168 0.43116E+04 50 chloritoid-Mg 13.20 10.47 -2.72 -0.182 0.46514E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13657E+04 52 chloritoid-Mn 11.40 9.28 -2.12 -0.141 0.36135E+04 54 coesite -2.38 -4.19 -1.81 -0.603 0.30908E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.19 -1.63 -0.542 0.27762E+04 78 fayalite 14.05 9.44 -4.61 -0.658 0.78659E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.07 -4.07 -0.340 0.69565E+04 92 hercynite 17.28 12.56 -4.72 -0.315 0.80568E+04 98 kaolinite -1.33 -2.63 -1.29 -0.117 0.22066E+04 99 kyanite 4.88 1.56 -3.31 -0.331 0.56603E+04 101 laumontite 2.88 -0.95 -3.83 -0.255 0.65369E+04 102 lawsonite 9.62 7.43 -2.19 -0.146 0.37369E+04 105 lizardite 23.24 18.36 -4.88 -0.407 0.83310E+04 106 magnesite 0.69 -3.40 -4.09 -1.365 0.69902E+04 107 magnetite 20.09 19.38 -0.71 -0.058 0.12099E+04 110 magnesioferrite 26.21 21.48 -4.73 -0.386 0.80829E+04 113 margarite 17.32 13.17 -4.15 -0.166 0.70838E+04 121 paragonite 4.24 -0.35 -4.59 -0.270 0.78374E+04 128 periclase-Fe 11.63 6.81 -4.81 -1.203 0.82197E+04 142 pyrite -21.25 -24.57 -3.32 -0.781 0.56707E+04 143 pyrrhotite -4.26 -8.35 -4.09 -1.363 0.69799E+04 144 pyrrhotiteFe0.875 -6.02 -9.33 -3.31 -1.219 0.56588E+04 145 pyroxmangite 7.40 3.54 -3.86 -0.772 0.65930E+04 146 pyrophyllite -6.18 -11.00 -4.82 -0.301 0.82331E+04 147 quartz -2.99 -4.19 -1.20 -0.399 0.20435E+04 151 rhodochrosite -0.98 -4.59 -3.62 -1.205 0.61737E+04 152 rhodonite 7.45 3.54 -3.91 -0.782 0.66733E+04 155 siderite -2.61 -5.50 -2.89 -0.965 0.49430E+04 156 sillimanite 5.26 1.56 -3.70 -0.370 0.63183E+04 168 sudoite 21.08 16.76 -4.32 -0.139 0.73704E+04 177 topaz-H 4.62 1.56 -3.06 -0.278 0.52203E+04 178 tridymite -2.63 -4.19 -1.56 -0.520 0.26635E+04 181 troilite-low -4.41 -8.35 -3.94 -1.312 0.67227E+04 187 wairakite 3.95 -0.95 -4.90 -0.288 0.83589E+04 189 wollastonite 10.46 5.87 -4.59 -0.919 0.78455E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.19 -1.38 -0.461 0.23628E+04 205 nontronite-Ca 3.21 -0.19 -3.40 -0.221 0.58138E+04 206 nontronite-H 2.53 -1.85 -4.38 -0.294 0.74817E+04 207 nontronite-K 3.34 -1.35 -4.69 -0.301 0.80051E+04 208 nontronite-Mg 3.07 -0.38 -3.45 -0.224 0.58961E+04 209 nontronite-Na 3.52 -0.67 -4.19 -0.269 0.71458E+04 214 gypsum -4.96 -9.34 -4.39 -1.097 0.74945E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.81 -3.00 -0.750 0.51207E+04 240 silica-amorphous -2.09 -4.19 -2.09 -0.698 0.35770E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0068000 g New total amount of reactant added: 0.0070000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9764E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0070000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2652140E-03 Osmotic coef. = 0.9902 True ionic strength = .2675300E-03 Chg. balance for total moles = 0.9764E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.42428E-07 -7.3723 0.40774E-07 -7.3896 0.96103E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13257E-03 -3.8776 0.96091E+00 -0.0173 4 SO4-- 0.25342E-04 -4.5962 0.22802E-04 -4.6420 0.89975E+00 -0.0459 5 HCO3- 0.12023E-04 -4.9200 0.11553E-04 -4.9373 0.96094E+00 -0.0173 6 HS- 0.13246E-07 -7.8779 0.12728E-07 -7.8952 0.96092E+00 -0.0173 7 Al+++ 0.62880E-19 -19.2015 0.50683E-19 -19.2951 0.80602E+00 -0.0937 8 H4SiO4 0.66888E-04 -4.1747 0.66888E-04 -4.1747 0.10000E+01 0.0000 9 Ca++ 0.22281E-04 -4.6521 0.20044E-04 -4.6980 0.89962E+00 -0.0459 10 Mg++ 0.15020E-05 -5.8233 0.13511E-05 -5.8693 0.89953E+00 -0.0460 11 Fe++ 0.11665E-07 -7.9331 0.10493E-07 -7.9791 0.89955E+00 -0.0460 12 K+ 0.14857E-05 -5.8281 0.14276E-05 -5.8454 0.96095E+00 -0.0173 13 Na+ 0.16885E-03 -3.7725 0.16225E-03 -3.7898 0.96091E+00 -0.0173 14 Mn++ 0.10547E-06 -6.9769 0.94876E-07 -7.0228 0.89957E+00 -0.0460 15 HPO4-- 0.93741E-08 -8.0281 0.84343E-08 -8.0740 0.89975E+00 -0.0459 16 HSiO3- 0.15940E-05 -5.7975 0.15317E-05 -5.8148 0.96091E+00 -0.0173 17 Ca(HSiO3)+ 0.72762E-09 -9.1381 0.69920E-09 -9.1554 0.96095E+00 -0.0173 18 Mg(HSiO3)+ 0.61038E-10 -10.2144 0.58655E-10 -10.2317 0.96095E+00 -0.0173 19 NaHSiO3,aq 0.40194E-08 -8.3958 0.40194E-08 -8.3958 0.10000E+01 0.0000 20 AlO+ 0.43158E-11 -11.3649 0.41473E-11 -11.3822 0.96095E+00 -0.0173 21 AlOH+2 0.93601E-15 -15.0287 0.84203E-15 -15.0747 0.89959E+00 -0.0460 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.11444E-05 -5.9414 0.10997E-05 -5.9587 0.96088E+00 -0.0173 24 CH4,aq 0.62652E-14 -14.2031 0.62646E-14 -14.2031 0.99992E+00 0.0000 29 CO,aq 0.10423E-15 -15.9820 0.10423E-15 -15.9820 0.10000E+01 0.0000 30 CO2,aq 0.10067E-05 -5.9971 0.10066E-05 -5.9971 0.99992E+00 0.0000 31 CO3-2 0.27508E-07 -7.5605 0.24749E-07 -7.6064 0.89971E+00 -0.0459 32 CaCO3,aq 0.62202E-08 -8.2062 0.62202E-08 -8.2062 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.61514E-08 -8.2110 0.59112E-08 -8.2283 0.96095E+00 -0.0173 34 CaCl+ 0.44750E-08 -8.3492 0.43002E-08 -8.3665 0.96095E+00 -0.0173 35 CaCl2,aq 0.13544E-12 -12.8683 0.13544E-12 -12.8683 0.10000E+01 0.0000 36 CaOH+ 0.36458E-07 -7.4382 0.35035E-07 -7.4555 0.96095E+00 -0.0173 37 CaSO4,aq 0.14513E-06 -6.8382 0.14513E-06 -6.8382 0.10000E+01 0.0000 38 HCl,aq 0.99053E-12 -12.0041 0.99053E-12 -12.0041 0.10000E+01 0.0000 43 FeCl+ 0.22914E-11 -11.6399 0.22019E-11 -11.6572 0.96095E+00 -0.0173 46 FeO,aq 0.24531E-09 -9.6103 0.24531E-09 -9.6103 0.10000E+01 0.0000 47 FeOH+ 0.87175E-08 -8.0596 0.83771E-08 -8.0769 0.96095E+00 -0.0173 48 HFeO2- 0.65508E-10 -10.1837 0.62948E-10 -10.2010 0.96091E+00 -0.0173 49 FeO+ 0.32387E-12 -12.4896 0.31123E-12 -12.5069 0.96095E+00 -0.0173 50 FeOH+2 0.26940E-17 -17.5696 0.24234E-17 -17.6156 0.89959E+00 -0.0460 51 FeO2- 0.39863E-10 -10.3994 0.38305E-10 -10.4168 0.96091E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.41221E-08 -8.3849 0.41218E-08 -8.3849 0.99992E+00 0.0000 54 KCl,aq 0.34302E-11 -11.4647 0.34302E-11 -11.4647 0.10000E+01 0.0000 55 KHSO4,aq 0.37528E-17 -17.4256 0.37528E-17 -17.4256 0.10000E+01 0.0000 56 KOH,aq 0.14953E-10 -10.8253 0.14953E-10 -10.8253 0.10000E+01 0.0000 57 KSO4- 0.52569E-09 -9.2793 0.50514E-09 -9.2966 0.96091E+00 -0.0173 58 MgCO3,aq 0.10510E-09 -9.9784 0.10510E-09 -9.9784 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.42369E-09 -9.3730 0.40714E-09 -9.3903 0.96095E+00 -0.0173 60 MgCl+ 0.27339E-09 -9.5632 0.26272E-09 -9.5805 0.96095E+00 -0.0173 61 MgOH+ 0.13599E-07 -7.8665 0.13068E-07 -7.8838 0.96095E+00 -0.0173 63 MnO,aq 0.59098E-10 -10.2284 0.59098E-10 -10.2284 0.10000E+01 0.0000 64 MnOH+ 0.73221E-08 -8.1354 0.70361E-08 -8.1527 0.96095E+00 -0.0173 65 MnO2-2 0.13112E-17 -17.8823 0.11797E-17 -17.9282 0.89971E+00 -0.0459 66 HMnO2- 0.10967E-13 -13.9599 0.10538E-13 -13.9772 0.96091E+00 -0.0173 69 MnCl+ 0.80601E-10 -10.0937 0.77453E-10 -10.1110 0.96095E+00 -0.0173 70 MnSO4,aq 0.62454E-09 -9.2044 0.62454E-09 -9.2044 0.10000E+01 0.0000 71 NaCl,aq 0.71281E-08 -8.1470 0.71281E-08 -8.1470 0.10000E+01 0.0000 72 NaOH,aq 0.17096E-08 -8.7671 0.17096E-08 -8.7671 0.10000E+01 0.0000 74 OH- 0.14747E-04 -4.8313 0.14170E-04 -4.8486 0.96088E+00 -0.0173 79 HPO3-2 0.12041E-18 -18.9193 0.10834E-18 -18.9652 0.89971E+00 -0.0459 82 H3PO4,aq 0.98073E-13 -13.0085 0.98073E-13 -13.0085 0.10000E+01 0.0000 83 H2PO4- 0.66020E-08 -8.1803 0.63441E-08 -8.1976 0.96093E+00 -0.0173 84 PO4-3 0.20918E-12 -12.6795 0.16877E-12 -12.7727 0.80682E+00 -0.0932 87 H2P2O7-2 0.35076E-17 -17.4550 0.31558E-17 -17.5009 0.89971E+00 -0.0459 88 HP2O7-3 0.19173E-16 -16.7173 0.15454E-16 -16.8109 0.80603E+00 -0.0936 89 P2O7-4 0.13095E-18 -18.8829 0.90547E-19 -19.0431 0.69146E+00 -0.1602 90 H2S,aq 0.16041E-08 -8.7948 0.16040E-08 -8.7948 0.99992E+00 0.0000 91 S2-2 0.96801E-18 -18.0141 0.87092E-18 -18.0600 0.89971E+00 -0.0459 96 SO2,aq 0.69783E-18 -18.1563 0.69783E-18 -18.1563 0.10000E+01 0.0000 97 SO3-2 0.13571E-13 -13.8674 0.12213E-13 -13.9132 0.89997E+00 -0.0458 98 HSO3- 0.32448E-13 -13.4888 0.31180E-13 -13.5061 0.96091E+00 -0.0173 99 HSO4- 0.93239E-09 -9.0304 0.89600E-09 -9.0477 0.96097E+00 -0.0173 101 S2O3-2 0.47752E-15 -15.3210 0.42963E-15 -15.3669 0.89971E+00 -0.0459 Charge balance for all species = 0.9767E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4242791E-07 -.2002994E-04 -.2018862E-01 0.0000 2 H2O 0.1000000E+01 0.5550826E+02 0.9999804E+06 0.0000 3 Cl- 0.1379626E-03 0.1379746E-03 0.4891525E+01 3.5121 4 SO4-- 0.2534248E-04 0.2548869E-04 0.2448441E+01 10.1372 5 HCO3- 0.1202295E-04 0.1307004E-04 0.7974829E+00 2.4523 6 HS- 0.1324590E-07 0.1585072E-07 0.5242057E-03 -0.5056 7 Al+++ 0.6288012E-19 0.1164684E-05 0.3142436E-01 2.8737 8 H4SiO4 0.6688784E-04 0.6848669E-04 0.6582509E+01 -4.1747 9 Ca++ 0.2228055E-04 0.2247971E-04 0.9009258E+00 10.0812 10 Mg++ 0.1501984E-05 0.1516446E-05 0.3686719E-01 8.9099 11 Fe++ 0.1166518E-07 0.2093465E-07 0.1169117E-02 6.8001 12 K+ 0.1485660E-05 0.1486204E-05 0.5811251E-01 1.5442 13 Na+ 0.1688453E-03 0.1688582E-03 0.3881947E+01 3.5998 14 Mn++ 0.1054688E-06 0.1135551E-06 0.6238381E-02 7.7564 15 HPO4-- 0.9374089E-08 0.1597643E-07 0.1533375E-02 6.7053 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1028696E-03 -.2002988E-04 -.8283972E-04 0.0000000E+00 2 H2O 0.5550816E+02 0.5550811E+02 0.4794358E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2569846E-04 0.2548862E-04 0.2098445E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1939939E-06 0.1585067E-07 -.2098445E-06 0.0000000E+00 7 Al+++ 0.2282519E-04 0.1164681E-05 0.2166051E-04 0.0000000E+00 8 H4SiO4 0.7288948E-04 0.6848650E-04 0.4402979E-05 0.0000000E+00 9 Ca++ 0.2252206E-04 0.2247965E-04 0.4241108E-07 0.0000000E+00 10 Mg++ 0.5555556E-05 0.1516442E-05 0.4039113E-05 0.0000000E+00 11 Fe++ 0.4991060E-05 0.2093460E-07 0.4970126E-05 0.0000000E+00 12 K+ 0.1486200E-05 0.1486200E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1688577E-03 0.1688577E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1213702E-06 0.1135548E-06 0.7815353E-08 0.0000000E+00 15 HPO4-- 0.4142304E-07 0.1597639E-07 0.2544665E-07 0.0000000E+00 Chg. balance for solid moles: -.4434E-21 Mass of aqueous solution: 0.100001E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0070000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.8482E-08 -8.071 0.4261E-05 -5.371 0.1953 0.1354E-05 clinochlore 0.8078E-06 -6.093 0.4490E-03 -3.348 20.58 0.1708E-03 daphnite 0.6583E-06 -6.182 0.4697E-03 -3.328 21.53 0.1423E-03 chlorite-Mn 0.1563E-08 -8.806 0.1108E-05 -5.955 0.5080E-01 0.3531E-06 diaspore 0.1873E-04 -4.728 0.1123E-02 -2.949 51.49 0.3344E-03 hematite 0.8394E-06 -6.076 0.1340E-03 -3.873 6.145 0.2541E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5504E+00 0.5504E+00 1.0000 -0.259 daphnite 0.4485E+00 0.4485E+00 1.0000 -0.348 chlorite-Mn 0.1065E-02 0.1065E-02 1.0000 -2.973 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002181 g Volume = 0.000675 cm3 Porosity: 99.9327% V(tot) - V(min): 0.10021E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0070000 g log = -2.1549 Original solution: 1000.0103000 g Original solution / Rock added: 142858.61 (Water/Rock Ratio), log = 5.1549 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1048E-03 1.0071 0.1077E-03 0.1069E-03 CH4,gas 0.8925E-11 1.0125 0.9221E-11 0.9107E-11 H2,gas 0.5300E-05 1.0005 0.5411E-05 0.5408E-05 H2S,gas 0.4338E-07 0.9960 0.4409E-07 0.4427E-07 S2,gas 0.2442E-23 1.0000 0.2492E-23 0.2492E-23 CO,gas 0.1522E-12 1.0000 0.1553E-12 0.1553E-12 SO3,gas 0.1405E-34 1.0000 0.1433E-34 0.1433E-34 SO2,gas 0.2957E-17 1.0000 0.3018E-17 0.3018E-17 HCl,gas 0.1713E-14 1.0000 0.1748E-14 0.1748E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.00000E+00 47 daphnite 28.97 28.97 0.00 0.000 0.60662E-11 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.24265E-10 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.33 -5.67 -1.889 0.96759E+04 -3.968 3 CH4,gas 4.54 -8.19 -12.73 -3.184 0.21743E+05 -11.035 4 H2,gas 8.00 1.03 -6.97 -3.980 0.11894E+05 -5.267 5 H2S,gas -6.23 -15.28 -9.05 -4.527 0.15460E+05 -7.356 6 S2,gas -7.34 -32.64 -25.30 -3.893 0.43203E+05 -23.603 7 CO,gas 3.21 -11.29 -14.51 -4.464 0.24772E+05 -12.809 8 SO3,gas 17.12 -19.42 -36.54 -9.136 0.62396E+05 -34.844 9 SO2,gas 0.83 -18.39 -19.22 -5.125 0.32816E+05 -17.520 10 HCl,gas 5.19 -11.27 -16.46 -8.228 0.28099E+05 -14.758 21 andalusite 5.00 1.57 -3.43 -0.343 0.58546E+04 24 anhydrite -5.32 -9.34 -4.02 -2.012 0.68696E+04 35 aragonite 0.97 -2.25 -3.21 -1.071 0.54848E+04 36 brucite 12.57 8.91 -3.66 -0.732 0.62471E+04 37 calcite 0.81 -2.25 -3.06 -1.019 0.52206E+04 40 carpholite-Mg 8.58 6.31 -2.27 -0.152 0.38830E+04 41 carpholite-Fe 6.71 4.20 -2.51 -0.168 0.42933E+04 50 chloritoid-Mg 13.20 10.48 -2.72 -0.181 0.46359E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13672E+04 52 chloritoid-Mn 11.40 9.33 -2.07 -0.138 0.35378E+04 54 coesite -2.38 -4.17 -1.80 -0.600 0.30710E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.17 -1.61 -0.538 0.27564E+04 78 fayalite 14.05 9.43 -4.62 -0.660 0.78887E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.05 -4.09 -0.341 0.69808E+04 92 hercynite 17.28 12.55 -4.73 -0.315 0.80781E+04 98 kaolinite -1.33 -2.60 -1.27 -0.115 0.21670E+04 99 kyanite 4.88 1.57 -3.30 -0.330 0.56405E+04 101 laumontite 2.88 -0.87 -3.75 -0.250 0.64089E+04 102 lawsonite 9.62 7.48 -2.14 -0.142 0.36485E+04 105 lizardite 23.24 18.38 -4.86 -0.405 0.83042E+04 106 magnesite 0.69 -3.42 -4.11 -1.369 0.70136E+04 107 magnetite 20.09 19.37 -0.72 -0.059 0.12312E+04 110 magnesioferrite 26.21 21.48 -4.74 -0.387 0.80871E+04 113 margarite 17.32 13.23 -4.10 -0.164 0.69954E+04 120 muscovite 2.58 -2.36 -4.94 -0.291 0.84367E+04 121 paragonite 4.24 -0.30 -4.54 -0.267 0.77562E+04 128 periclase-Fe 11.63 6.80 -4.83 -1.207 0.82410E+04 142 pyrite -21.25 -24.80 -3.56 -0.837 0.60730E+04 143 pyrrhotite -4.26 -8.48 -4.22 -1.408 0.72130E+04 144 pyrrhotiteFe0.875 -6.02 -9.46 -3.45 -1.267 0.58840E+04 145 pyroxmangite 7.40 3.58 -3.82 -0.763 0.65173E+04 146 pyrophyllite -6.18 -10.95 -4.78 -0.298 0.81539E+04 147 quartz -2.99 -4.17 -1.19 -0.395 0.20237E+04 151 rhodochrosite -0.98 -4.57 -3.59 -1.198 0.61370E+04 152 rhodonite 7.45 3.58 -3.86 -0.773 0.65976E+04 155 siderite -2.61 -5.53 -2.92 -0.973 0.49835E+04 156 sillimanite 5.26 1.57 -3.69 -0.369 0.62985E+04 168 sudoite 21.08 16.79 -4.29 -0.138 0.73194E+04 177 topaz-H 4.62 1.57 -3.05 -0.277 0.52005E+04 178 tridymite -2.63 -4.17 -1.55 -0.516 0.26437E+04 181 troilite-low -4.41 -8.48 -4.07 -1.358 0.69558E+04 187 wairakite 3.95 -0.87 -4.82 -0.284 0.82308E+04 189 wollastonite 10.46 5.91 -4.55 -0.911 0.77768E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.17 -1.37 -0.457 0.23430E+04 205 nontronite-Ca 3.21 -0.14 -3.36 -0.218 0.57330E+04 206 nontronite-H 2.53 -1.81 -4.34 -0.291 0.74090E+04 207 nontronite-K 3.34 -1.30 -4.64 -0.298 0.79185E+04 208 nontronite-Mg 3.07 -0.34 -3.41 -0.221 0.58241E+04 209 nontronite-Na 3.52 -0.62 -4.14 -0.266 0.70659E+04 214 gypsum -4.96 -9.34 -4.38 -1.096 0.74872E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.80 -3.01 -0.753 0.51420E+04 240 silica-amorphous -2.09 -4.17 -2.08 -0.694 0.35572E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0070000 g New total amount of reactant added: 0.0072000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9764E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0072000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2657838E-03 Osmotic coef. = 0.9902 True ionic strength = .2682292E-03 Chg. balance for total moles = 0.9764E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.41266E-07 -7.3844 0.39657E-07 -7.4017 0.96100E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13257E-03 -3.8776 0.96089E+00 -0.0173 4 SO4-- 0.25344E-04 -4.5961 0.22801E-04 -4.6420 0.89964E+00 -0.0459 5 HCO3- 0.12047E-04 -4.9191 0.11577E-04 -4.9364 0.96092E+00 -0.0173 6 HS- 0.10304E-07 -7.9870 0.99013E-08 -8.0043 0.96089E+00 -0.0173 7 Al+++ 0.57863E-19 -19.2376 0.46627E-19 -19.3314 0.80582E+00 -0.0938 8 H4SiO4 0.68656E-04 -4.1633 0.68656E-04 -4.1633 0.10000E+01 0.0000 9 Ca++ 0.22504E-04 -4.6477 0.20242E-04 -4.6937 0.89952E+00 -0.0460 10 Mg++ 0.14125E-05 -5.8500 0.12704E-05 -5.8960 0.89943E+00 -0.0460 11 Fe++ 0.10732E-07 -7.9693 0.96527E-08 -8.0154 0.89945E+00 -0.0460 12 K+ 0.15281E-05 -5.8158 0.14684E-05 -5.8332 0.96092E+00 -0.0173 13 Na+ 0.16910E-03 -3.7719 0.16248E-03 -3.7892 0.96089E+00 -0.0173 14 Mn++ 0.10741E-06 -6.9690 0.96608E-07 -7.0150 0.89947E+00 -0.0460 15 HPO4-- 0.88868E-08 -8.0513 0.79950E-08 -8.0972 0.89965E+00 -0.0459 16 HSiO3- 0.16824E-05 -5.7741 0.16166E-05 -5.7914 0.96089E+00 -0.0173 17 Ca(HSiO3)+ 0.77553E-09 -9.1104 0.74522E-09 -9.1277 0.96092E+00 -0.0173 18 Mg(HSiO3)+ 0.60574E-10 -10.2177 0.58207E-10 -10.2350 0.96092E+00 -0.0173 19 NaHSiO3,aq 0.42482E-08 -8.3718 0.42482E-08 -8.3718 0.10000E+01 0.0000 20 AlO+ 0.41976E-11 -11.3770 0.40335E-11 -11.3943 0.96092E+00 -0.0173 21 AlOH+2 0.88549E-15 -15.0528 0.79648E-15 -15.0988 0.89949E+00 -0.0460 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.11767E-05 -5.9293 0.11307E-05 -5.9467 0.96085E+00 -0.0173 24 CH4,aq 0.48836E-14 -14.3113 0.48832E-14 -14.3113 0.99992E+00 0.0000 29 CO,aq 0.96056E-16 -16.0175 0.96056E-16 -16.0175 0.10000E+01 0.0000 30 CO2,aq 0.98104E-06 -6.0083 0.98096E-06 -6.0083 0.99992E+00 0.0000 31 CO3-2 0.28344E-07 -7.5475 0.25498E-07 -7.5935 0.89961E+00 -0.0459 32 CaCO3,aq 0.64719E-08 -8.1890 0.64719E-08 -8.1890 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.62250E-08 -8.2059 0.59817E-08 -8.2232 0.96092E+00 -0.0173 34 CaCl+ 0.45193E-08 -8.3449 0.43427E-08 -8.3622 0.96092E+00 -0.0173 35 CaCl2,aq 0.13677E-12 -12.8640 0.13677E-12 -12.8640 0.10000E+01 0.0000 36 CaOH+ 0.37858E-07 -7.4218 0.36379E-07 -7.4391 0.96092E+00 -0.0173 37 CaSO4,aq 0.14656E-06 -6.8340 0.14656E-06 -6.8340 0.10000E+01 0.0000 38 HCl,aq 0.96335E-12 -12.0162 0.96335E-12 -12.0162 0.10000E+01 0.0000 43 FeCl+ 0.21078E-11 -11.6762 0.20254E-11 -11.6935 0.96092E+00 -0.0173 46 FeO,aq 0.23855E-09 -9.6224 0.23855E-09 -9.6224 0.10000E+01 0.0000 47 FeOH+ 0.82453E-08 -8.0838 0.79232E-08 -8.1011 0.96092E+00 -0.0173 48 HFeO2- 0.65502E-10 -10.1837 0.62941E-10 -10.2011 0.96089E+00 -0.0173 49 FeO+ 0.31500E-12 -12.5017 0.30269E-12 -12.5190 0.96092E+00 -0.0173 50 FeOH+2 0.25485E-17 -17.5937 0.22924E-17 -17.6397 0.89949E+00 -0.0460 51 FeO2- 0.40988E-10 -10.3873 0.39384E-10 -10.4047 0.96089E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.38983E-08 -8.4091 0.38980E-08 -8.4092 0.99992E+00 0.0000 54 KCl,aq 0.35280E-11 -11.4525 0.35280E-11 -11.4525 0.10000E+01 0.0000 55 KHSO4,aq 0.37540E-17 -17.4255 0.37540E-17 -17.4255 0.10000E+01 0.0000 56 KOH,aq 0.15813E-10 -10.8010 0.15813E-10 -10.8010 0.10000E+01 0.0000 57 KSO4- 0.54069E-09 -9.2671 0.51954E-09 -9.2844 0.96089E+00 -0.0173 58 MgCO3,aq 0.10181E-09 -9.9922 0.10181E-09 -9.9922 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.39921E-09 -9.3988 0.38361E-09 -9.4161 0.96092E+00 -0.0173 60 MgCl+ 0.25707E-09 -9.5899 0.24702E-09 -9.6073 0.96092E+00 -0.0173 61 MgOH+ 0.13148E-07 -7.8811 0.12634E-07 -7.8985 0.96092E+00 -0.0173 63 MnO,aq 0.63618E-10 -10.1964 0.63618E-10 -10.1964 0.10000E+01 0.0000 64 MnOH+ 0.76661E-08 -8.1154 0.73666E-08 -8.1327 0.96092E+00 -0.0173 65 MnO2-2 0.14923E-17 -17.8261 0.13425E-17 -17.8721 0.89961E+00 -0.0459 66 HMnO2- 0.12139E-13 -13.9158 0.11664E-13 -13.9332 0.96089E+00 -0.0173 69 MnCl+ 0.82072E-10 -10.0858 0.78865E-10 -10.1031 0.96092E+00 -0.0173 70 MnSO4,aq 0.63592E-09 -9.1966 0.63592E-09 -9.1966 0.10000E+01 0.0000 71 NaCl,aq 0.71383E-08 -8.1464 0.71383E-08 -8.1464 0.10000E+01 0.0000 72 NaOH,aq 0.17604E-08 -8.7544 0.17604E-08 -8.7544 0.10000E+01 0.0000 74 OH- 0.15163E-04 -4.8192 0.14569E-04 -4.8366 0.96085E+00 -0.0173 79 HPO3-2 0.10796E-18 -18.9667 0.97119E-19 -19.0127 0.89961E+00 -0.0459 82 H3PO4,aq 0.87937E-13 -13.0558 0.87937E-13 -13.0558 0.10000E+01 0.0000 83 H2PO4- 0.60868E-08 -8.2156 0.58488E-08 -8.2329 0.96091E+00 -0.0173 84 PO4-3 0.20393E-12 -12.6905 0.16449E-12 -12.7839 0.80661E+00 -0.0933 87 H2P2O7-2 0.29816E-17 -17.5255 0.26823E-17 -17.5715 0.89961E+00 -0.0459 88 HP2O7-3 0.16760E-16 -16.7757 0.13506E-16 -16.8695 0.80583E+00 -0.0938 89 P2O7-4 0.11772E-18 -18.9292 0.81360E-19 -19.0896 0.69115E+00 -0.1604 90 H2S,aq 0.12136E-08 -8.9159 0.12135E-08 -8.9159 0.99992E+00 0.0000 91 S2-2 0.61947E-18 -18.2080 0.55728E-18 -18.2539 0.89961E+00 -0.0459 96 SO2,aq 0.62422E-18 -18.2047 0.62422E-18 -18.2047 0.10000E+01 0.0000 97 SO3-2 0.12835E-13 -13.8916 0.11550E-13 -13.9374 0.89987E+00 -0.0458 98 HSO3- 0.29845E-13 -13.5251 0.28677E-13 -13.5425 0.96089E+00 -0.0173 99 HSO4- 0.90682E-09 -9.0425 0.87140E-09 -9.0598 0.96094E+00 -0.0173 101 S2O3-2 0.36130E-15 -15.4421 0.32503E-15 -15.4881 0.89961E+00 -0.0459 Charge balance for all species = 0.9768E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4126574E-07 -.2069350E-04 -.2085743E-01 0.0000 2 H2O 0.1000000E+01 0.5550827E+02 0.9999802E+06 0.0000 3 Cl- 0.1379626E-03 0.1379746E-03 0.4891525E+01 3.5241 4 SO4-- 0.2534438E-04 0.2549208E-04 0.2448766E+01 10.1613 5 HCO3- 0.1204745E-04 0.1307004E-04 0.7974828E+00 2.4653 6 HS- 0.1030428E-07 0.1246251E-07 0.4121527E-03 -0.6026 7 Al+++ 0.5786297E-19 0.1196980E-05 0.3229574E-01 2.8737 8 H4SiO4 0.6865581E-04 0.7034325E-04 0.6760949E+01 -4.1633 9 Ca++ 0.2250368E-04 0.2270610E-04 0.9099987E+00 10.1096 10 Mg++ 0.1412478E-05 0.1426445E-05 0.3467911E-01 8.9073 11 Fe++ 0.1073171E-07 0.1952316E-07 0.1090290E-02 6.7880 12 K+ 0.1528107E-05 0.1528667E-05 0.5977286E-01 1.5685 13 Na+ 0.1690961E-03 0.1691092E-03 0.3887718E+01 3.6125 14 Mn++ 0.1074061E-06 0.1158538E-06 0.6364662E-02 7.7884 15 HPO4-- 0.8886834E-08 0.1497388E-07 0.1437152E-02 6.7062 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1061813E-03 -.2069344E-04 -.8548787E-04 0.0000000E+00 2 H2O 0.5550816E+02 0.5550811E+02 0.4935192E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2570401E-04 0.2549201E-04 0.2119990E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.1995365E-06 0.1246247E-07 -.2119990E-06 0.0000000E+00 7 Al+++ 0.2347734E-04 0.1196977E-05 0.2228036E-04 0.0000000E+00 8 H4SiO4 0.7497204E-04 0.7034305E-04 0.4628986E-05 0.0000000E+00 9 Ca++ 0.2275209E-04 0.2270603E-04 0.4605453E-07 0.0000000E+00 10 Mg++ 0.5714286E-05 0.1426441E-05 0.4287845E-05 0.0000000E+00 11 Fe++ 0.5133662E-05 0.1952311E-07 0.5114139E-05 0.0000000E+00 12 K+ 0.1528662E-05 0.1528662E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1691088E-03 0.1691088E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1248379E-06 0.1158535E-06 0.8984419E-08 0.0000000E+00 15 HPO4-- 0.4260655E-07 0.1497384E-07 0.2763272E-07 0.0000000E+00 Chg. balance for solid moles: -.7875E-20 Mass of aqueous solution: 0.100002E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0072000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.9211E-08 -8.036 0.4627E-05 -5.335 0.2050 0.1470E-05 clinochlore 0.8576E-06 -6.067 0.4767E-03 -3.322 21.12 0.1813E-03 daphnite 0.6836E-06 -6.165 0.4878E-03 -3.312 21.61 0.1478E-03 chlorite-Mn 0.1797E-08 -8.745 0.1274E-05 -5.895 0.5644E-01 0.4060E-06 diaspore 0.1919E-04 -4.717 0.1151E-02 -2.939 51.01 0.3428E-03 hematite 0.8480E-06 -6.072 0.1354E-03 -3.868 6.000 0.2567E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5558E+00 0.5558E+00 1.0000 -0.255 daphnite 0.4431E+00 0.4431E+00 1.0000 -0.354 chlorite-Mn 0.1165E-02 0.1165E-02 1.0000 -2.934 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002257 g Volume = 0.000699 cm3 Porosity: 99.9303% V(tot) - V(min): 0.10022E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0072000 g log = -2.1427 Original solution: 1000.0103000 g Original solution / Rock added: 138890.32 (Water/Rock Ratio), log = 5.1427 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.1021E-03 1.0071 0.1050E-03 0.1042E-03 CH4,gas 0.6957E-11 1.0125 0.7188E-11 0.7099E-11 H2,gas 0.5013E-05 1.0005 0.5118E-05 0.5115E-05 H2S,gas 0.3282E-07 0.9960 0.3336E-07 0.3349E-07 S2,gas 0.1563E-23 1.0000 0.1595E-23 0.1595E-23 CO,gas 0.1403E-12 1.0000 0.1431E-12 0.1431E-12 SO3,gas 0.1329E-34 1.0000 0.1356E-34 0.1356E-34 SO2,gas 0.2645E-17 1.0000 0.2699E-17 0.2699E-17 HCl,gas 0.1666E-14 1.0000 0.1700E-14 0.1700E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.12132E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.00000E+00 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.34 -5.68 -1.893 0.96950E+04 -3.979 3 CH4,gas 4.54 -8.30 -12.84 -3.211 0.21928E+05 -11.143 4 H2,gas 8.00 1.01 -6.99 -3.994 0.11935E+05 -5.291 5 H2S,gas -6.23 -15.41 -9.18 -4.588 0.15667E+05 -7.477 6 S2,gas -7.34 -32.83 -25.50 -3.922 0.43534E+05 -23.797 7 CO,gas 3.21 -11.33 -14.54 -4.475 0.24832E+05 -12.844 8 SO3,gas 17.12 -19.45 -36.57 -9.142 0.62437E+05 -34.868 9 SO2,gas 0.83 -18.44 -19.27 -5.138 0.32899E+05 -17.569 10 HCl,gas 5.19 -11.28 -16.47 -8.234 0.28120E+05 -14.770 21 andalusite 5.00 1.58 -3.42 -0.342 0.58352E+04 24 anhydrite -5.32 -9.34 -4.02 -2.009 0.68623E+04 35 aragonite 0.97 -2.23 -3.19 -1.065 0.54554E+04 36 brucite 12.57 8.91 -3.66 -0.732 0.62515E+04 37 calcite 0.81 -2.23 -3.04 -1.013 0.51911E+04 40 carpholite-Mg 8.58 6.33 -2.25 -0.150 0.38487E+04 41 carpholite-Fe 6.71 4.21 -2.50 -0.167 0.42753E+04 50 chloritoid-Mg 13.20 10.49 -2.71 -0.180 0.46209E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13686E+04 52 chloritoid-Mn 11.40 9.37 -2.03 -0.135 0.34638E+04 54 coesite -2.38 -4.16 -1.79 -0.596 0.30517E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.16 -1.60 -0.534 0.27371E+04 75 epidote 24.67 19.76 -4.91 -0.238 0.83839E+04 78 fayalite 14.05 9.41 -4.63 -0.662 0.79107E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.04 -4.10 -0.342 0.70042E+04 92 hercynite 17.28 12.54 -4.74 -0.316 0.80988E+04 98 kaolinite -1.33 -2.58 -1.25 -0.113 0.21283E+04 99 kyanite 4.88 1.58 -3.29 -0.329 0.56211E+04 101 laumontite 2.88 -0.80 -3.68 -0.245 0.62829E+04 102 lawsonite 9.62 7.53 -2.09 -0.139 0.35613E+04 105 lizardite 23.24 18.40 -4.85 -0.404 0.82787E+04 106 magnesite 0.69 -3.43 -4.12 -1.374 0.70371E+04 107 magnetite 20.09 19.35 -0.73 -0.060 0.12519E+04 110 magnesioferrite 26.21 21.47 -4.74 -0.387 0.80915E+04 113 margarite 17.32 13.28 -4.05 -0.162 0.69082E+04 120 muscovite 2.58 -2.30 -4.88 -0.287 0.83372E+04 121 paragonite 4.24 -0.26 -4.50 -0.264 0.76765E+04 128 periclase-Fe 11.63 6.79 -4.84 -1.210 0.82617E+04 142 pyrite -21.25 -25.03 -3.79 -0.891 0.64660E+04 143 pyrrhotite -4.26 -8.62 -4.36 -1.453 0.74406E+04 144 pyrrhotiteFe0.875 -6.02 -9.59 -3.57 -1.315 0.61038E+04 145 pyroxmangite 7.40 3.63 -3.77 -0.755 0.64433E+04 146 pyrophyllite -6.18 -10.91 -4.73 -0.296 0.80765E+04 147 quartz -2.99 -4.16 -1.17 -0.391 0.20044E+04 151 rhodochrosite -0.98 -4.55 -3.57 -1.191 0.61015E+04 152 rhodonite 7.45 3.63 -3.82 -0.764 0.65236E+04 155 siderite -2.61 -5.55 -2.94 -0.981 0.50233E+04 156 sillimanite 5.26 1.58 -3.68 -0.368 0.62792E+04 168 sudoite 21.08 16.82 -4.26 -0.137 0.72702E+04 177 topaz-H 4.62 1.58 -3.03 -0.276 0.51812E+04 178 tridymite -2.63 -4.16 -1.54 -0.512 0.26244E+04 181 troilite-low -4.41 -8.62 -4.21 -1.402 0.71834E+04 187 wairakite 3.95 -0.80 -4.75 -0.279 0.81049E+04 189 wollastonite 10.46 5.95 -4.51 -0.903 0.77090E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.16 -1.36 -0.454 0.23237E+04 201 montmorillonite-Ca -2.29 -7.25 -4.96 -0.307 0.84622E+04 203 montmorillonite-Mg -2.48 -7.45 -4.97 -0.307 0.84780E+04 205 nontronite-Ca 3.21 -0.10 -3.31 -0.215 0.56540E+04 206 nontronite-H 2.53 -1.76 -4.30 -0.288 0.73380E+04 207 nontronite-K 3.34 -1.25 -4.59 -0.294 0.78338E+04 208 nontronite-Mg 3.07 -0.30 -3.37 -0.219 0.57538E+04 209 nontronite-Na 3.52 -0.57 -4.09 -0.263 0.69878E+04 214 gypsum -4.96 -9.34 -4.38 -1.095 0.74799E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.79 -3.02 -0.756 0.51627E+04 240 silica-amorphous -2.09 -4.16 -2.07 -0.691 0.35379E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0072000 g New total amount of reactant added: 0.0074000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9764E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0074000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2663666E-03 Osmotic coef. = 0.9902 True ionic strength = .2689442E-03 Chg. balance for total moles = 0.9764E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.40144E-07 -7.3964 0.38577E-07 -7.4137 0.96098E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13256E-03 -3.8776 0.96086E+00 -0.0173 4 SO4-- 0.25345E-04 -4.5961 0.22799E-04 -4.6421 0.89954E+00 -0.0460 5 HCO3- 0.12071E-04 -4.9183 0.11599E-04 -4.9356 0.96089E+00 -0.0173 6 HS- 0.80798E-08 -8.0926 0.77636E-08 -8.1099 0.96086E+00 -0.0173 7 Al+++ 0.53279E-19 -19.2734 0.42922E-19 -19.3673 0.80561E+00 -0.0939 8 H4SiO4 0.70428E-04 -4.1523 0.70428E-04 -4.1523 0.10000E+01 0.0000 9 Ca++ 0.22727E-04 -4.6435 0.20441E-04 -4.6895 0.89941E+00 -0.0460 10 Mg++ 0.13284E-05 -5.8767 0.11947E-05 -5.9227 0.89933E+00 -0.0461 11 Fe++ 0.98866E-08 -8.0050 0.88915E-08 -8.0510 0.89935E+00 -0.0461 12 K+ 0.15706E-05 -5.8039 0.15091E-05 -5.8213 0.96089E+00 -0.0173 13 Na+ 0.16935E-03 -3.7712 0.16272E-03 -3.7886 0.96086E+00 -0.0173 14 Mn++ 0.10923E-06 -6.9617 0.98236E-07 -7.0077 0.89936E+00 -0.0461 15 HPO4-- 0.84286E-08 -8.0742 0.75819E-08 -8.1202 0.89954E+00 -0.0460 16 HSiO3- 0.17741E-05 -5.7510 0.17047E-05 -5.7684 0.96086E+00 -0.0173 17 Ca(HSiO3)+ 0.82584E-09 -9.0831 0.79355E-09 -9.1004 0.96090E+00 -0.0173 18 Mg(HSiO3)+ 0.60069E-10 -10.2213 0.57720E-10 -10.2387 0.96090E+00 -0.0173 19 NaHSiO3,aq 0.44863E-08 -8.3481 0.44863E-08 -8.3481 0.10000E+01 0.0000 20 AlO+ 0.40834E-11 -11.3890 0.39238E-11 -11.4063 0.96090E+00 -0.0173 21 AlOH+2 0.83803E-15 -15.0767 0.75371E-15 -15.1228 0.89938E+00 -0.0461 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.12097E-05 -5.9173 0.11623E-05 -5.9347 0.96083E+00 -0.0174 24 CH4,aq 0.38369E-14 -14.4160 0.38366E-14 -14.4161 0.99992E+00 0.0000 29 CO,aq 0.88711E-16 -16.0520 0.88711E-16 -16.0520 0.10000E+01 0.0000 30 CO2,aq 0.95619E-06 -6.0195 0.95611E-06 -6.0195 0.99992E+00 0.0000 31 CO3-2 0.29197E-07 -7.5347 0.26262E-07 -7.5807 0.89950E+00 -0.0460 32 CaCO3,aq 0.67312E-08 -8.1719 0.67312E-08 -8.1719 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.62983E-08 -8.2008 0.60521E-08 -8.2181 0.96090E+00 -0.0173 34 CaCl+ 0.45636E-08 -8.3407 0.43851E-08 -8.3580 0.96090E+00 -0.0173 35 CaCl2,aq 0.13811E-12 -12.8598 0.13811E-12 -12.8598 0.10000E+01 0.0000 36 CaOH+ 0.39300E-07 -7.4056 0.37764E-07 -7.4229 0.96090E+00 -0.0173 37 CaSO4,aq 0.14799E-06 -6.8298 0.14799E-06 -6.8298 0.10000E+01 0.0000 38 HCl,aq 0.93710E-12 -12.0282 0.93710E-12 -12.0282 0.10000E+01 0.0000 43 FeCl+ 0.19416E-11 -11.7118 0.18657E-11 -11.7292 0.96090E+00 -0.0173 46 FeO,aq 0.23221E-09 -9.6341 0.23221E-09 -9.6341 0.10000E+01 0.0000 47 FeOH+ 0.78079E-08 -8.1075 0.75026E-08 -8.1248 0.96090E+00 -0.0173 48 HFeO2- 0.65547E-10 -10.1834 0.62982E-10 -10.2008 0.96086E+00 -0.0173 49 FeO+ 0.30644E-12 -12.5137 0.29445E-12 -12.5310 0.96090E+00 -0.0173 50 FeOH+2 0.24120E-17 -17.6176 0.21693E-17 -17.6637 0.89938E+00 -0.0461 51 FeO2- 0.42136E-10 -10.3754 0.40486E-10 -10.3927 0.96086E+00 -0.0173 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.36938E-08 -8.4325 0.36935E-08 -8.4326 0.99992E+00 0.0000 54 KCl,aq 0.36258E-11 -11.4406 0.36258E-11 -11.4406 0.10000E+01 0.0000 55 KHSO4,aq 0.37529E-17 -17.4256 0.37529E-17 -17.4256 0.10000E+01 0.0000 56 KOH,aq 0.16706E-10 -10.7771 0.16706E-10 -10.7771 0.10000E+01 0.0000 57 KSO4- 0.55567E-09 -9.2552 0.53392E-09 -9.2725 0.96086E+00 -0.0173 58 MgCO3,aq 0.98611E-10 -10.0061 0.98611E-10 -10.0061 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.37614E-09 -9.4246 0.36143E-09 -9.4420 0.96090E+00 -0.0173 60 MgCl+ 0.24174E-09 -9.6166 0.23229E-09 -9.6340 0.96090E+00 -0.0173 61 MgOH+ 0.12710E-07 -7.8958 0.12213E-07 -7.9132 0.96090E+00 -0.0173 63 MnO,aq 0.68360E-10 -10.1652 0.68360E-10 -10.1652 0.10000E+01 0.0000 64 MnOH+ 0.80136E-08 -8.0962 0.77003E-08 -8.1135 0.96090E+00 -0.0173 65 MnO2-2 0.16948E-17 -17.7709 0.15245E-17 -17.8169 0.89950E+00 -0.0460 66 HMnO2- 0.13409E-13 -13.8726 0.12884E-13 -13.8899 0.96086E+00 -0.0173 69 MnCl+ 0.83454E-10 -10.0786 0.80191E-10 -10.0959 0.96090E+00 -0.0173 70 MnSO4,aq 0.64658E-09 -9.1894 0.64658E-09 -9.1894 0.10000E+01 0.0000 71 NaCl,aq 0.71485E-08 -8.1458 0.71485E-08 -8.1458 0.10000E+01 0.0000 72 NaOH,aq 0.18123E-08 -8.7418 0.18123E-08 -8.7418 0.10000E+01 0.0000 74 OH- 0.15588E-04 -4.8072 0.14977E-04 -4.8246 0.96083E+00 -0.0174 79 HPO3-2 0.97019E-19 -19.0131 0.87269E-19 -19.0591 0.89950E+00 -0.0460 82 H3PO4,aq 0.78915E-13 -13.1028 0.78915E-13 -13.1028 0.10000E+01 0.0000 83 H2PO4- 0.56153E-08 -8.2506 0.53956E-08 -8.2680 0.96088E+00 -0.0173 84 PO4-3 0.19885E-12 -12.7015 0.16035E-12 -12.7949 0.80641E+00 -0.0934 87 H2P2O7-2 0.25377E-17 -17.5956 0.22827E-17 -17.6415 0.89950E+00 -0.0460 88 HP2O7-3 0.14666E-16 -16.8337 0.11815E-16 -16.9276 0.80562E+00 -0.0939 89 P2O7-4 0.10591E-18 -18.9750 0.73169E-19 -19.1357 0.69084E+00 -0.1606 90 H2S,aq 0.92570E-09 -9.0335 0.92563E-09 -9.0336 0.99992E+00 0.0000 91 S2-2 0.40199E-18 -18.3958 0.36159E-18 -18.4418 0.89950E+00 -0.0460 96 SO2,aq 0.55967E-18 -18.2521 0.55967E-18 -18.2521 0.10000E+01 0.0000 97 SO3-2 0.12162E-13 -13.9150 0.10943E-13 -13.9609 0.89977E+00 -0.0459 98 HSO3- 0.27508E-13 -13.5605 0.26431E-13 -13.5779 0.96086E+00 -0.0173 99 HSO4- 0.88209E-09 -9.0545 0.84762E-09 -9.0718 0.96091E+00 -0.0173 101 S2O3-2 0.27560E-15 -15.5597 0.24790E-15 -15.6057 0.89950E+00 -0.0460 Charge balance for all species = 0.9768E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.4014362E-07 -.2137091E-04 -.2154021E-01 0.0000 2 H2O 0.1000000E+01 0.5550827E+02 0.9999800E+06 0.0000 3 Cl- 0.1379625E-03 0.1379746E-03 0.4891524E+01 3.5361 4 SO4-- 0.2534546E-04 0.2549464E-04 0.2449012E+01 10.1853 5 HCO3- 0.1207115E-04 0.1307004E-04 0.7974827E+00 2.4781 6 HS- 0.8079782E-08 0.9898810E-08 0.3273675E-03 -0.6963 7 Al+++ 0.5327903E-19 0.1229942E-05 0.3318507E-01 2.8737 8 H4SiO4 0.7042757E-04 0.7220705E-04 0.6940084E+01 -4.1523 9 Ca++ 0.2272690E-04 0.2293260E-04 0.9190763E+00 10.1378 10 Mg++ 0.1328414E-05 0.1341900E-05 0.3262369E-01 8.9046 11 Fe++ 0.9886580E-08 0.1823526E-07 0.1018366E-02 6.7763 12 K+ 0.1570554E-05 0.1571130E-05 0.6143321E-01 1.5924 13 Na+ 0.1693468E-03 0.1693603E-03 0.3893489E+01 3.6251 14 Mn++ 0.1092277E-06 0.1180398E-06 0.6484751E-02 7.8196 15 HPO4-- 0.8428586E-08 0.1404414E-07 0.1347918E-02 6.7071 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1094930E-03 -.2137085E-04 -.8812216E-04 0.0000000E+00 2 H2O 0.5550816E+02 0.5550811E+02 0.5076068E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2570955E-04 0.2549457E-04 0.2149780E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.2050792E-06 0.9898782E-08 -.2149780E-06 0.0000000E+00 7 Al+++ 0.2412949E-04 0.1229938E-05 0.2289955E-04 0.0000000E+00 8 H4SiO4 0.7705459E-04 0.7220684E-04 0.4847754E-05 0.0000000E+00 9 Ca++ 0.2298212E-04 0.2293254E-04 0.4957662E-07 0.0000000E+00 10 Mg++ 0.5873016E-05 0.1341896E-05 0.4531119E-05 0.0000000E+00 11 Fe++ 0.5276264E-05 0.1823521E-07 0.5258028E-05 0.0000000E+00 12 K+ 0.1571125E-05 0.1571125E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1693598E-03 0.1693598E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1283056E-06 0.1180394E-06 0.1026619E-07 0.0000000E+00 15 HPO4-- 0.4379007E-07 0.1404410E-07 0.2974597E-07 0.0000000E+00 Chg. balance for solid moles: 0.1509E-20 Mass of aqueous solution: 0.100002E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0074000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.9915E-08 -8.004 0.4981E-05 -5.303 0.2136 0.1583E-05 clinochlore 0.9062E-06 -6.043 0.5037E-03 -3.298 21.60 0.1916E-03 daphnite 0.7076E-06 -6.150 0.5049E-03 -3.297 21.65 0.1530E-03 chlorite-Mn 0.2053E-08 -8.688 0.1456E-05 -5.837 0.6242E-01 0.4639E-06 diaspore 0.1967E-04 -4.706 0.1180E-02 -2.928 50.59 0.3513E-03 hematite 0.8599E-06 -6.066 0.1373E-03 -3.862 5.888 0.2603E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5608E+00 0.5608E+00 1.0000 -0.251 daphnite 0.4379E+00 0.4379E+00 1.0000 -0.359 chlorite-Mn 0.1271E-02 0.1271E-02 1.0000 -2.896 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002332 g Volume = 0.000724 cm3 Porosity: 99.9278% V(tot) - V(min): 0.10022E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0074000 g log = -2.1308 Original solution: 1000.0103000 g Original solution / Rock added: 135136.53 (Water/Rock Ratio), log = 5.1308 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.9954E-04 1.0071 0.1023E-03 0.1016E-03 CH4,gas 0.5466E-11 1.0125 0.5647E-11 0.5577E-11 H2,gas 0.4750E-05 1.0005 0.4849E-05 0.4846E-05 H2S,gas 0.2504E-07 0.9960 0.2544E-07 0.2555E-07 S2,gas 0.1013E-23 1.0000 0.1034E-23 0.1034E-23 CO,gas 0.1296E-12 1.0000 0.1322E-12 0.1322E-12 SO3,gas 0.1257E-34 1.0000 0.1283E-34 0.1283E-34 SO2,gas 0.2372E-17 1.0000 0.2420E-17 0.2420E-17 HCl,gas 0.1620E-14 1.0000 0.1654E-14 0.1654E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 -0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.24265E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.00000E+00 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.35 -5.69 -1.896 0.97140E+04 -3.990 3 CH4,gas 4.54 -8.40 -12.95 -3.237 0.22107E+05 -11.248 4 H2,gas 8.00 0.99 -7.01 -4.008 0.11975E+05 -5.314 5 H2S,gas -6.23 -15.52 -9.29 -4.647 0.15868E+05 -7.594 6 S2,gas -7.34 -33.02 -25.68 -3.951 0.43856E+05 -23.986 7 CO,gas 3.21 -11.36 -14.58 -4.485 0.24891E+05 -12.879 8 SO3,gas 17.12 -19.47 -36.59 -9.148 0.62478E+05 -34.892 9 SO2,gas 0.83 -18.48 -19.32 -5.151 0.32980E+05 -17.616 10 HCl,gas 5.19 -11.29 -16.48 -8.240 0.28140E+05 -14.782 21 andalusite 5.00 1.60 -3.41 -0.341 0.58163E+04 24 anhydrite -5.32 -9.33 -4.01 -2.007 0.68551E+04 35 aragonite 0.97 -2.21 -3.18 -1.059 0.54262E+04 36 brucite 12.57 8.90 -3.66 -0.733 0.62561E+04 37 calcite 0.81 -2.21 -3.02 -1.008 0.51620E+04 40 carpholite-Mg 8.58 6.35 -2.23 -0.149 0.38155E+04 41 carpholite-Fe 6.71 4.22 -2.49 -0.166 0.42575E+04 50 chloritoid-Mg 13.20 10.50 -2.70 -0.180 0.46067E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.053 0.13697E+04 52 chloritoid-Mn 11.40 9.41 -1.99 -0.132 0.33916E+04 54 coesite -2.38 -4.15 -1.78 -0.592 0.30328E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.15 -1.59 -0.531 0.27182E+04 75 epidote 24.67 19.85 -4.82 -0.234 0.82309E+04 78 fayalite 14.05 9.40 -4.65 -0.664 0.79318E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.02 -4.12 -0.343 0.70264E+04 92 hercynite 17.28 12.52 -4.75 -0.317 0.81187E+04 98 kaolinite -1.33 -2.56 -1.22 -0.111 0.20905E+04 99 kyanite 4.88 1.60 -3.28 -0.328 0.56022E+04 101 laumontite 2.88 -0.72 -3.61 -0.240 0.61592E+04 102 lawsonite 9.62 7.58 -2.04 -0.136 0.34753E+04 105 lizardite 23.24 18.41 -4.83 -0.403 0.82549E+04 106 magnesite 0.69 -3.44 -4.14 -1.378 0.70608E+04 107 magnetite 20.09 19.34 -0.74 -0.061 0.12719E+04 110 magnesioferrite 26.21 21.47 -4.74 -0.387 0.80962E+04 113 margarite 17.32 13.33 -4.00 -0.160 0.68222E+04 120 muscovite 2.58 -2.24 -4.83 -0.284 0.82398E+04 121 paragonite 4.24 -0.21 -4.45 -0.262 0.75983E+04 128 periclase-Fe 11.63 6.78 -4.85 -1.213 0.82817E+04 142 pyrite -21.25 -25.26 -4.01 -0.944 0.68477E+04 143 pyrrhotite -4.26 -8.75 -4.49 -1.496 0.76614E+04 144 pyrrhotiteFe0.875 -6.02 -9.72 -3.70 -1.361 0.63171E+04 145 pyroxmangite 7.40 3.67 -3.73 -0.746 0.63711E+04 146 pyrophyllite -6.18 -10.86 -4.69 -0.293 0.80009E+04 147 quartz -2.99 -4.15 -1.16 -0.388 0.19855E+04 151 rhodochrosite -0.98 -4.53 -3.55 -1.184 0.60672E+04 152 rhodonite 7.45 3.67 -3.78 -0.756 0.64514E+04 155 siderite -2.61 -5.57 -2.96 -0.988 0.50623E+04 156 sillimanite 5.26 1.60 -3.67 -0.367 0.62603E+04 168 sudoite 21.08 16.85 -4.23 -0.136 0.72229E+04 177 topaz-H 4.62 1.60 -3.02 -0.275 0.51623E+04 178 tridymite -2.63 -4.15 -1.53 -0.509 0.26055E+04 181 troilite-low -4.41 -8.75 -4.34 -1.445 0.74042E+04 187 wairakite 3.95 -0.72 -4.67 -0.275 0.79812E+04 189 wollastonite 10.46 5.99 -4.48 -0.895 0.76419E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.15 -1.35 -0.450 0.23048E+04 201 montmorillonite-Ca -2.29 -7.20 -4.91 -0.304 0.83802E+04 203 montmorillonite-Mg -2.48 -7.40 -4.92 -0.305 0.84047E+04 205 nontronite-Ca 3.21 -0.05 -3.27 -0.212 0.55767E+04 206 nontronite-H 2.53 -1.72 -4.26 -0.285 0.72687E+04 207 nontronite-K 3.34 -1.20 -4.54 -0.291 0.77511E+04 208 nontronite-Mg 3.07 -0.26 -3.33 -0.216 0.56853E+04 209 nontronite-Na 3.52 -0.53 -4.05 -0.260 0.69113E+04 214 gypsum -4.96 -9.33 -4.38 -1.094 0.74727E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.78 -3.04 -0.759 0.51826E+04 240 silica-amorphous -2.09 -4.15 -2.06 -0.687 0.35190E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0074000 g New total amount of reactant added: 0.0076000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9765E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0076000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2669619E-03 Osmotic coef. = 0.9902 True ionic strength = .2696743E-03 Chg. balance for total moles = 0.9765E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.39062E-07 -7.4082 0.37536E-07 -7.4255 0.96095E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13256E-03 -3.8776 0.96083E+00 -0.0174 4 SO4-- 0.25346E-04 -4.5961 0.22797E-04 -4.6421 0.89944E+00 -0.0460 5 HCO3- 0.12094E-04 -4.9174 0.11621E-04 -4.9348 0.96086E+00 -0.0173 6 HS- 0.63911E-08 -8.1944 0.61408E-08 -8.2118 0.96083E+00 -0.0174 7 Al+++ 0.49096E-19 -19.3090 0.39542E-19 -19.4029 0.80540E+00 -0.0940 8 H4SiO4 0.72202E-04 -4.1415 0.72202E-04 -4.1415 0.10000E+01 0.0000 9 Ca++ 0.22950E-04 -4.6392 0.20639E-04 -4.6853 0.89931E+00 -0.0461 10 Mg++ 0.12495E-05 -5.9033 0.11236E-05 -5.9494 0.89923E+00 -0.0461 11 Fe++ 0.91223E-08 -8.0399 0.82032E-08 -8.0860 0.89925E+00 -0.0461 12 K+ 0.16130E-05 -5.7924 0.15499E-05 -5.8097 0.96086E+00 -0.0173 13 Na+ 0.16960E-03 -3.7706 0.16295E-03 -3.7879 0.96083E+00 -0.0174 14 Mn++ 0.11093E-06 -6.9550 0.99754E-07 -7.0011 0.89926E+00 -0.0461 15 HPO4-- 0.79980E-08 -8.0970 0.71937E-08 -8.1430 0.89944E+00 -0.0460 16 HSiO3- 0.18693E-05 -5.7283 0.17961E-05 -5.7457 0.96083E+00 -0.0174 17 Ca(HSiO3)+ 0.87859E-09 -9.0562 0.84421E-09 -9.0735 0.96087E+00 -0.0173 18 Mg(HSiO3)+ 0.59525E-10 -10.2253 0.57196E-10 -10.2426 0.96087E+00 -0.0173 19 NaHSiO3,aq 0.47336E-08 -8.3248 0.47336E-08 -8.3248 0.10000E+01 0.0000 20 AlO+ 0.39734E-11 -11.4008 0.38179E-11 -11.4182 0.96087E+00 -0.0173 21 AlOH+2 0.79353E-15 -15.1004 0.71360E-15 -15.1465 0.89928E+00 -0.0461 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.12433E-05 -5.9054 0.11945E-05 -5.9228 0.96080E+00 -0.0174 24 CH4,aq 0.30409E-14 -14.5170 0.30406E-14 -14.5170 0.99992E+00 0.0000 29 CO,aq 0.82117E-16 -16.0856 0.82117E-16 -16.0856 0.10000E+01 0.0000 30 CO2,aq 0.93213E-06 -6.0305 0.93205E-06 -6.0306 0.99992E+00 0.0000 31 CO3-2 0.30065E-07 -7.5219 0.27041E-07 -7.5680 0.89940E+00 -0.0460 32 CaCO3,aq 0.69980E-08 -8.1550 0.69980E-08 -8.1550 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.63715E-08 -8.1958 0.61222E-08 -8.2131 0.96087E+00 -0.0173 34 CaCl+ 0.46079E-08 -8.3365 0.44276E-08 -8.3538 0.96087E+00 -0.0173 35 CaCl2,aq 0.13944E-12 -12.8556 0.13944E-12 -12.8556 0.10000E+01 0.0000 36 CaOH+ 0.40783E-07 -7.3895 0.39187E-07 -7.4069 0.96087E+00 -0.0173 37 CaSO4,aq 0.14941E-06 -6.8256 0.14941E-06 -6.8256 0.10000E+01 0.0000 38 HCl,aq 0.91179E-12 -12.0401 0.91179E-12 -12.0401 0.10000E+01 0.0000 43 FeCl+ 0.17913E-11 -11.7468 0.17212E-11 -11.7642 0.96087E+00 -0.0173 46 FeO,aq 0.22628E-09 -9.6454 0.22628E-09 -9.6454 0.10000E+01 0.0000 47 FeOH+ 0.74034E-08 -8.1306 0.71137E-08 -8.1479 0.96087E+00 -0.0173 48 HFeO2- 0.65645E-10 -10.1828 0.63074E-10 -10.2002 0.96083E+00 -0.0174 49 FeO+ 0.29818E-12 -12.5255 0.28651E-12 -12.5429 0.96087E+00 -0.0173 50 FeOH+2 0.22839E-17 -17.6413 0.20538E-17 -17.6874 0.89928E+00 -0.0461 51 FeO2- 0.43305E-10 -10.3635 0.41609E-10 -10.3808 0.96083E+00 -0.0174 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.35075E-08 -8.4550 0.35072E-08 -8.4550 0.99992E+00 0.0000 54 KCl,aq 0.37236E-11 -11.4290 0.37236E-11 -11.4290 0.10000E+01 0.0000 55 KHSO4,aq 0.37499E-17 -17.4260 0.37499E-17 -17.4260 0.10000E+01 0.0000 56 KOH,aq 0.17633E-10 -10.7537 0.17633E-10 -10.7537 0.10000E+01 0.0000 57 KSO4- 0.57063E-09 -9.2436 0.54828E-09 -9.2610 0.96083E+00 -0.0174 58 MgCO3,aq 0.95492E-10 -10.0200 0.95492E-10 -10.0200 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.35443E-09 -9.4505 0.34056E-09 -9.4678 0.96087E+00 -0.0173 60 MgCl+ 0.22736E-09 -9.6433 0.21846E-09 -9.6606 0.96087E+00 -0.0173 61 MgOH+ 0.12286E-07 -7.9106 0.11805E-07 -7.9279 0.96087E+00 -0.0173 63 MnO,aq 0.73319E-10 -10.1348 0.73319E-10 -10.1348 0.10000E+01 0.0000 64 MnOH+ 0.83633E-08 -8.0776 0.80360E-08 -8.0950 0.96087E+00 -0.0173 65 MnO2-2 0.19201E-17 -17.7167 0.17269E-17 -17.7627 0.89940E+00 -0.0460 66 HMnO2- 0.14781E-13 -13.8303 0.14202E-13 -13.8477 0.96083E+00 -0.0174 69 MnCl+ 0.84744E-10 -10.0719 0.81428E-10 -10.0892 0.96087E+00 -0.0173 70 MnSO4,aq 0.65651E-09 -9.1828 0.65651E-09 -9.1828 0.10000E+01 0.0000 71 NaCl,aq 0.71586E-08 -8.1452 0.71586E-08 -8.1452 0.10000E+01 0.0000 72 NaOH,aq 0.18652E-08 -8.7293 0.18652E-08 -8.7293 0.10000E+01 0.0000 74 OH- 0.16020E-04 -4.7953 0.15392E-04 -4.8127 0.96080E+00 -0.0174 79 HPO3-2 0.87418E-19 -19.0584 0.78623E-19 -19.1044 0.89940E+00 -0.0460 82 H3PO4,aq 0.70889E-13 -13.1494 0.70889E-13 -13.1494 0.10000E+01 0.0000 83 H2PO4- 0.51842E-08 -8.2853 0.49812E-08 -8.3027 0.96085E+00 -0.0173 84 PO4-3 0.19395E-12 -12.7123 0.15636E-12 -12.8059 0.80620E+00 -0.0936 87 H2P2O7-2 0.21632E-17 -17.6649 0.19456E-17 -17.7110 0.89940E+00 -0.0460 88 HP2O7-3 0.12850E-16 -16.8911 0.10350E-16 -16.9851 0.80541E+00 -0.0940 89 P2O7-4 0.95390E-19 -19.0205 0.65868E-19 -19.1813 0.69052E+00 -0.1608 90 H2S,aq 0.71246E-09 -9.1472 0.71240E-09 -9.1473 0.99992E+00 0.0000 91 S2-2 0.26489E-18 -18.5769 0.23825E-18 -18.6230 0.89940E+00 -0.0460 96 SO2,aq 0.50310E-18 -18.2983 0.50310E-18 -18.2983 0.10000E+01 0.0000 97 SO3-2 0.11549E-13 -13.9375 0.10390E-13 -13.9834 0.89966E+00 -0.0459 98 HSO3- 0.25414E-13 -13.5949 0.24419E-13 -13.6123 0.96083E+00 -0.0174 99 HSO4- 0.85824E-09 -9.0664 0.82467E-09 -9.0837 0.96089E+00 -0.0173 101 S2O3-2 0.21212E-15 -15.6734 0.19078E-15 -15.7195 0.89940E+00 -0.0460 Charge balance for all species = 0.9768E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3906192E-07 -.2206121E-04 -.2223597E-01 0.0000 2 H2O 0.1000000E+01 0.5550827E+02 0.9999798E+06 0.0000 3 Cl- 0.1379625E-03 0.1379746E-03 0.4891524E+01 3.5480 4 SO4-- 0.2534595E-04 0.2549659E-04 0.2449199E+01 10.2090 5 HCO3- 0.1209402E-04 0.1307004E-04 0.7974826E+00 2.4908 6 HS- 0.6391104E-08 0.7950158E-08 0.2629228E-03 -0.7862 7 Al+++ 0.4909572E-19 0.1263512E-05 0.3409084E-01 2.8737 8 H4SiO4 0.7220195E-04 0.7407690E-04 0.7119801E+01 -4.1415 9 Ca++ 0.2295018E-04 0.2315923E-04 0.9281585E+00 10.1658 10 Mg++ 0.1249513E-05 0.1262535E-05 0.3069420E-01 8.9017 11 Fe++ 0.9122333E-08 0.1706170E-07 0.9528271E-03 6.7651 12 K+ 0.1613001E-05 0.1613593E-05 0.6309356E-01 1.6158 13 Na+ 0.1695976E-03 0.1696114E-03 0.3899260E+01 3.6376 14 Mn++ 0.1109289E-06 0.1201068E-06 0.6598307E-02 7.8500 15 HPO4-- 0.7997960E-08 0.1318243E-07 0.1265213E-02 6.7080 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1128047E-03 -.2206115E-04 -.9074357E-04 0.0000000E+00 2 H2O 0.5550815E+02 0.5550810E+02 0.5216907E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2571509E-04 0.2549652E-04 0.2185720E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.2106219E-06 0.7950135E-08 -.2185720E-06 0.0000000E+00 7 Al+++ 0.2478164E-04 0.1263509E-05 0.2351813E-04 0.0000000E+00 8 H4SiO4 0.7913715E-04 0.7407669E-04 0.5060465E-05 0.0000000E+00 9 Ca++ 0.2321214E-04 0.2315916E-04 0.5298532E-07 0.0000000E+00 10 Mg++ 0.6031746E-05 0.1262532E-05 0.4769214E-05 0.0000000E+00 11 Fe++ 0.5418865E-05 0.1706165E-07 0.5401804E-05 0.0000000E+00 12 K+ 0.1613588E-05 0.1613588E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1696109E-03 0.1696109E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1317733E-06 0.1201064E-06 0.1166689E-07 0.0000000E+00 15 HPO4-- 0.4497358E-07 0.1318239E-07 0.3179119E-07 0.0000000E+00 Chg. balance for solid moles: -.7226E-20 Mass of aqueous solution: 0.100002E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0076000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.1060E-07 -7.975 0.5323E-05 -5.274 0.2212 0.1691E-05 clinochlore 0.9538E-06 -6.021 0.5302E-03 -3.276 22.03 0.2017E-03 daphnite 0.7306E-06 -6.136 0.5213E-03 -3.283 21.66 0.1580E-03 chlorite-Mn 0.2333E-08 -8.632 0.1654E-05 -5.781 0.6874E-01 0.5272E-06 diaspore 0.2014E-04 -4.696 0.1208E-02 -2.918 50.22 0.3598E-03 hematite 0.8743E-06 -6.058 0.1396E-03 -3.855 5.802 0.2646E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5655E+00 0.5655E+00 1.0000 -0.248 daphnite 0.4331E+00 0.4331E+00 1.0000 -0.363 chlorite-Mn 0.1383E-02 0.1383E-02 1.0000 -2.859 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002407 g Volume = 0.000748 cm3 Porosity: 99.9254% V(tot) - V(min): 0.10023E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0076000 g log = -2.1192 Original solution: 1000.0103000 g Original solution / Rock added: 131580.30 (Water/Rock Ratio), log = 5.1192 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.9704E-04 1.0071 0.9972E-04 0.9902E-04 CH4,gas 0.4332E-11 1.0125 0.4476E-11 0.4420E-11 H2,gas 0.4510E-05 1.0005 0.4605E-05 0.4602E-05 H2S,gas 0.1927E-07 0.9960 0.1958E-07 0.1966E-07 S2,gas 0.6654E-24 1.0000 0.6790E-24 0.6790E-24 CO,gas 0.1199E-12 1.0000 0.1224E-12 0.1224E-12 SO3,gas 0.1190E-34 1.0000 0.1214E-34 0.1214E-34 SO2,gas 0.2132E-17 1.0000 0.2176E-17 0.2176E-17 HCl,gas 0.1577E-14 1.0000 0.1609E-14 0.1609E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 0.36397E-10 47 daphnite 28.97 28.97 0.00 0.000 0.60662E-11 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.12132E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.36 -5.70 -1.900 0.97329E+04 -4.001 3 CH4,gas 4.54 -8.50 -13.05 -3.262 0.22279E+05 -11.349 4 H2,gas 8.00 0.96 -7.04 -4.020 0.12013E+05 -5.337 5 H2S,gas -6.23 -15.64 -9.41 -4.704 0.16062E+05 -7.708 6 S2,gas -7.34 -33.20 -25.87 -3.980 0.44167E+05 -24.168 7 CO,gas 3.21 -11.40 -14.61 -4.496 0.24948E+05 -12.912 8 SO3,gas 17.12 -19.49 -36.61 -9.154 0.62518E+05 -34.916 9 SO2,gas 0.83 -18.53 -19.36 -5.163 0.33059E+05 -17.662 10 HCl,gas 5.19 -11.30 -16.49 -8.246 0.28160E+05 -14.793 21 andalusite 5.00 1.61 -3.40 -0.340 0.57979E+04 24 anhydrite -5.32 -9.33 -4.01 -2.005 0.68480E+04 35 aragonite 0.97 -2.19 -3.16 -1.054 0.53974E+04 36 brucite 12.57 8.90 -3.67 -0.733 0.62611E+04 37 calcite 0.81 -2.19 -3.01 -1.002 0.51332E+04 40 carpholite-Mg 8.58 6.37 -2.22 -0.148 0.37836E+04 41 carpholite-Fe 6.71 4.23 -2.48 -0.166 0.42398E+04 50 chloritoid-Mg 13.20 10.51 -2.69 -0.179 0.45932E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.054 0.13704E+04 52 chloritoid-Mn 11.40 9.46 -1.95 -0.130 0.33212E+04 54 coesite -2.38 -4.14 -1.77 -0.588 0.30144E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.14 -1.58 -0.527 0.26997E+04 75 epidote 24.67 19.94 -4.73 -0.229 0.80801E+04 78 fayalite 14.05 9.39 -4.66 -0.665 0.79517E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.01 -4.13 -0.344 0.70470E+04 92 hercynite 17.28 12.51 -4.77 -0.318 0.81379E+04 98 kaolinite -1.33 -2.54 -1.20 -0.109 0.20536E+04 99 kyanite 4.88 1.61 -3.27 -0.327 0.55838E+04 101 laumontite 2.88 -0.65 -3.54 -0.236 0.60377E+04 102 lawsonite 9.62 7.63 -1.99 -0.132 0.33907E+04 105 lizardite 23.24 18.42 -4.82 -0.402 0.82328E+04 106 magnesite 0.69 -3.46 -4.15 -1.383 0.70847E+04 107 magnetite 20.09 19.33 -0.76 -0.062 0.12911E+04 110 magnesioferrite 26.21 21.47 -4.74 -0.387 0.81011E+04 113 margarite 17.32 13.38 -3.95 -0.158 0.67376E+04 120 muscovite 2.58 -2.19 -4.77 -0.281 0.81444E+04 121 paragonite 4.24 -0.17 -4.41 -0.259 0.75216E+04 128 periclase-Fe 11.63 6.77 -4.86 -1.215 0.83009E+04 142 pyrite -21.25 -25.47 -4.23 -0.994 0.72168E+04 143 pyrrhotite -4.26 -8.87 -4.61 -1.537 0.78747E+04 144 pyrrhotiteFe0.875 -6.02 -9.84 -3.82 -1.405 0.65233E+04 145 pyroxmangite 7.40 3.71 -3.69 -0.738 0.63008E+04 146 pyrophyllite -6.18 -10.82 -4.64 -0.290 0.79271E+04 147 quartz -2.99 -4.14 -1.15 -0.384 0.19670E+04 151 rhodochrosite -0.98 -4.51 -3.53 -1.178 0.60342E+04 152 rhodonite 7.45 3.71 -3.74 -0.747 0.63810E+04 155 siderite -2.61 -5.60 -2.99 -0.996 0.51004E+04 156 sillimanite 5.26 1.61 -3.66 -0.366 0.62418E+04 168 sudoite 21.08 16.87 -4.20 -0.136 0.71774E+04 177 topaz-H 4.62 1.61 -3.01 -0.274 0.51438E+04 178 tridymite -2.63 -4.14 -1.52 -0.505 0.25870E+04 181 troilite-low -4.41 -8.87 -4.46 -1.487 0.76175E+04 187 wairakite 3.95 -0.65 -4.60 -0.271 0.78596E+04 189 wollastonite 10.46 6.02 -4.44 -0.887 0.75757E+04 190 pseudo-wollastonite 11.00 6.02 -4.98 -0.995 0.84956E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.14 -1.34 -0.446 0.22863E+04 201 montmorillonite-Ca -2.29 -7.15 -4.86 -0.301 0.83002E+04 203 montmorillonite-Mg -2.48 -7.36 -4.88 -0.302 0.83333E+04 205 nontronite-Ca 3.21 -0.01 -3.22 -0.209 0.55011E+04 206 nontronite-H 2.53 -1.68 -4.22 -0.283 0.72010E+04 207 nontronite-K 3.34 -1.15 -4.49 -0.288 0.76701E+04 208 nontronite-Mg 3.07 -0.22 -3.29 -0.213 0.56184E+04 209 nontronite-Na 3.52 -0.48 -4.00 -0.257 0.68366E+04 214 gypsum -4.96 -9.33 -4.37 -1.093 0.74656E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.77 -3.05 -0.762 0.52018E+04 240 silica-amorphous -2.09 -4.14 -2.05 -0.683 0.35005E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0076000 g New total amount of reactant added: 0.0078000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9764E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0078000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2675692E-03 Osmotic coef. = 0.9902 True ionic strength = .2704189E-03 Chg. balance for total moles = 0.9764E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.38020E-07 -7.4200 0.36535E-07 -7.4373 0.96092E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13255E-03 -3.8776 0.96080E+00 -0.0174 4 SO4-- 0.25346E-04 -4.5961 0.22794E-04 -4.6422 0.89933E+00 -0.0461 5 HCO3- 0.12116E-04 -4.9166 0.11641E-04 -4.9340 0.96083E+00 -0.0174 6 HS- 0.51015E-08 -8.2923 0.49015E-08 -8.3097 0.96081E+00 -0.0174 7 Al+++ 0.45281E-19 -19.3441 0.36459E-19 -19.4382 0.80519E+00 -0.0941 8 H4SiO4 0.73978E-04 -4.1309 0.73978E-04 -4.1309 0.10000E+01 0.0000 9 Ca++ 0.23174E-04 -4.6350 0.20838E-04 -4.6812 0.89920E+00 -0.0461 10 Mg++ 0.11755E-05 -5.9298 0.10569E-05 -5.9760 0.89912E+00 -0.0462 11 Fe++ 0.84314E-08 -8.0741 0.75810E-08 -8.1203 0.89914E+00 -0.0462 12 K+ 0.16554E-05 -5.7811 0.15906E-05 -5.7984 0.96084E+00 -0.0174 13 Na+ 0.16985E-03 -3.7699 0.16319E-03 -3.7873 0.96080E+00 -0.0174 14 Mn++ 0.11251E-06 -6.9488 0.10116E-06 -6.9950 0.89915E+00 -0.0462 15 HPO4-- 0.75935E-08 -8.1196 0.68291E-08 -8.1656 0.89933E+00 -0.0461 16 HSiO3- 0.19678E-05 -5.7060 0.18907E-05 -5.7234 0.96080E+00 -0.0174 17 Ca(HSiO3)+ 0.93381E-09 -9.0297 0.89724E-09 -9.0471 0.96084E+00 -0.0173 18 Mg(HSiO3)+ 0.58947E-10 -10.2295 0.56638E-10 -10.2469 0.96084E+00 -0.0173 19 NaHSiO3,aq 0.49903E-08 -8.3019 0.49903E-08 -8.3019 0.10000E+01 0.0000 20 AlO+ 0.38675E-11 -11.4126 0.37160E-11 -11.4299 0.96084E+00 -0.0173 21 AlOH+2 0.75182E-15 -15.1239 0.67602E-15 -15.1700 0.89917E+00 -0.0462 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.12774E-05 -5.8937 0.12273E-05 -5.9111 0.96077E+00 -0.0174 24 CH4,aq 0.24319E-14 -14.6141 0.24317E-14 -14.6141 0.99992E+00 0.0000 29 CO,aq 0.76197E-16 -16.1181 0.76197E-16 -16.1181 0.10000E+01 0.0000 30 CO2,aq 0.90888E-06 -6.0415 0.90880E-06 -6.0415 0.99992E+00 0.0000 31 CO3-2 0.30949E-07 -7.5094 0.27832E-07 -7.5555 0.89929E+00 -0.0461 32 CaCO3,aq 0.72720E-08 -8.1383 0.72720E-08 -8.1383 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.64445E-08 -8.1908 0.61921E-08 -8.2082 0.96084E+00 -0.0173 34 CaCl+ 0.46522E-08 -8.3323 0.44700E-08 -8.3497 0.96084E+00 -0.0173 35 CaCl2,aq 0.14077E-12 -12.8515 0.14077E-12 -12.8515 0.10000E+01 0.0000 36 CaOH+ 0.42305E-07 -7.3736 0.40649E-07 -7.3910 0.96084E+00 -0.0173 37 CaSO4,aq 0.15083E-06 -6.8215 0.15083E-06 -6.8215 0.10000E+01 0.0000 38 HCl,aq 0.88743E-12 -12.0519 0.88743E-12 -12.0519 0.10000E+01 0.0000 43 FeCl+ 0.16554E-11 -11.7811 0.15906E-11 -11.7984 0.96084E+00 -0.0173 46 FeO,aq 0.22074E-09 -9.6561 0.22074E-09 -9.6561 0.10000E+01 0.0000 47 FeOH+ 0.70296E-08 -8.1531 0.67544E-08 -8.1704 0.96084E+00 -0.0173 48 HFeO2- 0.65797E-10 -10.1818 0.63218E-10 -10.1992 0.96080E+00 -0.0174 49 FeO+ 0.29023E-12 -12.5373 0.27886E-12 -12.5546 0.96084E+00 -0.0173 50 FeOH+2 0.21638E-17 -17.6648 0.19456E-17 -17.7109 0.89917E+00 -0.0462 51 FeO2- 0.44494E-10 -10.3517 0.42750E-10 -10.3691 0.96080E+00 -0.0174 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.33379E-08 -8.4765 0.33376E-08 -8.4766 0.99992E+00 0.0000 54 KCl,aq 0.38214E-11 -11.4178 0.38214E-11 -11.4178 0.10000E+01 0.0000 55 KHSO4,aq 0.37453E-17 -17.4265 0.37453E-17 -17.4265 0.10000E+01 0.0000 56 KOH,aq 0.18593E-10 -10.7307 0.18593E-10 -10.7307 0.10000E+01 0.0000 57 KSO4- 0.58558E-09 -9.2324 0.56262E-09 -9.2498 0.96080E+00 -0.0174 58 MgCO3,aq 0.92456E-10 -10.0341 0.92456E-10 -10.0341 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.33401E-09 -9.4762 0.32093E-09 -9.4936 0.96084E+00 -0.0173 60 MgCl+ 0.21387E-09 -9.6699 0.20549E-09 -9.6872 0.96084E+00 -0.0173 61 MgOH+ 0.11874E-07 -7.9254 0.11409E-07 -7.9428 0.96084E+00 -0.0173 63 MnO,aq 0.78486E-10 -10.1052 0.78486E-10 -10.1052 0.10000E+01 0.0000 64 MnOH+ 0.87140E-08 -8.0598 0.83727E-08 -8.0771 0.96084E+00 -0.0173 65 MnO2-2 0.21700E-17 -17.6635 0.19514E-17 -17.7096 0.89929E+00 -0.0461 66 HMnO2- 0.16257E-13 -13.7890 0.15620E-13 -13.8063 0.96080E+00 -0.0174 69 MnCl+ 0.85938E-10 -10.0658 0.82573E-10 -10.0832 0.96084E+00 -0.0173 70 MnSO4,aq 0.66569E-09 -9.1767 0.66569E-09 -9.1767 0.10000E+01 0.0000 71 NaCl,aq 0.71688E-08 -8.1446 0.71688E-08 -8.1446 0.10000E+01 0.0000 72 NaOH,aq 0.19191E-08 -8.7169 0.19191E-08 -8.7169 0.10000E+01 0.0000 74 OH- 0.16460E-04 -4.7836 0.15814E-04 -4.8009 0.96077E+00 -0.0174 79 HPO3-2 0.78984E-19 -19.1025 0.71030E-19 -19.1486 0.89929E+00 -0.0461 82 H3PO4,aq 0.63752E-13 -13.1955 0.63752E-13 -13.1955 0.10000E+01 0.0000 83 H2PO4- 0.47902E-08 -8.3196 0.46026E-08 -8.3370 0.96082E+00 -0.0174 84 PO4-3 0.18922E-12 -12.7230 0.15251E-12 -12.8167 0.80599E+00 -0.0937 87 H2P2O7-2 0.18470E-17 -17.7335 0.16610E-17 -17.7796 0.89929E+00 -0.0461 88 HP2O7-3 0.11274E-16 -16.9479 0.90780E-17 -17.0420 0.80519E+00 -0.0941 89 P2O7-4 0.86006E-19 -19.0655 0.59360E-19 -19.2265 0.69019E+00 -0.1610 90 H2S,aq 0.55350E-09 -9.2569 0.55345E-09 -9.2569 0.99992E+00 0.0000 91 S2-2 0.17736E-18 -18.7511 0.15950E-18 -18.7972 0.89929E+00 -0.0461 96 SO2,aq 0.45351E-18 -18.3434 0.45351E-18 -18.3434 0.10000E+01 0.0000 97 SO3-2 0.10990E-13 -13.9590 0.98863E-14 -14.0050 0.89956E+00 -0.0460 98 HSO3- 0.23538E-13 -13.6282 0.22615E-13 -13.6456 0.96080E+00 -0.0174 99 HSO4- 0.83526E-09 -9.0782 0.80257E-09 -9.0955 0.96086E+00 -0.0173 101 S2O3-2 0.16479E-15 -15.7831 0.14819E-15 -15.8292 0.89929E+00 -0.0461 Charge balance for all species = 0.9768E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3802044E-07 -.2276356E-04 -.2294388E-01 0.0000 2 H2O 0.1000000E+01 0.5550827E+02 0.9999796E+06 0.0000 3 Cl- 0.1379625E-03 0.1379746E-03 0.4891523E+01 3.5597 4 SO4-- 0.2534598E-04 0.2549809E-04 0.2449342E+01 10.2324 5 HCO3- 0.1211607E-04 0.1307004E-04 0.7974825E+00 2.5033 6 HS- 0.5101477E-08 0.6459027E-08 0.2136090E-03 -0.8724 7 Al+++ 0.4528060E-19 0.1297644E-05 0.3501174E-01 2.8737 8 H4SiO4 0.7397808E-04 0.7595190E-04 0.7300013E+01 -4.1309 9 Ca++ 0.2317352E-04 0.2338595E-04 0.9372450E+00 10.1934 10 Mg++ 0.1175529E-05 0.1188102E-05 0.2888460E-01 8.8986 11 Fe++ 0.8431361E-08 0.1599263E-07 0.8931237E-03 6.7543 12 K+ 0.1655448E-05 0.1656056E-05 0.6475390E-01 1.6389 13 Na+ 0.1698483E-03 0.1698624E-03 0.3905031E+01 3.6500 14 Mn++ 0.1125051E-06 0.1220491E-06 0.6705012E-02 7.8796 15 HPO4-- 0.7593488E-08 0.1238397E-07 0.1188579E-02 6.7090 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1161164E-03 -.2276349E-04 -.9335293E-04 0.0000000E+00 2 H2O 0.5550815E+02 0.5550810E+02 0.5357656E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2572063E-04 0.2549801E-04 0.2226236E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.2161646E-06 0.6459007E-08 -.2226236E-06 0.0000000E+00 7 Al+++ 0.2543378E-04 0.1297640E-05 0.2413614E-04 0.0000000E+00 8 H4SiO4 0.8121971E-04 0.7595167E-04 0.5268034E-05 0.0000000E+00 9 Ca++ 0.2344217E-04 0.2338588E-04 0.5628861E-07 0.0000000E+00 10 Mg++ 0.6190476E-05 0.1188098E-05 0.5002378E-05 0.0000000E+00 11 Fe++ 0.5561467E-05 0.1599258E-07 0.5545474E-05 0.0000000E+00 12 K+ 0.1656051E-05 0.1656051E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1698619E-03 0.1698619E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1352410E-06 0.1220488E-06 0.1319227E-07 0.0000000E+00 15 HPO4-- 0.4615710E-07 0.1238393E-07 0.3377317E-07 0.0000000E+00 Chg. balance for solid moles: -.2209E-19 Mass of aqueous solution: 0.100002E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0078000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.1126E-07 -7.949 0.5655E-05 -5.248 0.2280 0.1797E-05 clinochlore 0.1000E-05 -6.000 0.5561E-03 -3.255 22.42 0.2115E-03 daphnite 0.7529E-06 -6.123 0.5372E-03 -3.270 21.66 0.1628E-03 chlorite-Mn 0.2638E-08 -8.579 0.1871E-05 -5.728 0.7542E-01 0.5961E-06 diaspore 0.2062E-04 -4.686 0.1237E-02 -2.908 49.88 0.3683E-03 hematite 0.8905E-06 -6.050 0.1422E-03 -3.847 5.734 0.2695E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5697E+00 0.5697E+00 1.0000 -0.244 daphnite 0.4288E+00 0.4288E+00 1.0000 -0.368 chlorite-Mn 0.1503E-02 0.1503E-02 1.0000 -2.823 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002480 g Volume = 0.000772 cm3 Porosity: 99.9230% V(tot) - V(min): 0.10023E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0078000 g log = -2.1079 Original solution: 1000.0103000 g Original solution / Rock added: 128206.45 (Water/Rock Ratio), log = 5.1079 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.9462E-04 1.0071 0.9723E-04 0.9655E-04 CH4,gas 0.3464E-11 1.0125 0.3579E-11 0.3535E-11 H2,gas 0.4292E-05 1.0005 0.4382E-05 0.4379E-05 H2S,gas 0.1497E-07 0.9960 0.1521E-07 0.1527E-07 S2,gas 0.4435E-24 1.0000 0.4525E-24 0.4525E-24 CO,gas 0.1113E-12 1.0000 0.1135E-12 0.1135E-12 SO3,gas 0.1127E-34 1.0000 0.1150E-34 0.1150E-34 SO2,gas 0.1922E-17 1.0000 0.1961E-17 0.1961E-17 HCl,gas 0.1535E-14 1.0000 0.1566E-14 0.1566E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.60662E-11 46 clinochlore 39.07 39.07 0.00 0.000 -0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.18198E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.00000E+00 65 diaspore 2.87 2.87 0.00 0.000 -0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.37 -5.71 -1.904 0.97517E+04 -4.012 3 CH4,gas 4.54 -8.60 -13.15 -3.286 0.22445E+05 -11.446 4 H2,gas 8.00 0.94 -7.06 -4.033 0.12050E+05 -5.358 5 H2S,gas -6.23 -15.75 -9.52 -4.758 0.16250E+05 -7.818 6 S2,gas -7.34 -33.38 -26.04 -4.007 0.44468E+05 -24.344 7 CO,gas 3.21 -11.43 -14.64 -4.506 0.25004E+05 -12.945 8 SO3,gas 17.12 -19.52 -36.64 -9.160 0.62559E+05 -34.939 9 SO2,gas 0.83 -18.57 -19.41 -5.175 0.33136E+05 -17.707 10 HCl,gas 5.19 -11.31 -16.50 -8.252 0.28180E+05 -14.805 21 andalusite 5.00 1.62 -3.39 -0.339 0.57798E+04 24 anhydrite -5.32 -9.32 -4.01 -2.003 0.68410E+04 35 aragonite 0.97 -2.18 -3.14 -1.048 0.53689E+04 36 brucite 12.57 8.90 -3.67 -0.734 0.62663E+04 37 calcite 0.81 -2.18 -2.99 -0.997 0.51047E+04 40 carpholite-Mg 8.58 6.38 -2.20 -0.147 0.37528E+04 41 carpholite-Fe 6.71 4.24 -2.47 -0.165 0.42221E+04 50 chloritoid-Mg 13.20 10.52 -2.68 -0.179 0.45804E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.054 0.13708E+04 52 chloritoid-Mn 11.40 9.50 -1.90 -0.127 0.32527E+04 54 coesite -2.38 -4.13 -1.75 -0.585 0.29963E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.13 -1.57 -0.524 0.26817E+04 75 epidote 24.67 20.02 -4.65 -0.225 0.79316E+04 78 fayalite 14.05 9.38 -4.67 -0.667 0.79705E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 12.00 -4.14 -0.345 0.70661E+04 92 hercynite 17.28 12.50 -4.78 -0.318 0.81563E+04 98 kaolinite -1.33 -2.51 -1.18 -0.107 0.20176E+04 99 kyanite 4.88 1.62 -3.26 -0.326 0.55657E+04 101 laumontite 2.88 -0.58 -3.47 -0.231 0.59184E+04 102 lawsonite 9.62 7.68 -1.94 -0.129 0.33074E+04 105 lizardite 23.24 18.43 -4.81 -0.401 0.82125E+04 106 magnesite 0.69 -3.47 -4.16 -1.388 0.71086E+04 107 magnetite 20.09 19.32 -0.77 -0.063 0.13095E+04 110 magnesioferrite 26.21 21.46 -4.75 -0.388 0.81063E+04 113 margarite 17.32 13.43 -3.90 -0.156 0.66543E+04 120 muscovite 2.58 -2.13 -4.72 -0.277 0.80510E+04 121 paragonite 4.24 -0.12 -4.36 -0.257 0.74464E+04 128 periclase-Fe 11.63 6.75 -4.87 -1.218 0.83193E+04 142 pyrite -21.25 -25.68 -4.44 -1.044 0.75729E+04 143 pyrrhotite -4.26 -8.99 -4.73 -1.577 0.80803E+04 144 pyrrhotiteFe0.875 -6.02 -9.95 -3.94 -1.448 0.67221E+04 145 pyroxmangite 7.40 3.75 -3.65 -0.730 0.62322E+04 146 pyrophyllite -6.18 -10.78 -4.60 -0.288 0.78551E+04 147 quartz -2.99 -4.13 -1.14 -0.380 0.19490E+04 151 rhodochrosite -0.98 -4.49 -3.52 -1.172 0.60024E+04 152 rhodonite 7.45 3.75 -3.70 -0.739 0.63125E+04 155 siderite -2.61 -5.62 -3.01 -1.003 0.51375E+04 156 sillimanite 5.26 1.62 -3.65 -0.365 0.62238E+04 168 sudoite 21.08 16.90 -4.18 -0.135 0.71338E+04 177 topaz-H 4.62 1.62 -3.00 -0.273 0.51258E+04 178 tridymite -2.63 -4.13 -1.50 -0.502 0.25690E+04 181 troilite-low -4.41 -8.99 -4.58 -1.527 0.78231E+04 187 wairakite 3.95 -0.58 -4.53 -0.267 0.77403E+04 189 wollastonite 10.46 6.06 -4.40 -0.880 0.75105E+04 190 pseudo-wollastonite 11.00 6.06 -4.94 -0.987 0.84303E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.13 -1.33 -0.443 0.22683E+04 201 montmorillonite-Ca -2.29 -7.11 -4.82 -0.298 0.82220E+04 203 montmorillonite-Mg -2.48 -7.32 -4.84 -0.299 0.82638E+04 205 nontronite-Ca 3.21 0.04 -3.18 -0.206 0.54272E+04 206 nontronite-H 2.53 -1.65 -4.18 -0.280 0.71348E+04 207 nontronite-K 3.34 -1.11 -4.45 -0.285 0.75910E+04 208 nontronite-Mg 3.07 -0.18 -3.25 -0.211 0.55531E+04 209 nontronite-Na 3.52 -0.44 -3.96 -0.254 0.67635E+04 214 gypsum -4.96 -9.32 -4.37 -1.092 0.74586E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.75 -3.06 -0.764 0.52202E+04 240 silica-amorphous -2.09 -4.13 -2.04 -0.680 0.34825E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0078000 g New total amount of reactant added: 0.0080000 g Solids and gases carried Charge balance check after fractionation or titration: TBAL = 0.9765E-15 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 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 = 6 Loop limit = 400 Temperature = 100.00 C Pressure = 50.00 bar Mixer fraction = 0.0080000 Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01 Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000 Stoichiometric ionic strength = .2681880E-03 Osmotic coef. = 0.9902 True ionic strength = .2711774E-03 Chg. balance for total moles = 0.9765E-15 Max. difference allowed = 0.1380E-07 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.37019E-07 -7.4316 0.35571E-07 -7.4489 0.96089E+00 -0.0173 2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000 3 Cl- 0.13796E-03 -3.8602 0.13255E-03 -3.8776 0.96077E+00 -0.0174 4 SO4-- 0.25346E-04 -4.5961 0.22791E-04 -4.6422 0.89922E+00 -0.0461 5 HCO3- 0.12137E-04 -4.9159 0.11662E-04 -4.9332 0.96080E+00 -0.0174 6 HS- 0.41093E-08 -8.3862 0.39481E-08 -8.4036 0.96078E+00 -0.0174 7 Al+++ 0.41802E-19 -19.3788 0.33650E-19 -19.4730 0.80497E+00 -0.0942 8 H4SiO4 0.75755E-04 -4.1206 0.75755E-04 -4.1206 0.10000E+01 0.0000 9 Ca++ 0.23397E-04 -4.6308 0.21036E-04 -4.6770 0.89909E+00 -0.0462 10 Mg++ 0.11062E-05 -5.9562 0.99451E-06 -6.0024 0.89901E+00 -0.0462 11 Fe++ 0.78063E-08 -8.1076 0.70181E-08 -8.1538 0.89903E+00 -0.0462 12 K+ 0.16979E-05 -5.7701 0.16313E-05 -5.7875 0.96081E+00 -0.0174 13 Na+ 0.17010E-03 -3.7693 0.16343E-03 -3.7867 0.96077E+00 -0.0174 14 Mn++ 0.11395E-06 -6.9433 0.10245E-06 -6.9895 0.89904E+00 -0.0462 15 HPO4-- 0.72137E-08 -8.1418 0.64867E-08 -8.1880 0.89922E+00 -0.0461 16 HSiO3- 0.20698E-05 -5.6841 0.19886E-05 -5.7015 0.96077E+00 -0.0174 17 Ca(HSiO3)+ 0.99153E-09 -9.0037 0.95267E-09 -9.0211 0.96081E+00 -0.0174 18 Mg(HSiO3)+ 0.58338E-10 -10.2341 0.56052E-10 -10.2514 0.96081E+00 -0.0174 19 NaHSiO3,aq 0.52562E-08 -8.2793 0.52562E-08 -8.2793 0.10000E+01 0.0000 20 AlO+ 0.37656E-11 -11.4242 0.36180E-11 -11.4415 0.96081E+00 -0.0174 21 AlOH+2 0.71277E-15 -15.1471 0.64082E-15 -15.1933 0.89906E+00 -0.0462 22 HAlO2,aq 0.20256E-07 -7.6935 0.20256E-07 -7.6935 0.10000E+01 0.0000 23 AlO2- 0.13120E-05 -5.8821 0.12605E-05 -5.8994 0.96074E+00 -0.0174 24 CH4,aq 0.19625E-14 -14.7072 0.19623E-14 -14.7072 0.99992E+00 0.0000 29 CO,aq 0.70877E-16 -16.1495 0.70877E-16 -16.1495 0.10000E+01 0.0000 30 CO2,aq 0.88643E-06 -6.0524 0.88635E-06 -6.0524 0.99992E+00 0.0000 31 CO3-2 0.31846E-07 -7.4969 0.28635E-07 -7.5431 0.89918E+00 -0.0462 32 CaCO3,aq 0.75531E-08 -8.1219 0.75531E-08 -8.1219 0.10000E+01 0.0000 33 Ca(HCO3)+ 0.65172E-08 -8.1859 0.62618E-08 -8.2033 0.96081E+00 -0.0174 34 CaCl+ 0.46964E-08 -8.3282 0.45124E-08 -8.3456 0.96081E+00 -0.0174 35 CaCl2,aq 0.14210E-12 -12.8474 0.14210E-12 -12.8474 0.10000E+01 0.0000 36 CaOH+ 0.43867E-07 -7.3579 0.42147E-07 -7.3752 0.96081E+00 -0.0174 37 CaSO4,aq 0.15224E-06 -6.8175 0.15224E-06 -6.8175 0.10000E+01 0.0000 38 HCl,aq 0.86399E-12 -12.0635 0.86399E-12 -12.0635 0.10000E+01 0.0000 43 FeCl+ 0.15325E-11 -11.8146 0.14724E-11 -11.8320 0.96081E+00 -0.0174 46 FeO,aq 0.21557E-09 -9.6664 0.21557E-09 -9.6664 0.10000E+01 0.0000 47 FeOH+ 0.66842E-08 -8.1749 0.64223E-08 -8.1923 0.96081E+00 -0.0174 48 HFeO2- 0.66000E-10 -10.1805 0.63411E-10 -10.1978 0.96077E+00 -0.0174 49 FeO+ 0.28258E-12 -12.5489 0.27151E-12 -12.5662 0.96081E+00 -0.0174 50 FeOH+2 0.20514E-17 -17.6879 0.18444E-17 -17.7342 0.89906E+00 -0.0462 51 FeO2- 0.45701E-10 -10.3401 0.43908E-10 -10.3575 0.96077E+00 -0.0174 52 HFeO2,aq 0.19864E-09 -9.7019 0.19864E-09 -9.7019 0.10000E+01 0.0000 53 H2,aq 0.31835E-08 -8.4971 0.31832E-08 -8.4971 0.99992E+00 0.0000 54 KCl,aq 0.39191E-11 -11.4068 0.39191E-11 -11.4068 0.10000E+01 0.0000 55 KHSO4,aq 0.37394E-17 -17.4272 0.37394E-17 -17.4272 0.10000E+01 0.0000 56 KOH,aq 0.19586E-10 -10.7081 0.19586E-10 -10.7081 0.10000E+01 0.0000 57 KSO4- 0.60051E-09 -9.2215 0.57696E-09 -9.2389 0.96077E+00 -0.0174 58 MgCO3,aq 0.89506E-10 -10.0481 0.89506E-10 -10.0481 0.10000E+01 0.0000 59 Mg(HCO3)+ 0.31483E-09 -9.5019 0.30250E-09 -9.5193 0.96081E+00 -0.0174 60 MgCl+ 0.20124E-09 -9.6963 0.19335E-09 -9.7137 0.96081E+00 -0.0174 61 MgOH+ 0.11476E-07 -7.9402 0.11026E-07 -7.9576 0.96081E+00 -0.0174 63 MnO,aq 0.83851E-10 -10.0765 0.83851E-10 -10.0765 0.10000E+01 0.0000 64 MnOH+ 0.90643E-08 -8.0427 0.87091E-08 -8.0600 0.96081E+00 -0.0174 65 MnO2-2 0.24459E-17 -17.6116 0.21993E-17 -17.6577 0.89918E+00 -0.0462 66 HMnO2- 0.17839E-13 -13.7486 0.17139E-13 -13.7660 0.96077E+00 -0.0174 69 MnCl+ 0.87033E-10 -10.0603 0.83622E-10 -10.0777 0.96081E+00 -0.0174 70 MnSO4,aq 0.67408E-09 -9.1713 0.67408E-09 -9.1713 0.10000E+01 0.0000 71 NaCl,aq 0.71789E-08 -8.1439 0.71789E-08 -8.1439 0.10000E+01 0.0000 72 NaOH,aq 0.19740E-08 -8.7047 0.19740E-08 -8.7047 0.10000E+01 0.0000 74 OH- 0.16907E-04 -4.7719 0.16243E-04 -4.7893 0.96074E+00 -0.0174 79 HPO3-2 0.71563E-19 -19.1453 0.64348E-19 -19.1915 0.89918E+00 -0.0462 82 H3PO4,aq 0.57403E-13 -13.2411 0.57403E-13 -13.2411 0.10000E+01 0.0000 83 H2PO4- 0.44302E-08 -8.3536 0.42565E-08 -8.3709 0.96079E+00 -0.0174 84 PO4-3 0.18465E-12 -12.7336 0.14879E-12 -12.8274 0.80577E+00 -0.0938 87 H2P2O7-2 0.15799E-17 -17.8014 0.14206E-17 -17.8475 0.89918E+00 -0.0462 88 HP2O7-3 0.99067E-17 -17.0041 0.79746E-17 -17.0983 0.80497E+00 -0.0942 89 P2O7-4 0.77636E-19 -19.1099 0.53558E-19 -19.2712 0.68986E+00 -0.1612 90 H2S,aq 0.43408E-09 -9.3624 0.43404E-09 -9.3625 0.99992E+00 0.0000 91 S2-2 0.12067E-18 -18.9184 0.10850E-18 -18.9646 0.89918E+00 -0.0462 96 SO2,aq 0.40996E-18 -18.3873 0.40996E-18 -18.3873 0.10000E+01 0.0000 97 SO3-2 0.10482E-13 -13.9796 0.94278E-14 -14.0256 0.89945E+00 -0.0460 98 HSO3- 0.21855E-13 -13.6605 0.20997E-13 -13.6778 0.96077E+00 -0.0174 99 HSO4- 0.81315E-09 -9.0898 0.78129E-09 -9.1072 0.96083E+00 -0.0174 101 S2O3-2 0.12923E-15 -15.8886 0.11620E-15 -15.9348 0.89918E+00 -0.0462 Charge balance for all species = 0.9768E-15 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.3701864E-07 -.2347720E-04 -.2366317E-01 0.0000 2 H2O 0.1000000E+01 0.5550827E+02 0.9999794E+06 0.0000 3 Cl- 0.1379624E-03 0.1379746E-03 0.4891522E+01 3.5713 4 SO4-- 0.2534567E-04 0.2549924E-04 0.2449452E+01 10.2556 5 HCO3- 0.1213729E-04 0.1307004E-04 0.7974824E+00 2.5157 6 HS- 0.4109304E-08 0.5308680E-08 0.1755654E-03 -0.9547 7 Al+++ 0.4180237E-19 0.1332292E-05 0.3594657E-01 2.8737 8 H4SiO4 0.7575525E-04 0.7783134E-04 0.7480650E+01 -4.1206 9 Ca++ 0.2339691E-04 0.2361278E-04 0.9463353E+00 10.2208 10 Mg++ 0.1106227E-05 0.1118366E-05 0.2718921E-01 8.8954 11 Fe++ 0.7806322E-08 0.1501830E-07 0.8387115E-03 6.7440 12 K+ 0.1697895E-05 0.1698519E-05 0.6641425E-01 1.6615 13 Na+ 0.1700991E-03 0.1701135E-03 0.3910802E+01 3.6622 14 Mn++ 0.1139523E-06 0.1238616E-06 0.6804581E-02 7.9083 15 HPO4-- 0.7213686E-08 0.1164413E-07 0.1117571E-02 6.7098 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ -.1194281E-03 -.2347713E-04 -.9595100E-04 0.0000000E+00 2 H2O 0.5550815E+02 0.5550809E+02 0.5498276E-04 0.0000000E+00 3 Cl- 0.1379742E-03 0.1379742E-03 0.0000000E+00 0.0000000E+00 4 SO4-- 0.2572618E-04 0.2549916E-04 0.2270159E-06 0.0000000E+00 5 HCO3- 0.1307000E-04 0.1307000E-04 0.0000000E+00 0.0000000E+00 6 HS- -.2217073E-06 0.5308664E-08 -.2270159E-06 0.0000000E+00 7 Al+++ 0.2608593E-04 0.1332288E-05 0.2475364E-04 0.0000000E+00 8 H4SiO4 0.8330226E-04 0.7783110E-04 0.5471169E-05 0.0000000E+00 9 Ca++ 0.2367220E-04 0.2361271E-04 0.5949421E-07 0.0000000E+00 10 Mg++ 0.6349206E-05 0.1118363E-05 0.5230844E-05 0.0000000E+00 11 Fe++ 0.5704069E-05 0.1501826E-07 0.5689050E-05 0.0000000E+00 12 K+ 0.1698514E-05 0.1698514E-05 0.0000000E+00 0.0000000E+00 13 Na+ 0.1701129E-03 0.1701129E-03 0.0000000E+00 0.0000000E+00 14 Mn++ 0.1387088E-06 0.1238612E-06 0.1484755E-07 0.0000000E+00 15 HPO4-- 0.4734061E-07 0.1164409E-07 0.3569652E-07 0.0000000E+00 Chg. balance for solid moles: -.5095E-20 Mass of aqueous solution: 0.100002E+04 g Temperature = 100.00 C Pressure = 50.00 bar Mixer frac. = 0.0080000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) apatite-OH 0.1190E-07 -7.924 0.5977E-05 -5.224 0.2341 0.1899E-05 clinochlore 0.1046E-05 -5.980 0.5815E-03 -3.235 22.77 0.2212E-03 daphnite 0.7746E-06 -6.111 0.5527E-03 -3.258 21.64 0.1675E-03 chlorite-Mn 0.2970E-08 -8.527 0.2105E-05 -5.677 0.8245E-01 0.6709E-06 diaspore 0.2111E-04 -4.676 0.1266E-02 -2.898 49.59 0.3769E-03 hematite 0.9081E-06 -6.042 0.1450E-03 -3.839 5.679 0.2749E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity apatite-OH 0.1000E+01 0.1000E+01 1.0000 0.000 clinochlore 0.5736E+00 0.5736E+00 1.0000 -0.241 daphnite 0.4247E+00 0.4247E+00 1.0000 -0.372 chlorite-Mn 0.1628E-02 0.1628E-02 1.0000 -2.788 diaspore 0.1000E+01 0.1000E+01 1.0000 0.000 hematite 0.1000E+01 0.1000E+01 1.0000 0.000 Solid products produced: Mass = 0.002553 g Volume = 0.000796 cm3 Porosity: 99.9207% V(tot) - V(min): 0.10024E+01 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Reactant consumed: 0.0080000 g log = -2.0969 Original solution: 1000.0103000 g Original solution / Rock added: 125001.29 (Water/Rock Ratio), log = 5.0969 Gas composition at saturation ( 2 iterations) ------------------------------------------------- Temperature: 100.0000 deg.C Sat. pressure: 1.0204 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.9999E+00 0.9860 0.1006E+01 0.1020E+01 CO2,gas 0.9228E-04 1.0071 0.9483E-04 0.9416E-04 CH4,gas 0.2796E-11 1.0125 0.2888E-11 0.2853E-11 H2,gas 0.4093E-05 1.0005 0.4179E-05 0.4177E-05 H2S,gas 0.1174E-07 0.9960 0.1193E-07 0.1198E-07 S2,gas 0.2998E-24 1.0000 0.3060E-24 0.3060E-24 CO,gas 0.1035E-12 1.0000 0.1056E-12 0.1056E-12 SO3,gas 0.1069E-34 1.0000 0.1090E-34 0.1090E-34 SO2,gas 0.1737E-17 1.0000 0.1773E-17 0.1773E-17 HCl,gas 0.1494E-14 1.0000 0.1525E-14 0.1525E-14 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 32 apatite-OH -18.15 -18.15 0.00 0.000 0.00000E+00 46 clinochlore 39.07 39.07 0.00 0.000 0.12132E-10 47 daphnite 28.97 28.97 0.00 0.000 0.18198E-10 48 chlorite-Mn 46.87 46.87 0.00 0.000 0.48529E-10 65 diaspore 2.87 2.87 0.00 0.000 0.30331E-11 90 hematite 12.57 12.57 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 1 H2O,gas 1.70 0.00 -1.70 -1.696 0.28965E+04 0.003 2 CO2,gas -6.66 -12.38 -5.72 -1.907 0.97702E+04 -4.023 3 CH4,gas 4.54 -8.69 -13.24 -3.310 0.22604E+05 -11.539 4 H2,gas 8.00 0.92 -7.08 -4.045 0.12085E+05 -5.379 5 H2S,gas -6.23 -15.85 -9.62 -4.811 0.16430E+05 -7.923 6 S2,gas -7.34 -33.55 -26.21 -4.033 0.44759E+05 -24.514 7 CO,gas 3.21 -11.46 -14.68 -4.515 0.25058E+05 -12.976 8 SO3,gas 17.12 -19.54 -36.66 -9.165 0.62598E+05 -34.962 9 SO2,gas 0.83 -18.62 -19.45 -5.187 0.33211E+05 -17.751 10 HCl,gas 5.19 -11.33 -16.52 -8.258 0.28200E+05 -14.817 21 andalusite 5.00 1.63 -3.37 -0.337 0.57622E+04 24 anhydrite -5.32 -9.32 -4.00 -2.001 0.68341E+04 29 anorthite 12.71 7.73 -4.98 -0.383 0.85089E+04 35 aragonite 0.97 -2.16 -3.13 -1.043 0.53408E+04 36 brucite 12.57 8.90 -3.67 -0.735 0.62718E+04 37 calcite 0.81 -2.16 -2.97 -0.991 0.50766E+04 40 carpholite-Mg 8.58 6.40 -2.18 -0.145 0.37231E+04 41 carpholite-Fe 6.71 4.25 -2.46 -0.164 0.42045E+04 50 chloritoid-Mg 13.20 10.52 -2.68 -0.178 0.45683E+04 51 chloritoid-Fe 9.17 8.37 -0.80 -0.054 0.13707E+04 52 chloritoid-Mn 11.40 9.54 -1.87 -0.124 0.31861E+04 54 coesite -2.38 -4.12 -1.74 -0.582 0.29787E+04 59 corundum 8.38 5.75 -2.64 -0.240 0.45004E+04 61 cristobalite -2.56 -4.12 -1.56 -0.520 0.26641E+04 75 epidote 24.67 20.11 -4.56 -0.221 0.77855E+04 78 fayalite 14.05 9.37 -4.68 -0.668 0.79880E+04 83 gibbsite 4.08 2.87 -1.21 -0.172 0.20585E+04 87 greenalite 16.14 11.99 -4.15 -0.346 0.70836E+04 92 hercynite 17.28 12.49 -4.79 -0.319 0.81739E+04 98 kaolinite -1.33 -2.49 -1.16 -0.106 0.19824E+04 99 kyanite 4.88 1.63 -3.25 -0.325 0.55481E+04 101 laumontite 2.88 -0.51 -3.40 -0.227 0.58013E+04 102 lawsonite 9.62 7.73 -1.89 -0.126 0.32256E+04 105 lizardite 23.24 18.45 -4.80 -0.400 0.81938E+04 106 magnesite 0.69 -3.49 -4.18 -1.392 0.71327E+04 107 magnetite 20.09 19.31 -0.78 -0.063 0.13270E+04 110 magnesioferrite 26.21 21.46 -4.75 -0.388 0.81118E+04 113 margarite 17.32 13.47 -3.85 -0.154 0.65724E+04 120 muscovite 2.58 -2.08 -4.66 -0.274 0.79596E+04 121 paragonite 4.24 -0.08 -4.32 -0.254 0.73727E+04 128 periclase-Fe 11.63 6.74 -4.88 -1.221 0.83368E+04 142 pyrite -21.25 -25.88 -4.64 -1.091 0.79158E+04 143 pyrrhotite -4.26 -9.11 -4.85 -1.616 0.82781E+04 144 pyrrhotiteFe0.875 -6.02 -10.07 -4.05 -1.489 0.69133E+04 145 pyroxmangite 7.40 3.79 -3.61 -0.722 0.61656E+04 146 pyrophyllite -6.18 -10.73 -4.56 -0.285 0.77846E+04 147 quartz -2.99 -4.12 -1.13 -0.377 0.19314E+04 151 rhodochrosite -0.98 -4.47 -3.50 -1.166 0.59719E+04 152 rhodonite 7.45 3.79 -3.66 -0.732 0.62459E+04 155 siderite -2.61 -5.64 -3.03 -1.010 0.51736E+04 156 sillimanite 5.26 1.63 -3.63 -0.363 0.62062E+04 168 sudoite 21.08 16.92 -4.15 -0.134 0.70920E+04 177 topaz-H 4.62 1.63 -2.99 -0.272 0.51082E+04 178 tridymite -2.63 -4.12 -1.49 -0.498 0.25514E+04 181 troilite-low -4.41 -9.11 -4.70 -1.566 0.80209E+04 187 wairakite 3.95 -0.51 -4.46 -0.263 0.76233E+04 189 wollastonite 10.46 6.10 -4.36 -0.872 0.74462E+04 190 pseudo-wollastonite 11.00 6.10 -4.90 -0.980 0.83661E+04 192 akaganeite 7.75 6.28 -1.47 -0.318 0.25125E+04 199 chalcedony -2.80 -4.12 -1.32 -0.439 0.22507E+04 201 montmorillonite-Ca -2.29 -7.06 -4.77 -0.295 0.81457E+04 203 montmorillonite-Mg -2.48 -7.28 -4.80 -0.297 0.81962E+04 205 nontronite-Ca 3.21 0.08 -3.14 -0.203 0.53549E+04 206 nontronite-H 2.53 -1.61 -4.14 -0.278 0.70702E+04 207 nontronite-K 3.34 -1.06 -4.40 -0.282 0.75137E+04 208 nontronite-Mg 3.07 -0.14 -3.21 -0.209 0.54894E+04 209 nontronite-Na 3.52 -0.40 -3.92 -0.252 0.66920E+04 214 gypsum -4.96 -9.32 -4.36 -1.091 0.74517E+04 233 boehmite 4.41 2.87 -1.53 -0.255 0.26169E+04 235 ferrous-oxide 9.81 6.74 -3.07 -0.767 0.52378E+04 240 silica-amorphous -2.09 -4.12 -2.03 -0.676 0.34649E+04 Calculations done for 100.0000 Deg. C; 50.0000 bar Next reactant titration increment of: 0.0002000 g Current total amount of reactant added: 0.0080000 g New total amount of reactant added: 0.0082000 g Mixing fraction reached given limit of 0.8000E-02 TOTMIX = 0.8200E-02 Execution stopped.