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. fCO2,1bar20C is suppressed in THIS RUN. amesite is suppressed in SOLTHERM data file. antigorite is suppressed in SOLTHERM data file. 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. ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Species No. Charge Tot.moles Trial molality Gamma Mixing solution H+ 1 1. 0.32344E+00 0.13687E-04 0.5738 0.00000000E+00 H2O 2 0. 0.83072E+02 0.10000E+01 0.9662 0.55508250E+02 Cl- 3 -1. 0.15454E+01 0.90092E+00 0.5810 0.00000000E+00 SO4-- 4 -2. 0.18864E-03 0.11651E-03 0.0860 0.00000000E+00 HCO3- 5 -1. 0.34993E+00 0.17700E-01 0.5907 0.00000000E+00 HS- 6 -1. 0.14030E-04 0.44566E-06 0.5820 0.00000000E+00 H4SiO4 7 0. 0.28117E-02 0.18674E-02 1.0000 0.00000000E+00 Al+++ 8 3. 0.24073E-05 0.75379E-12 0.0035 0.00000000E+00 Ca++ 9 2. 0.21052E-02 0.10496E-02 0.0792 0.00000000E+00 Mg++ 10 2. 0.17177E-03 0.91629E-04 0.0755 0.00000000E+00 Fe++ 11 2. 0.16033E-05 0.86962E-06 0.0764 0.00000000E+00 K+ 12 1. 0.45456E-01 0.29896E-01 0.5915 0.00000000E+00 Na+ 13 1. 0.15238E+01 0.88712E+00 0.5789 0.00000000E+00 Mn++ 14 2. 0.34477E-04 0.98335E-05 0.0770 0.00000000E+00 Zn++ 15 2. 0.74682E-05 0.53422E-07 0.0764 0.00000000E+00 Cu+ 16 1. 0.17016E-06 0.98913E-12 0.5785 0.00000000E+00 Pb++ 17 2. 0.15650E-05 0.37995E-08 0.0818 0.00000000E+00 Ag+ 18 1. 0.42713E-06 0.29370E-11 0.5890 0.00000000E+00 Au+ 19 1. 0.31110E-11 0.45870E-22 0.5929 0.00000000E+00 Ba++ 20 2. 0.40644E-05 0.16822E-05 0.0835 0.00000000E+00 F- 21 -1. 0.16304E-02 0.93033E-03 0.5678 0.00000000E+00 H2AsO3- 22 -1. 0.12964E-03 0.18941E-06 0.6815 0.00000000E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Chg. balance for the mixing solution = 0.0000E+00 Max. difference allowed = 0.1545E-03 The following parameters were given: ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 500.0000 SLIM = 0.200000E+01 TEMP = 143.7232 SINC = 0.1000E+00 TEMPC = 25.0000 TOTMIX = 0.500000E+00 ENTH = 0.0000 SENTH = 0.0000 DENTH = 0.0000 TOTWAT = 90.0000 SOLMIN = 0.0000E+00 RM = 0.0000 AQGRM = 1082.4053 SUPRNT = 0.1000E-10 VBOX-1 = 0.0000 RHOFRS = 0.0000 RHOROC = 0.0000 The following options were selected: CONFLG = 1 C = 3 IFRAC = 0 IPUNCH = 2 NLOOP = 70 ISTEP = 2 LIMSOL = 2 LOOC = 0 IENTH = 0 ITREF = 0 IDEAL = 0 IPSAT = 1 INCREM = 0 INCP = 0 MINSOL = 0 NEUT = 0 AWAT = 0 CHGF = 0 Of the derived species, only those with molality > 0.10E-10 will appear in the output Species No. Charge Log K(diss) Species No. Charge Log K(diss) SiF6-2 23 -2. -23.7999 FeCl2,aq 102 0. 2.5208 HSiO3- 24 -1. 8.6899 FeCl+2 103 2. 6.0018 Ca(HSiO3)+ 25 1. 7.0618 FeF+ 104 1. -1.9263 Mg(HSiO3)+ 26 1. 7.0468 FeF+2 105 2. 0.6758 NaHSiO3,aq 27 0. 7.7117 FeO,aq 106 0. 14.7299 Ag(CO3)- 28 -1. 7.9653 FeOH+ 107 1. 6.6655 Ag(CO3)2-3 29 -3. 18.3324 HFeO2- 108 -1. 22.2799 Ag+2 30 2. 22.7455 FeO+ 109 1. 10.1130 AgCl,aq 31 0. -2.7451 FeOH+2 110 2. 8.2961 AgCl2- 32 -1. -4.3382 FeO2- 111 -1. 21.6456 AgCl3-2 33 -2. -3.4183 HFeO2,aq 112 0. 14.2603 AgCl4-3 34 -3. -1.2320 H2,aq 113 0. 8.5424 AgF,aq 35 0. -0.6257 KCl,aq 114 0. 1.4199 Ag(OH),aq 36 0. 10.4936 KHSO4,aq 115 0. -1.4089 AgO- 37 -1. 18.8282 KOH,aq 116 0. 11.5598 Ag(HS),aq 38 0. -10.0532 KSO4- 117 -1. -1.4295 Ag(HS)2- 39 -1. -12.6714 MgCO3,aq 118 0. 6.1834 AlO+ 40 1. 5.6324 Mg(HCO3)+ 119 1. -1.7176 AlOH+2 41 2. 2.4851 MgCl+ 120 1. -0.4095 HAlO2,aq 42 0. 8.7784 MgF+ 121 1. -2.0264 AlO2- 43 -1. 13.9176 MgOH+ 122 1. 8.4608 AsO2- 44 -1. 0.5647 Mn+3 123 3. 18.1771 HAsO2,aq 45 0. -7.4353 MnF+ 124 1. -1.4805 H3AsO3,aq 46 0. -7.7534 MnO,aq 125 0. 16.2476 H3AsO4,aq 47 0. 0.3584 MnOH+ 126 1. 7.6090 H2AsO4- 48 -1. 3.1214 MnO2-2 127 -2. 37.3197 HAsO4-2 49 -2. 9.9877 HMnO2- 128 -1. 26.7221 AsO4-3 50 -3. 21.0815 MnO4- 129 -1. 73.7969 HAs3S6-2 51 -2. -71.7914 MnO4-2 130 -2. 73.1403 H2As3S6- 52 -1. -78.4419 MnCl+ 131 1. -1.2915 H3As3S6,aq 53 0. -81.0642 MnSO4,aq 132 0. -2.7580 Au+3 54 3. 31.2607 NaCl,aq 133 0. 0.3255 AuCl,aq 55 0. -5.9347 NaF,aq 134 0. 0.4643 AuCl2- 56 -1. -7.0630 NaOH,aq 135 0. 11.6286 AuCl3-2 57 -2. -6.5179 O2,aq 136 0. 47.0218 AuCl4- 58 -1. 24.7288 OH- 137 -1. 11.5250 AuOH,aq 59 0. -3.8673 HO2- 138 -1. 45.8087 AuHS,aq 60 0. -17.4607 H2O2,aq 139 0. 35.4474 Au(HS)2- 61 -1. -21.4008 PbCl+ 140 1. -2.0406 BaCO3,aq 62 0. 6.0492 PbCl2,aq 141 0. -2.9617 Ba(HCO3)+ 63 1. -2.3513 PbCl3- 142 -1. -2.7036 BaCl+ 64 1. -0.5807 PbCl4-2 143 -2. -2.0717 BaF+ 65 1. -0.6851 PbF+ 144 1. -2.2998 CH4,aq 66 0. 6.0006 PbF2,aq 145 0. -3.4795 C2H6,aq 67 0. 12.1041 PbO,aq 146 0. 12.5045 C3H8,aq 68 0. 17.0851 HPbO2- 147 -1. 22.0482 C4H10,aq 69 0. 22.0806 Pb(HS)2,aq 148 0. -12.3080 ethanol,aq 70 0. 14.5624 Pb(HS)3- 149 -1. -13.4163 CO,aq 71 0. 3.5795 H2S,aq 150 0. -6.4069 CO2,aq 72 0. -6.3588 S2-2 151 -2. 1.1198 CO3-2 73 -2. 9.9298 S3-2 152 -2. -8.4190 CaCO3,aq 74 0. 5.4430 S3- 153 -1. -16.2555 Ca(HCO3)+ 75 1. -1.7166 S4-2 154 -2. -17.7942 CaCl+ 76 1. -0.5413 S5-2 155 -2. -27.0118 CaCl2,aq 77 0. 0.1382 SO2,aq 156 0. -1.6771 CaF+ 78 1. -1.5053 SO3-2 157 -2. 9.4955 CaOH+ 79 1. 9.0852 HSO3- 158 -1. 1.4867 CaSO4,aq 80 0. -2.7360 HSO4- 159 -1. -3.4743 HCl,aq 81 0. 0.4878 HSO5- 160 -1. 33.3158 HClO,aq 82 0. 28.3167 S2O3-2 161 -2. -4.5482 ClO- 83 -1. 35.3460 HS2O3- 162 -1. -7.2006 HClO2,aq 84 0. 61.7549 H2S2O3,aq 163 0. -8.6478 Cu+2 85 2. 0.3258 S2O4-2 164 -2. 8.6892 CuCl+ 86 1. -0.6518 HS2O4- 165 -1. 5.5241 CuCl2,aq 87 0. 0.0911 H2S2O4,aq 166 0. 4.2250 CuCl3- 88 -1. 1.9103 S2O5-2 167 -2. 8.1115 CuCl4-2 89 -2. 5.1362 S2O6-2 168 -2. 9.2428 CuCl,aq 90 0. -3.6765 S2O8-2 169 -2. 35.8235 CuCl2- 91 -1. -4.8838 S3O6-2 170 -2. 1.8595 CuCl3-2 92 -2. -3.5128 S4O6-2 171 -2. -18.5368 CuF+ 93 1. -1.7202 S5O6-2 172 -2. -15.0687 CuO,aq 94 0. 11.4174 ZnCl+ 173 1. -2.8063 CuOH+ 95 1. 5.9639 ZnCl2,aq 174 0. -2.5907 CuO2-2 96 -2. 32.6764 ZnCl3- 175 -1. -1.6858 HCuO2- 97 -1. 21.1483 ZnF+ 176 1. -1.7361 HF,aq 98 0. -4.1387 ZnO,aq 177 0. 12.5014 HF2- 99 -1. -3.6088 ZnOH+ 178 1. 4.1549 Fe+3 100 3. 8.1577 ZnO2-2 179 -2. 32.1463 FeCl+ 101 1. -0.4673 HZnO2- 180 -1. 21.2964 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 2.001 0.0000E+00 px-Mg-tschermaks 141 14.752 0.0000E+00 CO2,gas 2 -6.037 0.0000E+00 px-Ca-tschermaks 142 14.219 0.0000E+00 CH4,gas 3 5.325 0.0000E+00 pyrite 143 -19.983 0.0000E+00 H2,gas 4 8.068 0.0000E+00 pyrrhotite 144 -4.486 0.0000E+00 H2S,gas 5 -5.453 0.0000E+00 pyrrhotiteFe0.875 145 -6.025 0.0000E+00 S2,gas 6 -7.433 0.0000E+00 pyroxmangite 146 6.466 0.0000E+00 CO,gas 7 3.005 0.0000E+00 pyrophyllite 147 -7.482 0.0000E+00 SO3,gas 8 14.348 0.0000E+00 quartz 148 -2.629 0.0000E+00 O2,gas 9 43.754 0.0000E+00 rankinite 149 36.347 0.0000E+00 SO2,gas 10 -0.067 0.0000E+00 riebeckite 150 17.749 0.0000E+00 HF,gas 11 0.423 0.0000E+00 ringwoodite-Fe 151 13.150 0.0000E+00 HCl,gas 12 4.817 0.0000E+00 ringwoodite-Mg 152 23.970 0.0000E+00 acmite 13 6.942 0.0000E+00 rhodochrosite 153 -1.275 0.0000E+00 akermanite 14 32.114 0.0000E+00 rhodonite 154 6.502 0.0000E+00 akimotoite 15 14.526 0.0000E+00 sanidine 155 -1.744 0.0000E+00 akimotoite-Fe 16 11.350 0.0000E+00 sapphirine(351) 156 57.295 0.0000E+00 albite-high 17 -0.208 0.0000E+00 siderite 157 -2.919 0.0000E+00 albite 18 -1.082 0.0000E+00 sillimanite 158 2.335 0.0000E+00 almandine 19 18.353 0.0000E+00 sodalite 159 40.119 0.0000E+00 pyrope 20 29.759 0.0000E+00 spinel 160 15.881 0.0000E+00 spessartine 21 19.020 0.0000E+00 spurrite 161 52.822 0.0000E+00 analcite 22 2.254 0.0000E+00 staurolite-Fe 162 43.545 0.0000E+00 andalusite 23 2.127 0.0000E+00 staurolite-Mg 163 57.971 0.0000E+00 andradite 24 34.169 0.0000E+00 staurolite-Mn 164 53.470 0.0000E+00 grossular 25 27.001 0.0000E+00 stilbite 165 -7.720 0.0000E+00 anhydrite 26 -5.767 0.0000E+00 stilpnomelane-Fe 166 9.123 0.0000E+00 ankerite 27 -2.824 0.0000E+00 stilpnomelane-Mg 167 21.711 0.0000E+00 annite 28 16.411 0.0000E+00 stishovite 168 2.526 0.0000E+00 phlogopite 29 22.670 0.0000E+00 sudoite-Fe 169 11.785 0.0000E+00 biotite-Mn 30 28.417 0.0000E+00 sudoite 170 14.307 0.0000E+00 anorthite 31 8.933 0.0000E+00 sulfur 171 -8.681 0.0000E+00 anthophyllite 32 44.359 0.0000E+00 sylvite 172 1.455 0.0000E+00 anthophyllite-Fe 33 24.258 0.0000E+00 talc 173 14.124 0.0000E+00 aragonite 34 0.552 0.0000E+00 talc-Fe 174 11.366 0.0000E+00 brucite 35 11.066 0.0000E+00 talc-tschermaks 175 14.323 0.0000E+00 calcite 36 0.413 0.0000E+00 tenorite 176 4.920 0.0000E+00 carnegieite-low 37 7.278 0.0000E+00 tephroite 177 15.851 0.0000E+00 carnegieite-high 38 8.153 0.0000E+00 tilleyite 178 36.341 0.0000E+00 carpholite-Mg 39 5.439 0.0000E+00 titanite-CaSi 179 13.946 0.0000E+00 carpholite-Fe 40 3.753 0.0000E+00 topaz-H 180 2.082 0.0000E+00 celadonite 41 4.103 0.0000E+00 tridymite 181 -2.297 0.0000E+00 celadonite-Fe 42 2.727 0.0000E+00 tremolite 182 41.501 0.0000E+00 chrysotile 43 20.829 0.0000E+00 ferroactinolite 183 33.015 0.0000E+00 chondrodite 44 48.872 0.0000E+00 troilite-low 184 -4.591 0.0000E+00 clinochlore 45 31.771 0.0000E+00 tschermakite 185 37.647 0.0000E+00 daphnite 46 22.664 0.0000E+00 vesuvianite 186 186.861 0.0000E+00 chlorite-Mn 47 39.695 0.0000E+00 wadeite-Si 187 19.210 0.0000E+00 chlorite-Al-free 48 41.157 0.0000E+00 wadsleyite-Fe 188 13.317 0.0000E+00 chloritoid-Mg 49 9.314 0.0000E+00 wadsleyite-Mg 189 22.404 0.0000E+00 chloritoid-Fe 50 5.755 0.0000E+00 wairakite 190 1.547 0.0000E+00 chloritoid-Mn 51 7.953 0.0000E+00 walstromite 191 10.277 0.0000E+00 clinohumite 52 83.854 0.0000E+00 wollastonite 192 9.357 0.0000E+00 coesite 53 -2.083 0.0000E+00 pseudo-wollastonite 193 9.813 0.0000E+00 cordierite-H 54 15.791 0.0000E+00 zoisite 194 16.923 0.0000E+00 cordierite 55 16.200 0.0000E+00 Ag2O 195 10.693 0.0000E+00 cordierite-Fe 56 12.973 0.0000E+00 akaganeite 196 6.531 0.0000E+00 cordierite-Mn 57 17.464 0.0000E+00 argentite 197 -25.005 0.1898E-06 corundum 58 5.090 0.0000E+00 arsenic 198 -6.336 0.0000E+00 corundum-MgSi 59 16.585 0.0000E+00 arsenolite 199 -15.025 0.0000E+00 cristobalite 60 -2.254 0.0000E+00 arsenopyrite 200 -14.067 0.0000E+00 cummingtonite 61 44.563 0.0000E+00 beidellite-Ca 201 -3.866 0.0000E+00 cuprite 62 -0.037 0.0000E+00 beidellite-H 202 -4.435 0.0000E+00 cymrite-K 63 0.888 0.0000E+00 beidellite-K 203 -3.579 0.0000E+00 deerite 64 79.997 0.0000E+00 beidellite-Mg 204 -4.078 0.0000E+00 diaspore 65 1.517 0.0000E+00 beidellite-Na 205 -3.456 0.0000E+00 diamond 66 -2.606 0.0000E+00 bornite 206 -79.852 0.2644E-07 diopside 67 14.140 0.0000E+00 calcium 207 75.331 0.0000E+00 hedenbergite 68 12.354 0.0000E+00 chalcedony 208 -2.461 0.0000E+00 dolomite,ordered 69 -0.404 0.0000E+00 chalcocite 209 -24.778 0.0000E+00 eastonite 70 21.855 0.0000E+00 claudetite 210 -15.184 0.0000E+00 enstatite 71 14.772 0.0000E+00 covellite 211 -17.923 0.0000E+00 clinoenstatite-HiP 72 15.742 0.0000E+00 dawsonite 212 0.871 0.0000E+00 clinoenstatite 73 14.686 0.0000E+00 loellingite 213 -2.611 0.0000E+00 protoenstatite 74 15.260 0.0000E+00 montmorillonite-Ca 214 -3.757 0.0000E+00 epidote 75 19.397 0.0000E+00 montmorillonite-K 215 -3.555 0.0000E+00 clinozoisite 76 16.881 0.0000E+00 montmorillonite-Mg 216 -3.970 0.0000E+00 epidote-Fe 77 24.889 0.0000E+00 montmorillonite-Na 217 -3.375 0.0000E+00 fayalite 78 11.845 0.0000E+00 nontronite-Ca 218 2.153 0.0000E+00 ferrosilite 79 9.298 0.0000E+00 nontronite-H 219 1.581 0.0000E+00 forsterite 80 18.086 0.0000E+00 nontronite-K 220 2.439 0.0000E+00 gedrite 81 38.983 0.0000E+00 nontronite-Mg 221 1.972 0.0000E+00 gehlenite 82 30.229 0.0000E+00 nontronite-Na 222 2.564 0.0000E+00 gibbsite 83 2.718 0.0000E+00 orpiment 223 -49.448 0.0000E+00 glaucophane 84 18.521 0.0000E+00 realgar 224 -61.204 0.0000E+00 glaucophane-Fe 85 13.382 0.0000E+00 sepiolite 225 21.798 0.0000E+00 goethite 86 5.469 0.0000E+00 topaz 226 -18.016 0.1187E-05 graphite 87 -3.014 0.0000E+00 alite 227 51.765 0.0000E+00 greenalite 88 13.908 0.0000E+00 belite 228 27.125 0.0000E+00 grunerite 89 25.910 0.0000E+00 ettringite 229 38.100 0.0000E+00 halite 90 1.541 0.0000E+00 gypsum 230 -5.123 0.0000E+00 hematite 91 10.510 0.0000E+00 hemicarboaluminate 231 62.843 0.0000E+00 heulandite 92 -6.989 0.0000E+00 hydrogarnet 232 52.732 0.0000E+00 hercynite 93 12.641 0.0000E+00 hydrogarnet-Si 233 43.556 0.0000E+00 hollandite 94 22.427 0.0000E+00 jennite 234 22.415 0.0000E+00 iron 95 16.957 0.0000E+00 monosulfoaluminate 235 45.963 0.0000E+00 jadeite 96 3.063 0.0000E+00 monocarboaluminate 236 54.551 0.0000E+00 julgoldite 97 61.565 0.0000E+00 portlandite 237 16.477 0.0000E+00 kalsilite 98 6.047 0.0000E+00 stratlingite 238 31.398 0.0000E+00 kaolinite 99 -3.046 0.0000E+00 tricarboaluminate 239 64.290 0.0000E+00 kyanite 100 2.024 0.0000E+00 tobermorite 240 9.331 0.0000E+00 larnite-bredigite 101 27.356 0.0000E+00 C4AH13 241 72.935 0.0000E+00 laumontite 102 0.838 0.0000E+00 C2AH8 242 39.441 0.0000E+00 lawsonite 103 6.679 0.0000E+00 C3A 243 75.151 0.0000E+00 leucite 104 2.914 0.0000E+00 C4AF 244 101.597 0.0000E+00 lime 105 23.230 0.0000E+00 CAH10 245 24.530 0.0000E+00 lizardite 106 20.309 0.0000E+00 acanthite 246 -24.866 0.0000E+00 magnesite 107 0.030 0.0000E+00 alabandite 247 -1.420 0.0000E+00 magnetite 108 16.845 0.0000E+00 alunite 248 -12.823 0.0000E+00 minnesotaite 109 8.646 0.0000E+00 anglesite 249 -7.874 0.0000E+00 minnesotaite-Mg 110 17.812 0.0000E+00 artinite 250 13.394 0.0000E+00 magnesioferrite 111 22.320 0.0000E+00 azurite 251 4.174 0.0000E+00 majorite 112 46.309 0.0000E+00 barite 252 -9.309 0.0000E+00 manganosite 113 12.377 0.0000E+00 boehmite 253 2.811 0.0000E+00 margarite 114 10.930 0.0000E+00 cerussite 254 -2.706 0.0000E+00 meionite 115 32.206 0.0000E+00 chalcopyrite 255 -26.341 0.0000E+00 merwinite 116 49.448 0.0000E+00 chlorargyrite 256 -6.726 0.0000E+00 microcline 117 -2.828 0.0000E+00 copper,native 257 -2.285 0.0000E+00 monticellite 118 21.398 0.0000E+00 dolomite,disordered 258 0.162 0.0000E+00 mullite-Al 119 319.359 0.0000E+00 ferrous-oxide 259 8.357 0.0000E+00 mullite-Si 120 4.095 0.0000E+00 fluorite 260 -9.846 0.0000E+00 muscovite 121 -0.491 0.0000E+00 galena 261 -10.989 0.1289E-05 paragonite 122 0.899 0.0000E+00 gold,native 262 -15.924 0.0000E+00 nepheline 123 6.638 0.0000E+00 silver,native 263 -5.411 0.0000E+00 osumilite(1) 124 13.262 0.0000E+00 huntite 264 1.245 0.0000E+00 osumilite(2) 125 14.555 0.0000E+00 litharge 265 9.436 0.0000E+00 osumilite-Fe 126 6.883 0.0000E+00 hydromagnesite 266 15.851 0.0000E+00 pargasite 127 53.588 0.0000E+00 malachite 267 2.966 0.0000E+00 periclase 128 14.064 0.0000E+00 nesquehonite 268 4.704 0.0000E+00 periclase-Fe 129 10.000 0.0000E+00 potassium-oxide 269 62.794 0.0000E+00 perovskite-Al 130 8.630 0.0000E+00 silica-amorphous 270 -1.835 0.0000E+00 perovskite-Ca 131 21.281 0.0000E+00 smithsonite 271 -1.185 0.0000E+00 perovskite-Fe 132 18.572 0.0000E+00 sodium-oxide 272 50.167 0.0000E+00 perovskite-Mg 133 20.345 0.0000E+00 sphalerite 273 -9.871 0.3107E-05 phase_A 134 69.904 0.0000E+00 wurtzite 274 -8.230 0.0000E+00 phlogopite-Na 135 24.868 0.0000E+00 zincite 275 6.969 0.0000E+00 piemontite(ordered) 136 27.628 0.0000E+00 an20ab80 276 0.704 0.0000E+00 prehnite 137 15.166 0.0000E+00 an25ab75 277 1.177 0.0000E+00 prehnite-Fe 138 18.783 0.0000E+00 an30ab70 278 1.657 0.0000E+00 pumpellyite-Fe 139 35.964 0.0000E+00 tr.625ac.25prg.125 279 38.388 0.0000E+00 pumpellyite-Mg 140 38.403 0.0000E+00 280 0.000 0.0000E+00 Mixing solution: Stoch.ionic strengh 0.5000E-10 Temperature 25.00 HEAT 0.64600 The following minerals and/or gases with identical index are in solid solution: H2O,gas 6 CO2,gas 6 CH4,gas 6 H2,gas 6 H2S,gas 6 S2,gas 6 CO,gas 6 SO3,gas 6 SO2,gas 6 HF,gas 6 HCl,gas 6 almandine 16 pyrope 16 spessartine 16 andradite 8 grossular 8 annite 15 phlogopite 15 biotite-Mn 15 clinochlore 1 daphnite 1 chlorite-Mn 1 diopside 5 hedenbergite 5 epidote 3 clinozoisite 3 iron 9 magnetite 14 talc 7 talc-Fe 7 tremolite 2 ferroactinolite 2 gold,native 10 silver,native 10 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 8 Loop limit = 70 Temperature = 143.72 C Pressure = 500.00 bar Mixer fraction = 0.5000000 Water: Moles liquid = 0.8340E+02 kg liquid = 0.1502E+01 Moles total = 0.8307E+02 kg total = 0.1497E+01 Activity = 0.9662 Stoichiometric ionic strength = .1161453E+01 Osmotic coef. = 0.9280 True ionic strength = .9210274E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.13687E-04 -4.8637 0.78530E-05 -5.1050 0.57375E+00 -0.2413 2 H2O 0.96619E+00 -0.0149 0.96619E+00 -0.0149 3 Cl- 0.90092E+00 -0.0453 0.52347E+00 -0.2811 0.58104E+00 -0.2358 4 SO4-- 0.11651E-03 -3.9336 0.10021E-04 -4.9991 0.86006E-01 -1.0655 5 HCO3- 0.17700E-01 -1.7520 0.10455E-01 -1.9807 0.59069E+00 -0.2286 6 HS- 0.44566E-06 -6.3510 0.25938E-06 -6.5861 0.58201E+00 -0.2351 7 H4SiO4 0.18674E-02 -2.7288 0.18674E-02 -2.7288 0.10000E+01 0.0000 8 Al+++ 0.75379E-12 -12.1228 0.26534E-14 -14.5762 0.35202E-02 -2.4534 9 Ca++ 0.10496E-02 -2.9790 0.83180E-04 -4.0800 0.79246E-01 -1.1010 10 Mg++ 0.91629E-04 -4.0380 0.69149E-05 -5.1602 0.75466E-01 -1.1222 11 Fe++ 0.86962E-06 -6.0607 0.66400E-07 -7.1778 0.76355E-01 -1.1172 12 K+ 0.29896E-01 -1.5244 0.17684E-01 -1.7524 0.59151E+00 -0.2280 13 Na+ 0.88712E+00 -0.0520 0.51351E+00 -0.2895 0.57885E+00 -0.2374 14 Mn++ 0.98335E-05 -5.0073 0.75752E-06 -6.1206 0.77034E-01 -1.1133 15 Zn++ 0.53422E-07 -7.2723 0.40791E-08 -8.3894 0.76355E-01 -1.1172 16 Cu+ 0.98913E-12 -12.0047 0.57222E-12 -12.2424 0.57851E+00 -0.2377 17 Pb++ 0.37995E-08 -8.4203 0.31073E-09 -9.5076 0.81783E-01 -1.0873 18 Ag+ 0.29370E-11 -11.5321 0.17299E-11 -11.7620 0.58902E+00 -0.2299 19 Au+ 0.45870E-22 -22.3385 0.27198E-22 -22.5655 0.59294E+00 -0.2270 20 Ba++ 0.16822E-05 -5.7741 0.14049E-06 -6.8523 0.83519E-01 -1.0782 21 F- 0.93033E-03 -3.0314 0.52822E-03 -3.2772 0.56777E+00 -0.2458 22 H2AsO3- 0.18941E-06 -6.7226 0.12907E-06 -6.8892 0.68146E+00 -0.1666 24 HSiO3- 0.86498E-06 -6.0630 0.50259E-06 -6.2988 0.58104E+00 -0.2358 25 Ca(HSiO3)+ 0.29949E-08 -8.5236 0.17758E-08 -8.7506 0.59294E+00 -0.2270 26 Mg(HSiO3)+ 0.25770E-09 -9.5889 0.15280E-09 -9.8159 0.59294E+00 -0.2270 27 NaHSiO3,aq 0.24547E-05 -5.6100 0.24547E-05 -5.6100 0.10000E+01 0.0000 31 AgCl,aq 0.50347E-09 -9.2980 0.50347E-09 -9.2980 0.10000E+01 0.0000 32 AgCl2- 0.17777E-07 -7.7501 0.10329E-07 -7.9859 0.58104E+00 -0.2358 33 AgCl3-2 0.77225E-08 -8.1122 0.65009E-09 -9.1870 0.84181E-01 -1.0748 34 AgCl4-3 0.61212E-09 -9.2132 0.22164E-11 -11.6543 0.36209E-02 -2.4412 38 Ag(HS),aq 0.50723E-08 -8.2948 0.50723E-08 -8.2948 0.10000E+01 0.0000 40 AlO+ 0.16344E-09 -9.7866 0.96909E-10 -10.0136 0.59294E+00 -0.2270 41 AlOH+2 0.13726E-10 -10.8625 0.10684E-11 -11.9713 0.77839E-01 -1.1088 42 HAlO2,aq 0.85193E-08 -8.0696 0.85193E-08 -8.0696 0.10000E+01 0.0000 43 AlO2- 0.13831E-07 -7.8591 0.78743E-08 -8.1038 0.56932E+00 -0.2446 44 AsO2- 0.62639E-07 -7.2032 0.36396E-07 -7.4389 0.58104E+00 -0.2358 45 HAsO2,aq 0.28583E-04 -4.5439 0.28583E-04 -4.5439 0.10000E+01 0.0000 46 H3AsO3,aq 0.57454E-04 -4.2407 0.57454E-04 -4.2407 0.10000E+01 0.0000 48 H2AsO4- 0.22170E-10 -10.6542 0.12882E-10 -10.8900 0.58104E+00 -0.2358 62 BaCO3,aq 0.16699E-09 -9.7773 0.16699E-09 -9.7773 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.55000E-06 -6.2596 0.32984E-06 -6.4817 0.59972E+00 -0.2221 64 BaCl+ 0.47235E-06 -6.3257 0.28007E-06 -6.5527 0.59294E+00 -0.2270 65 BaF+ 0.60617E-09 -9.2174 0.35942E-09 -9.4444 0.59294E+00 -0.2270 66 CH4,aq 0.28936E-09 -9.5386 0.26112E-09 -9.5832 0.90242E+00 -0.0446 71 CO,aq 0.16955E-09 -9.7707 0.16955E-09 -9.7707 0.10000E+01 0.0000 72 CO2,aq 0.21513E+00 -0.6673 0.19414E+00 -0.7119 0.90242E+00 -0.0446 73 CO3-2 0.18588E-05 -5.7308 0.15647E-06 -6.8056 0.84181E-01 -1.0748 74 CaCO3,aq 0.39928E-06 -6.3987 0.39928E-06 -6.3987 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.76373E-04 -4.1171 0.45284E-04 -4.3441 0.59294E+00 -0.2270 76 CaCl+ 0.25542E-03 -3.5928 0.15145E-03 -3.8197 0.59294E+00 -0.2270 77 CaCl2,aq 0.16581E-04 -4.7804 0.16581E-04 -4.7804 0.10000E+01 0.0000 78 CaF+ 0.23721E-05 -5.6249 0.14065E-05 -5.8519 0.59294E+00 -0.2270 79 CaOH+ 0.14186E-07 -7.8481 0.84117E-08 -8.0751 0.59294E+00 -0.2270 80 CaSO4,aq 0.45382E-06 -6.3431 0.45382E-06 -6.3431 0.10000E+01 0.0000 81 HCl,aq 0.13372E-05 -5.8738 0.13372E-05 -5.8738 0.10000E+01 0.0000 90 CuCl,aq 0.14223E-08 -8.8470 0.14223E-08 -8.8470 0.10000E+01 0.0000 91 CuCl2- 0.20653E-07 -7.6850 0.12000E-07 -7.9208 0.58104E+00 -0.2358 92 CuCl3-2 0.31758E-08 -8.4982 0.26734E-09 -9.5729 0.84181E-01 -1.0748 98 HF,aq 0.57090E-04 -4.2434 0.57090E-04 -4.2434 0.10000E+01 0.0000 99 HF2- 0.15319E-07 -7.8148 0.89011E-08 -8.0506 0.58104E+00 -0.2358 101 FeCl+ 0.17191E-06 -6.7647 0.10193E-06 -6.9917 0.59294E+00 -0.2270 102 FeCl2,aq 0.54849E-10 -10.2608 0.54849E-10 -10.2608 0.10000E+01 0.0000 104 FeF+ 0.49918E-08 -8.3017 0.29598E-08 -8.5287 0.59294E+00 -0.2270 107 FeOH+ 0.29761E-08 -8.5263 0.17647E-08 -8.7533 0.59294E+00 -0.2270 113 H2,aq 0.23266E-07 -7.6333 0.20996E-07 -7.6779 0.90242E+00 -0.0446 114 KCl,aq 0.35202E-03 -3.4534 0.35202E-03 -3.4534 0.10000E+01 0.0000 115 KHSO4,aq 0.35676E-10 -10.4476 0.35676E-10 -10.4476 0.10000E+01 0.0000 116 KOH,aq 0.59957E-08 -8.2222 0.59957E-08 -8.2222 0.10000E+01 0.0000 117 KSO4- 0.81994E-05 -5.0862 0.47642E-05 -5.3220 0.58104E+00 -0.2358 118 MgCO3,aq 0.60347E-08 -8.2193 0.60347E-08 -8.2193 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.63633E-05 -5.1963 0.37730E-05 -5.4233 0.59294E+00 -0.2270 120 MgCl+ 0.15675E-04 -4.8048 0.92940E-05 -5.0318 0.59294E+00 -0.2270 121 MgF+ 0.65461E-06 -6.1840 0.38814E-06 -6.4110 0.59294E+00 -0.2270 122 MgOH+ 0.49660E-08 -8.3040 0.29445E-08 -8.5310 0.59294E+00 -0.2270 124 MnF+ 0.20404E-07 -7.6903 0.12098E-07 -7.9173 0.59294E+00 -0.2270 126 MnOH+ 0.38677E-08 -8.4125 0.22933E-08 -8.6395 0.59294E+00 -0.2270 131 MnCl+ 0.13086E-04 -4.8832 0.77592E-05 -5.1102 0.59294E+00 -0.2270 132 MnSO4,aq 0.43477E-08 -8.3617 0.43477E-08 -8.3617 0.10000E+01 0.0000 133 NaCl,aq 0.12703E+00 -0.8961 0.12703E+00 -0.8961 0.10000E+01 0.0000 134 NaF,aq 0.93118E-04 -4.0310 0.93118E-04 -4.0310 0.10000E+01 0.0000 135 NaOH,aq 0.14858E-06 -6.8280 0.14858E-06 -6.8280 0.10000E+01 0.0000 137 OH- 0.64516E-06 -6.1903 0.36730E-06 -6.4350 0.56932E+00 -0.2446 140 PbCl+ 0.30118E-07 -7.5212 0.17858E-07 -7.7482 0.59294E+00 -0.2270 141 PbCl2,aq 0.77958E-07 -7.1081 0.77958E-07 -7.1081 0.10000E+01 0.0000 142 PbCl3- 0.38764E-07 -7.4116 0.22524E-07 -7.6474 0.58104E+00 -0.2358 143 PbCl4-2 0.32697E-07 -7.4855 0.27524E-08 -8.5603 0.84181E-01 -1.0748 144 PbF+ 0.55208E-10 -10.2580 0.32735E-10 -10.4850 0.59294E+00 -0.2270 148 Pb(HS)2,aq 0.42492E-10 -10.3717 0.42492E-10 -10.3717 0.10000E+01 0.0000 150 H2S,aq 0.57606E-05 -5.2395 0.51985E-05 -5.2841 0.90242E+00 -0.0446 158 HSO3- 0.33462E-10 -10.4755 0.19443E-10 -10.7112 0.58104E+00 -0.2358 159 HSO4- 0.39091E-06 -6.4079 0.23454E-06 -6.6298 0.59998E+00 -0.2219 173 ZnCl+ 0.23053E-05 -5.6373 0.13669E-05 -5.8643 0.59294E+00 -0.2270 174 ZnCl2,aq 0.43554E-06 -6.3610 0.43554E-06 -6.3610 0.10000E+01 0.0000 175 ZnCl3- 0.48843E-07 -7.3112 0.28380E-07 -7.5470 0.58104E+00 -0.2358 176 ZnF+ 0.19793E-09 -9.7035 0.11736E-09 -9.9305 0.59294E+00 -0.2270 177 ZnO,aq 0.20144E-10 -10.6959 0.20144E-10 -10.6959 0.10000E+01 0.0000 178 ZnOH+ 0.59245E-07 -7.2273 0.35128E-07 -7.4543 0.59294E+00 -0.2270 Charge balance for all species = -.8627E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1368714E-04 0.2152862E+00 0.2024585E+03 0.0000 2 H2O 0.1000000E+01 0.5529309E+02 0.9293888E+06 0.0000 3 Cl- 0.9009206E+00 0.1028625E+01 0.3402478E+05 4.8239 4 SO4-- 0.1165145E-03 0.1255570E-03 0.1125319E+02 5.2108 5 HCO3- 0.1769970E-01 0.2329137E+00 0.1325966E+05 3.1243 6 HS- 0.4456620E-06 0.6217624E-05 0.1918536E+00 -1.4811 7 H4SiO4 0.1867395E-02 0.1870718E-02 0.1677592E+03 -2.7288 8 Al+++ 0.7537863E-12 0.2252816E-07 0.5671224E-03 0.7387 9 Ca++ 0.1049633E-02 0.1401246E-02 0.5239690E+02 6.1299 10 Mg++ 0.9162876E-04 0.1143325E-03 0.2593436E+01 5.0497 11 Fe++ 0.8696241E-06 0.1049566E-05 0.5468834E-01 3.0321 12 K+ 0.2989557E-01 0.3025580E-01 0.1103806E+04 3.3525 13 Na+ 0.8871219E+00 0.1014247E+01 0.2175525E+05 4.8155 14 Mn++ 0.9833488E-05 0.2294813E-04 0.1176265E+01 4.0893 15 Zn++ 0.5342204E-07 0.2902594E-05 0.1770312E+00 1.8205 16 Cu+ 0.9891253E-12 0.2525180E-07 0.1497010E-02 -7.1375 17 Pb++ 0.3799496E-08 0.1834365E-06 0.3546007E-01 0.7023 18 Ag+ 0.2936982E-11 0.3169091E-07 0.3189485E-02 -6.6570 19 Au+ 0.4587029E-22 0.2070670E-11 0.3805304E-06 -17.4605 20 Ba++ 0.1682164E-05 0.2705283E-05 0.3466529E+00 3.3576 21 F- 0.9303303E-03 0.1083622E-02 0.1920750E+02 1.8278 22 H2AsO3- 0.1894083E-06 0.8628898E-04 0.1005835E+02 -1.7842 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234446E+00 -.9409415E-05 0.0000000E+00 2 H2O 0.8307198E+02 0.8307198E+02 -.1322190E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886360E-03 0.3305475E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.9341318E-05 0.4688993E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810554E-02 0.1186716E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.3384615E-07 0.2373433E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1576861E-05 0.2644380E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.4360838E-05 0.3107338E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.3793814E-07 0.1322190E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.2755938E-06 0.1289427E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.4761222E-07 0.3795159E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628027E-02 0.2373433E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.161027E+04 g Temperature = 143.72 C Pressure = 500.00 bar Mixer frac. = 0.5000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.1898E-06 -6.722 0.4702E-04 -4.328 5.284 0.6603E-05 bornite 0.2644E-07 -7.578 0.1327E-04 -4.877 1.491 0.2611E-05 topaz 0.1187E-05 -5.926 0.2184E-03 -3.661 24.54 0.6114E-04 galena 0.1289E-05 -5.890 0.3085E-03 -3.511 34.66 0.4060E-04 sphalerite 0.3107E-05 -5.508 0.3027E-03 -3.519 34.02 0.7404E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 0.5000000 Solid products produced: Mass = 0.000890 g Volume = 0.000185 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.400 AFFINITY: 0.2668E+03 GOLD Q/K: 0.0786 SILVER Q/K: 0.1536 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 143.7232 deg.C Sat. pressure: 57.7667 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1129E+00 0.7396 0.4824E+01 0.6523E+01 CO2,gas 0.8868E+00 0.9029 0.4625E+02 0.5123E+02 CH4,gas 0.1010E-07 1.0598 0.6184E-06 0.5835E-06 H2,gas 0.5271E-06 1.0280 0.3130E-04 0.3045E-04 H2S,gas 0.5870E-05 0.8529 0.2892E-03 0.3391E-03 S2,gas 0.1815E-16 1.0000 0.1049E-14 0.1049E-14 CO,gas 0.5510E-08 1.0000 0.3183E-06 0.3183E-06 SO3,gas 0.2487E-28 1.0000 0.1437E-26 0.1437E-26 O2,gas 0.3015E-03 1.0000 0.1742E-01 0.1742E-01 SO2,gas 0.4896E-13 1.0000 0.2828E-11 0.2828E-11 HF,gas 0.1355E-07 1.0000 0.7830E-06 0.7830E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -25.01 -25.01 0.00 0.000 0.00000E+00 206 bornite -79.85 -79.85 0.00 0.000 0.27108E-10 226 topaz -18.02 -18.02 0.00 0.000 0.00000E+00 261 galena -10.99 -10.99 0.00 0.000 0.00000E+00 273 sphalerite -9.87 -9.87 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 2.00 -0.01 -2.02 -2.016 0.38447E+04 0.683 2 CO2,gas -6.04 -7.07 -1.03 -0.345 0.19721E+04 1.665 3 CH4,gas 5.33 -3.58 -8.91 -2.227 0.16992E+05 -6.209 4 H2,gas 8.07 0.86 -7.20 -4.116 0.13741E+05 -4.504 5 H2S,gas -5.45 -11.69 -6.24 -3.119 0.11899E+05 -3.539 6 S2,gas -7.43 -25.11 -17.68 -2.720 0.33722E+05 -14.979 7 CO,gas 3.00 -6.19 -9.20 -2.830 0.17542E+05 -6.497 8 SO3,gas 14.35 -15.19 -29.54 -7.385 0.56352E+05 -26.843 9 O2,gas 43.75 -1.76 -45.51 -30.342 0.86819E+05 -42.814 10 SO2,gas -0.07 -14.31 -14.25 -3.799 0.27178E+05 -11.549 11 HF,gas 0.42 -8.38 -8.81 -4.403 0.16796E+05 -6.106 12 HCl,gas 4.82 -5.39 -10.20 -5.102 0.19463E+05 -10.203 13 acmite 6.94 1.99 -4.95 -0.515 0.94499E+04 17 albite-high -0.21 -2.57 -2.36 -0.182 0.45098E+04 18 albite -1.08 -2.57 -1.49 -0.115 0.28423E+04 22 analcite 2.25 0.11 -2.14 -0.238 0.40864E+04 23 andalusite 2.13 -1.27 -3.39 -0.339 0.64732E+04 26 anhydrite -5.77 -9.08 -3.31 -1.656 0.63176E+04 27 ankerite -2.82 -5.01 -2.19 -0.364 0.41681E+04 34 aragonite 0.55 -0.96 -1.51 -0.503 0.28758E+04 36 calcite 0.41 -0.96 -1.37 -0.456 0.26113E+04 37 carnegieite-low 7.28 2.83 -4.45 -0.636 0.84934E+04 39 carpholite-Mg 5.44 1.04 -4.40 -0.293 0.83927E+04 40 carpholite-Fe 3.75 -0.98 -4.73 -0.315 0.90241E+04 50 chloritoid-Fe 5.76 1.74 -4.02 -0.268 0.76670E+04 53 coesite -2.08 -2.70 -0.62 -0.205 0.11752E+04 58 corundum 5.09 1.43 -3.66 -0.333 0.69772E+04 60 cristobalite -2.25 -2.70 -0.44 -0.148 0.84805E+03 63 cymrite-K 0.89 -4.05 -4.94 -0.412 0.94200E+04 65 diaspore 1.52 0.71 -0.81 -0.135 0.15422E+04 66 diamond -2.61 -5.31 -2.71 -0.773 0.51613E+04 69 dolomite,ordered -0.40 -2.99 -2.59 -0.431 0.49354E+04 83 gibbsite 2.72 0.69 -2.02 -0.289 0.38602E+04 86 goethite 5.47 2.57 -2.90 -0.627 0.55299E+04 87 graphite -3.01 -5.31 -2.30 -0.656 0.43827E+04 90 halite 1.54 -0.57 -2.11 -1.056 0.40285E+04 92 heulandite -6.99 -11.43 -4.45 -0.202 0.84792E+04 96 jadeite 3.06 0.13 -2.94 -0.294 0.56020E+04 98 kalsilite 6.05 1.36 -4.68 -0.669 0.89358E+04 99 kaolinite -3.05 -4.00 -0.95 -0.086 0.18101E+04 100 kyanite 2.02 -1.27 -3.29 -0.329 0.62769E+04 102 laumontite 0.84 -3.31 -4.15 -0.276 0.79090E+04 103 lawsonite 6.68 2.12 -4.56 -0.304 0.86970E+04 104 leucite 2.91 -1.34 -4.25 -0.425 0.81076E+04 107 magnesite 0.03 -2.04 -2.07 -0.689 0.39405E+04 117 microcline -2.83 -4.04 -1.21 -0.093 0.23024E+04 121 muscovite -0.49 -2.62 -2.13 -0.125 0.40574E+04 122 paragonite 0.90 -1.15 -2.05 -0.121 0.39176E+04 123 nepheline 6.64 2.83 -3.81 -0.545 0.72733E+04 143 pyrite -19.98 -21.21 -1.23 -0.290 0.23496E+04 144 pyrrhotite -4.49 -8.66 -4.17 -1.391 0.79609E+04 145 pyrrhotiteFe0.875 -6.02 -9.15 -3.12 -1.148 0.59526E+04 147 pyrophyllite -7.48 -9.38 -1.90 -0.118 0.36158E+04 148 quartz -2.63 -2.70 -0.07 -0.023 0.13388E+03 153 rhodochrosite -1.27 -3.00 -1.72 -0.574 0.32838E+04 155 sanidine -1.74 -4.04 -2.29 -0.176 0.43703E+04 157 siderite -2.92 -4.05 -1.13 -0.378 0.21633E+04 158 sillimanite 2.34 -1.27 -3.60 -0.360 0.68704E+04 165 stilbite -7.72 -11.45 -3.73 -0.178 0.71135E+04 171 sulfur -8.68 -12.56 -3.87 -1.192 0.73915E+04 172 sylvite 1.46 -2.03 -3.49 -1.745 0.66555E+04 180 topaz-H 2.08 -1.28 -3.36 -0.306 0.64162E+04 181 tridymite -2.30 -2.70 -0.40 -0.134 0.76624E+03 184 troilite-low -4.59 -8.66 -4.07 -1.356 0.77604E+04 190 wairakite 1.55 -3.28 -4.83 -0.284 0.92039E+04 196 akaganeite 6.53 2.57 -3.96 -0.856 0.75560E+04 198 arsenic -6.34 -10.65 -4.32 -1.114 0.82345E+04 201 beidellite-Ca -3.87 -7.24 -3.38 -0.209 0.64398E+04 202 beidellite-H -4.44 -8.25 -3.82 -0.244 0.72827E+04 203 beidellite-K -3.58 -7.15 -3.57 -0.218 0.68059E+04 204 beidellite-Mg -4.08 -7.42 -3.34 -0.207 0.63754E+04 205 beidellite-Na -3.46 -6.66 -3.21 -0.196 0.61198E+04 208 chalcedony -2.46 -2.70 -0.24 -0.079 0.45306E+03 209 chalcocite -24.78 -25.97 -1.19 -0.297 0.22670E+04 211 covellite -17.92 -19.26 -1.34 -0.510 0.25528E+04 212 dawsonite 0.87 -1.56 -2.43 -0.304 0.46400E+04 214 montmorillonite-Ca -3.76 -6.94 -3.19 -0.197 0.60787E+04 215 montmorillonite-K -3.55 -6.85 -3.29 -0.202 0.62835E+04 216 montmorillonite-Mg -3.97 -7.12 -3.15 -0.195 0.60121E+04 217 montmorillonite-Na -3.38 -6.37 -2.99 -0.183 0.57048E+04 230 gypsum -5.12 -9.11 -3.99 -0.996 0.76032E+04 246 acanthite -24.87 -25.01 -0.14 -0.035 0.26527E+03 252 barite -9.31 -11.85 -2.54 -1.271 0.48491E+04 253 boehmite 2.81 0.71 -2.10 -0.350 0.40097E+04 254 cerussite -2.71 -6.38 -3.68 -1.226 0.70145E+04 255 chalcopyrite -26.34 -27.92 -1.58 -0.294 0.30118E+04 257 copper,native -2.28 -6.71 -4.42 -1.538 0.84323E+04 258 dolomite,disordered 0.16 -2.99 -3.15 -0.526 0.60148E+04 260 fluorite -9.85 -10.63 -0.79 -0.263 0.15035E+04 262 gold,native -15.92 -17.03 -1.10 -0.384 0.21071E+04 263 silver,native -5.41 -6.22 -0.81 -0.283 0.15522E+04 270 silica-amorphous -1.83 -2.70 -0.86 -0.288 0.16481E+04 271 smithsonite -1.19 -5.27 -4.08 -1.360 0.77822E+04 274 wurtzite -8.23 -9.87 -1.64 -0.547 0.31288E+04 276 an20ab80 0.70 -1.63 -2.33 -0.179 0.44477E+04 277 an25ab75 1.18 -1.39 -2.57 -0.198 0.49008E+04 278 an30ab70 1.66 -1.16 -2.81 -0.216 0.53646E+04 Calculations done for 143.7232 Deg. C; 500.0000 bar Mixer fraction: 0.5000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 143.723 .11615E+01 2.746 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.8481E+02 New heat: 2.617 New temperature: 136.531 New mixer fraction: 0.6000000 Resulting temperature: 136.531Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 136.53 C Pressure = 500.00 bar Mixer fraction = 0.6000000 Water: Moles liquid = 0.8895E+02 kg liquid = 0.1602E+01 Moles total = 0.8862E+02 kg total = 0.1597E+01 Activity = 0.9682 Stoichiometric ionic strength = .1088705E+01 Osmotic coef. = 0.9294 True ionic strength = .8743790E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.14870E-04 -4.8277 0.87286E-05 -5.0591 0.58700E+00 -0.2314 2 H2O 0.96822E+00 -0.0140 0.96822E+00 -0.0140 3 Cl- 0.85548E+00 -0.0678 0.50391E+00 -0.2976 0.58903E+00 -0.2299 4 SO4-- 0.10980E-03 -3.9594 0.10330E-04 -4.9859 0.94081E-01 -1.0265 5 HCO3- 0.16603E-01 -1.7798 0.99158E-02 -2.0037 0.59723E+00 -0.2239 6 HS- 0.36400E-06 -6.4389 0.21470E-06 -6.6682 0.58984E+00 -0.2293 7 H4SiO4 0.17513E-02 -2.7566 0.17513E-02 -2.7566 0.10000E+01 0.0000 8 Al+++ 0.11762E-11 -11.9295 0.51586E-14 -14.2875 0.43857E-02 -2.3580 9 Ca++ 0.10100E-02 -2.9957 0.88109E-04 -4.0550 0.87234E-01 -1.0593 10 Mg++ 0.87161E-04 -4.0597 0.72885E-05 -5.1374 0.83621E-01 -1.0777 11 Fe++ 0.82498E-06 -6.0836 0.69680E-07 -7.1569 0.84462E-01 -1.0733 12 K+ 0.28084E-01 -1.5515 0.16779E-01 -1.7752 0.59748E+00 -0.2237 13 Na+ 0.84248E+00 -0.0744 0.49408E+00 -0.3062 0.58646E+00 -0.2318 14 Mn++ 0.10083E-04 -4.9964 0.85814E-06 -6.0664 0.85109E-01 -1.0700 15 Zn++ 0.59380E-07 -7.2264 0.50153E-08 -8.2997 0.84462E-01 -1.0733 16 Cu+ 0.67945E-12 -12.1678 0.39827E-12 -12.3998 0.58617E+00 -0.2320 17 Pb++ 0.33987E-08 -8.4687 0.30486E-09 -9.5159 0.89699E-01 -1.0472 18 Ag+ 0.19691E-11 -11.7057 0.11722E-11 -11.9310 0.59528E+00 -0.2253 19 Au+ 0.27448E-22 -22.5615 0.16435E-22 -22.7842 0.59875E+00 -0.2228 20 Ba++ 0.16719E-05 -5.7768 0.15281E-06 -6.8158 0.91397E-01 -1.0391 21 F- 0.88162E-03 -3.0547 0.51059E-03 -3.2919 0.57914E+00 -0.2372 22 H2AsO3- 0.13605E-06 -6.8663 0.92606E-07 -7.0334 0.68068E+00 -0.1671 24 HSiO3- 0.69337E-06 -6.1590 0.40842E-06 -6.3889 0.58903E+00 -0.2299 25 Ca(HSiO3)+ 0.22405E-08 -8.6497 0.13415E-08 -8.8724 0.59875E+00 -0.2228 26 Mg(HSiO3)+ 0.19749E-09 -9.7045 0.11824E-09 -9.9272 0.59875E+00 -0.2228 27 NaHSiO3,aq 0.20151E-05 -5.6957 0.20151E-05 -5.6957 0.10000E+01 0.0000 31 AgCl,aq 0.33364E-09 -9.4767 0.33364E-09 -9.4767 0.10000E+01 0.0000 32 AgCl2- 0.11206E-07 -7.9505 0.66007E-08 -8.1804 0.58903E+00 -0.2299 33 AgCl3-2 0.44816E-08 -8.3486 0.41370E-09 -9.3833 0.92309E-01 -1.0348 34 AgCl4-3 0.31158E-09 -9.5064 0.14148E-11 -11.8493 0.45408E-02 -2.3429 38 Ag(HS),aq 0.45360E-08 -8.3433 0.45360E-08 -8.3433 0.10000E+01 0.0000 40 AlO+ 0.15644E-09 -9.8057 0.93665E-10 -10.0284 0.59875E+00 -0.2228 41 AlOH+2 0.16138E-10 -10.7922 0.13859E-11 -11.8583 0.85879E-01 -1.0661 42 HAlO2,aq 0.62541E-08 -8.2038 0.62541E-08 -8.2038 0.10000E+01 0.0000 43 AlO2- 0.75225E-08 -8.1236 0.43637E-08 -8.3601 0.58008E+00 -0.2365 44 AsO2- 0.50326E-07 -7.2982 0.29644E-07 -7.5281 0.58903E+00 -0.2299 45 HAsO2,aq 0.27771E-04 -4.5564 0.27771E-04 -4.5564 0.10000E+01 0.0000 46 H3AsO3,aq 0.52947E-04 -4.2762 0.52947E-04 -4.2762 0.10000E+01 0.0000 48 H2AsO4- 0.16329E-10 -10.7870 0.96185E-11 -11.0169 0.58903E+00 -0.2299 62 BaCO3,aq 0.13540E-09 -9.8684 0.13540E-09 -9.8684 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.45098E-06 -6.3458 0.27276E-06 -6.5642 0.60481E+00 -0.2184 64 BaCl+ 0.41286E-06 -6.3842 0.24720E-06 -6.6070 0.59875E+00 -0.2228 65 BaF+ 0.54435E-09 -9.2641 0.32593E-09 -9.4869 0.59875E+00 -0.2228 66 CH4,aq 0.22038E-09 -9.6568 0.19895E-09 -9.7013 0.90275E+00 -0.0444 71 CO,aq 0.10262E-09 -9.9888 0.10262E-09 -9.9888 0.10000E+01 0.0000 72 CO2,aq 0.20170E+00 -0.6953 0.18209E+00 -0.7397 0.90275E+00 -0.0444 73 CO3-2 0.15231E-05 -5.8173 0.14060E-06 -6.8520 0.92309E-01 -1.0348 74 CaCO3,aq 0.31648E-06 -6.4997 0.31648E-06 -6.4997 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.65747E-04 -4.1821 0.39366E-04 -4.4049 0.59875E+00 -0.2228 76 CaCl+ 0.22153E-03 -3.6546 0.13264E-03 -3.8773 0.59875E+00 -0.2228 77 CaCl2,aq 0.13673E-04 -4.8641 0.13673E-04 -4.8641 0.10000E+01 0.0000 78 CaF+ 0.20559E-05 -5.6870 0.12310E-05 -5.9098 0.59875E+00 -0.2228 79 CaOH+ 0.92071E-08 -8.0359 0.55127E-08 -8.2586 0.59875E+00 -0.2228 80 CaSO4,aq 0.43904E-06 -6.3575 0.43904E-06 -6.3575 0.10000E+01 0.0000 81 HCl,aq 0.13277E-05 -5.8769 0.13277E-05 -5.8769 0.10000E+01 0.0000 90 CuCl,aq 0.96850E-09 -9.0139 0.96850E-09 -9.0139 0.10000E+01 0.0000 91 CuCl2- 0.13370E-07 -7.8739 0.78755E-08 -8.1037 0.58903E+00 -0.2299 92 CuCl3-2 0.19193E-08 -8.7169 0.17717E-09 -9.7516 0.92309E-01 -1.0348 98 HF,aq 0.52345E-04 -4.2811 0.52345E-04 -4.2811 0.10000E+01 0.0000 99 HF2- 0.13433E-07 -7.8718 0.79122E-08 -8.1017 0.58903E+00 -0.2299 101 FeCl+ 0.15094E-06 -6.8212 0.90372E-07 -7.0440 0.59875E+00 -0.2228 102 FeCl2,aq 0.26718E-10 -10.5732 0.26718E-10 -10.5732 0.10000E+01 0.0000 104 FeF+ 0.44833E-08 -8.3484 0.26844E-08 -8.5712 0.59875E+00 -0.2228 107 FeOH+ 0.21528E-08 -8.6670 0.12890E-08 -8.8898 0.59875E+00 -0.2228 113 H2,aq 0.15562E-07 -7.8079 0.14049E-07 -7.8524 0.90275E+00 -0.0444 114 KCl,aq 0.27700E-03 -3.5575 0.27700E-03 -3.5575 0.10000E+01 0.0000 115 KHSO4,aq 0.25127E-10 -10.5999 0.25127E-10 -10.5999 0.10000E+01 0.0000 116 KOH,aq 0.40355E-08 -8.3941 0.40355E-08 -8.3941 0.10000E+01 0.0000 117 KSO4- 0.71279E-05 -5.1470 0.41986E-05 -5.3769 0.58903E+00 -0.2299 118 MgCO3,aq 0.49771E-08 -8.3030 0.49771E-08 -8.3030 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.54745E-05 -5.2617 0.32778E-05 -5.4844 0.59875E+00 -0.2228 120 MgCl+ 0.13979E-04 -4.8545 0.83700E-05 -5.0773 0.59875E+00 -0.2228 121 MgF+ 0.57390E-06 -6.2412 0.34362E-06 -6.4639 0.59875E+00 -0.2228 122 MgOH+ 0.33241E-08 -8.4783 0.19903E-08 -8.7011 0.59875E+00 -0.2228 124 MnF+ 0.19483E-07 -7.7103 0.11665E-07 -7.9331 0.59875E+00 -0.2228 126 MnOH+ 0.29398E-08 -8.5317 0.17602E-08 -8.7544 0.59875E+00 -0.2228 131 MnCl+ 0.11406E-04 -4.9429 0.68295E-05 -5.1656 0.59875E+00 -0.2228 132 MnSO4,aq 0.44136E-08 -8.3552 0.44136E-08 -8.3552 0.10000E+01 0.0000 133 NaCl,aq 0.10839E+00 -0.9650 0.10839E+00 -0.9650 0.10000E+01 0.0000 134 NaF,aq 0.79341E-04 -4.1005 0.79341E-04 -4.1005 0.10000E+01 0.0000 135 NaOH,aq 0.10428E-06 -6.9818 0.10428E-06 -6.9818 0.10000E+01 0.0000 137 OH- 0.47702E-06 -6.3215 0.27671E-06 -6.5580 0.58008E+00 -0.2365 140 PbCl+ 0.24991E-07 -7.6022 0.14963E-07 -7.8250 0.59875E+00 -0.2228 141 PbCl2,aq 0.58349E-07 -7.2340 0.58349E-07 -7.2340 0.10000E+01 0.0000 142 PbCl3- 0.26642E-07 -7.5744 0.15693E-07 -7.8043 0.58903E+00 -0.2299 143 PbCl4-2 0.20360E-07 -7.6912 0.18794E-08 -8.7260 0.92309E-01 -1.0348 144 PbF+ 0.47812E-10 -10.3205 0.28627E-10 -10.5432 0.59875E+00 -0.2228 148 Pb(HS)2,aq 0.32110E-10 -10.4934 0.32110E-10 -10.4934 0.10000E+01 0.0000 150 H2S,aq 0.51242E-05 -5.2904 0.46259E-05 -5.3348 0.90275E+00 -0.0444 158 HSO3- 0.23181E-10 -10.6349 0.13654E-10 -10.8647 0.58903E+00 -0.2299 159 HSO4- 0.35038E-06 -6.4555 0.21213E-06 -6.6734 0.60541E+00 -0.2179 173 ZnCl+ 0.19470E-05 -5.7106 0.11658E-05 -5.9334 0.59875E+00 -0.2228 174 ZnCl2,aq 0.34772E-06 -6.4588 0.34772E-06 -6.4588 0.10000E+01 0.0000 175 ZnCl3- 0.37803E-07 -7.4225 0.22267E-07 -7.6523 0.58903E+00 -0.2299 176 ZnF+ 0.20697E-09 -9.6841 0.12392E-09 -9.9069 0.59875E+00 -0.2228 177 ZnO,aq 0.12027E-10 -10.9198 0.12027E-10 -10.9198 0.10000E+01 0.0000 178 ZnOH+ 0.45037E-07 -7.3464 0.26966E-07 -7.5692 0.59875E+00 -0.2228 Charge balance for all species = -.8089E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1486981E-04 0.2018512E+00 0.1906210E+03 0.0000 2 H2O 0.1000000E+01 0.5530652E+02 0.9335175E+06 0.0000 3 Cl- 0.8554815E+00 0.9644323E+00 0.3203534E+05 4.7614 4 SO4-- 0.1098035E-03 0.1177212E-03 0.1059520E+02 5.1322 5 HCO3- 0.1660305E-01 0.2183783E+00 0.1248436E+05 3.0554 6 HS- 0.3640026E-06 0.5496991E-05 0.1703296E+00 -1.6091 7 H4SiO4 0.1751258E-02 0.1753969E-02 0.1579500E+03 -2.7566 8 Al+++ 0.1176225E-11 0.1395028E-07 0.3526580E-03 0.8897 9 Ca++ 0.1010030E-02 0.1313799E-02 0.4933325E+02 6.0631 10 Mg++ 0.8716126E-04 0.1071974E-03 0.2441797E+01 4.9808 11 Fe++ 0.8249818E-06 0.9825828E-06 0.5141308E-01 2.9612 12 K+ 0.2808350E-01 0.2836764E-01 0.1039266E+04 3.2838 13 Na+ 0.8424755E+00 0.9509514E+00 0.2048322E+05 4.7529 14 Mn++ 0.1008286E-04 0.2151602E-04 0.1107489E+01 4.0517 15 Zn++ 0.5937978E-07 0.2437178E-05 0.1492693E+00 1.8184 16 Cu+ 0.6794530E-12 0.1625865E-07 0.9679133E-03 -7.3408 17 Pb++ 0.3398681E-08 0.1338204E-06 0.2597741E-01 0.6022 18 Ag+ 0.1969102E-11 0.2087151E-07 0.2109402E-02 -6.8720 19 Au+ 0.2744846E-22 0.1941446E-11 0.3582807E-06 -17.7252 20 Ba++ 0.1671936E-05 0.2536456E-05 0.3263841E+00 3.3023 21 F- 0.8816222E-03 0.1015990E-02 0.1808430E+02 1.7671 22 H2AsO3- 0.1360490E-06 0.8090397E-04 0.9470241E+01 -1.9743 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234451E+00 -.9962997E-05 0.0000000E+00 2 H2O 0.8862280E+02 0.8862280E+02 -.1441044E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886357E-03 0.3602609E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.8808342E-05 0.5221968E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810548E-02 0.1192463E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.2235384E-07 0.2384925E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1574484E-05 0.2882087E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.3905319E-05 0.3562858E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.2605276E-07 0.1441044E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.2144330E-06 0.1350588E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.3344438E-07 0.3936837E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628015E-02 0.2384925E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1694E-20 Mass of aqueous solution: 0.171027E+04 g Temperature = 136.53 C Pressure = 500.00 bar Mixer frac. = 0.6000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.1968E-06 -6.706 0.4878E-04 -4.312 5.119 0.6850E-05 bornite 0.2882E-07 -7.540 0.1446E-04 -4.840 1.518 0.2845E-05 topaz 0.1192E-05 -5.924 0.2195E-03 -3.659 23.03 0.6144E-04 galena 0.1351E-05 -5.869 0.3231E-03 -3.491 33.91 0.4253E-04 sphalerite 0.3563E-05 -5.448 0.3471E-03 -3.460 36.43 0.8489E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 0.6000000 Solid products produced: Mass = 0.000953 g Volume = 0.000199 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2164E+03 GOLD Q/K: 0.0992 SILVER Q/K: 0.1361 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 136.5306 deg.C Sat. pressure: 52.5396 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.1000E+00 0.7566 0.3977E+01 0.5256E+01 CO2,gas 0.9000E+00 0.9046 0.4277E+02 0.4728E+02 CH4,gas 0.8905E-08 1.0520 0.4922E-06 0.4679E-06 H2,gas 0.4090E-06 1.0259 0.2205E-04 0.2149E-04 H2S,gas 0.5619E-05 0.8585 0.2535E-03 0.2952E-03 S2,gas 0.1296E-16 1.0000 0.6810E-15 0.6810E-15 CO,gas 0.3903E-08 1.0000 0.2051E-06 0.2051E-06 SO3,gas 0.9069E-29 1.0000 0.4765E-27 0.4765E-27 O2,gas 0.6819E-48 1.0000 0.3583E-46 0.3583E-46 SO2,gas 0.3160E-13 1.0000 0.1660E-11 0.1660E-11 HF,gas 0.1094E-07 1.0000 0.5745E-06 0.5745E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -25.47 -25.47 0.00 0.000 0.00000E+00 206 bornite -81.07 -81.07 0.00 0.000 -0.26640E-10 226 topaz -17.68 -17.68 0.00 0.000 -0.13320E-10 261 galena -11.13 -11.13 0.00 0.000 0.00000E+00 273 sphalerite -9.91 -9.91 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 2.09 -0.01 -2.10 -2.099 0.39356E+04 0.600 2 CO2,gas -5.98 -7.05 -1.07 -0.356 0.20018E+04 1.631 3 CH4,gas 5.31 -3.70 -9.01 -2.252 0.16884E+05 -6.308 4 H2,gas 8.19 0.83 -7.36 -4.203 0.13789E+05 -4.657 5 H2S,gas -5.43 -11.73 -6.30 -3.148 0.11801E+05 -3.596 6 S2,gas -7.25 -25.11 -17.87 -2.749 0.33492E+05 -15.167 7 CO,gas 3.18 -6.20 -9.39 -2.888 0.17597E+05 -6.688 8 SO3,gas 14.93 -15.09 -30.02 -7.505 0.56278E+05 -27.322 9 O2,gas 47.46 -1.69 -49.14 -32.763 0.92128E+05 -46.446 10 SO2,gas 0.23 -14.25 -14.48 -3.861 0.27142E+05 -11.780 11 HF,gas 0.59 -8.35 -8.94 -4.470 0.16759E+05 -6.241 12 HCl,gas 2.31 -5.36 -7.67 -3.835 0.14380E+05 -7.671 17 albite-high -0.01 -2.57 -2.56 -0.197 0.48061E+04 18 albite -0.91 -2.57 -1.66 -0.128 0.31094E+04 22 analcite 2.47 0.14 -2.33 -0.259 0.43626E+04 23 andalusite 2.64 -0.99 -3.63 -0.363 0.68027E+04 26 anhydrite -5.64 -9.04 -3.40 -1.701 0.63790E+04 27 ankerite -2.66 -5.10 -2.45 -0.408 0.45855E+04 34 aragonite 0.65 -1.00 -1.64 -0.548 0.30838E+04 36 calcite 0.51 -1.00 -1.51 -0.502 0.28244E+04 37 carnegieite-low 7.59 2.89 -4.70 -0.672 0.88171E+04 39 carpholite-Mg 5.99 1.22 -4.77 -0.318 0.89503E+04 50 chloritoid-Fe 6.35 1.94 -4.41 -0.294 0.82628E+04 53 coesite -2.12 -2.73 -0.61 -0.203 0.11399E+04 58 corundum 5.65 1.74 -3.91 -0.356 0.73385E+04 60 cristobalite -2.29 -2.73 -0.44 -0.147 0.82626E+03 65 diaspore 1.75 0.86 -0.89 -0.148 0.16653E+04 66 diamond -2.68 -5.36 -2.68 -0.765 0.50184E+04 69 dolomite,ordered -0.20 -3.08 -2.88 -0.480 0.54031E+04 83 gibbsite 2.94 0.85 -2.10 -0.300 0.39303E+04 86 goethite 5.63 2.52 -3.11 -0.672 0.58276E+04 87 graphite -3.10 -5.36 -2.27 -0.647 0.42463E+04 90 halite 1.56 -0.60 -2.16 -1.082 0.40563E+04 92 heulandite -6.68 -11.40 -4.72 -0.215 0.88511E+04 96 jadeite 3.28 0.16 -3.12 -0.312 0.58472E+04 98 kalsilite 6.32 1.42 -4.91 -0.701 0.91975E+04 99 kaolinite -2.72 -3.75 -1.03 -0.094 0.19336E+04 100 kyanite 2.52 -0.99 -3.52 -0.352 0.65901E+04 102 laumontite 1.25 -3.18 -4.44 -0.296 0.83187E+04 103 lawsonite 7.19 2.30 -4.89 -0.326 0.91727E+04 104 leucite 3.15 -1.31 -4.46 -0.446 0.83702E+04 107 magnesite 0.16 -2.08 -2.24 -0.747 0.41992E+04 117 microcline -2.71 -4.04 -1.33 -0.102 0.24907E+04 121 muscovite 0.09 -2.32 -2.41 -0.142 0.45143E+04 122 paragonite 1.52 -0.85 -2.37 -0.139 0.44396E+04 123 nepheline 6.94 2.89 -4.05 -0.579 0.76015E+04 143 pyrite -20.13 -21.32 -1.20 -0.281 0.22412E+04 144 pyrrhotite -4.42 -8.77 -4.34 -1.448 0.81415E+04 145 pyrrhotiteFe0.875 -6.00 -9.24 -3.24 -1.193 0.60806E+04 147 pyrophyllite -7.19 -9.19 -2.00 -0.125 0.37453E+04 148 quartz -2.67 -2.73 -0.05 -0.018 0.10109E+03 153 rhodochrosite -1.20 -3.01 -1.81 -0.603 0.33910E+04 155 sanidine -1.61 -4.04 -2.43 -0.187 0.45586E+04 157 siderite -2.84 -4.10 -1.26 -0.420 0.23635E+04 158 sillimanite 2.85 -0.99 -3.84 -0.384 0.72048E+04 165 stilbite -7.56 -11.41 -3.85 -0.183 0.72231E+04 171 sulfur -8.73 -12.56 -3.83 -1.179 0.71820E+04 172 sylvite 1.45 -2.07 -3.53 -1.763 0.66108E+04 180 topaz-H 2.52 -1.01 -3.53 -0.321 0.66173E+04 181 tridymite -2.33 -2.73 -0.40 -0.132 0.74124E+03 184 troilite-low -4.54 -8.77 -4.23 -1.410 0.79311E+04 196 akaganeite 6.73 2.52 -4.21 -0.911 0.78987E+04 198 arsenic -6.47 -10.81 -4.33 -1.118 0.81240E+04 201 beidellite-Ca -3.43 -7.01 -3.58 -0.221 0.67094E+04 202 beidellite-H -4.01 -8.01 -3.99 -0.255 0.74825E+04 203 beidellite-K -3.17 -6.92 -3.76 -0.230 0.70415E+04 204 beidellite-Mg -3.63 -7.18 -3.55 -0.220 0.66558E+04 205 beidellite-Na -3.04 -6.44 -3.40 -0.208 0.63777E+04 208 chalcedony -2.50 -2.73 -0.22 -0.075 0.42003E+03 209 chalcocite -25.21 -26.41 -1.20 -0.299 0.22406E+04 211 covellite -18.20 -19.48 -1.29 -0.490 0.24105E+04 212 dawsonite 1.03 -1.45 -2.48 -0.310 0.46502E+04 214 montmorillonite-Ca -3.45 -6.84 -3.39 -0.210 0.63641E+04 215 montmorillonite-K -3.27 -6.76 -3.49 -0.214 0.65426E+04 216 montmorillonite-Mg -3.65 -7.02 -3.36 -0.208 0.63078E+04 217 montmorillonite-Na -3.08 -6.27 -3.19 -0.195 0.59789E+04 230 gypsum -5.05 -9.07 -4.02 -1.006 0.75423E+04 246 acanthite -25.34 -25.47 -0.13 -0.033 0.24565E+03 252 barite -9.27 -11.80 -2.53 -1.264 0.47396E+04 253 boehmite 3.08 0.86 -2.22 -0.370 0.41604E+04 254 cerussite -2.70 -6.46 -3.76 -1.254 0.70551E+04 255 chalcopyrite -26.62 -28.25 -1.63 -0.303 0.30487E+04 257 copper,native -2.39 -6.93 -4.53 -1.576 0.84960E+04 258 dolomite,disordered 0.39 -3.08 -3.47 -0.578 0.65017E+04 260 fluorite -9.80 -10.64 -0.84 -0.280 0.15733E+04 262 gold,native -16.31 -17.31 -1.00 -0.349 0.18813E+04 263 silver,native -5.59 -6.46 -0.87 -0.301 0.16238E+04 270 silica-amorphous -1.86 -2.73 -0.87 -0.290 0.16290E+04 271 smithsonite -1.09 -5.24 -4.16 -1.386 0.77928E+04 274 wurtzite -8.24 -9.91 -1.67 -0.556 0.31289E+04 276 an20ab80 0.98 -1.59 -2.57 -0.197 0.48110E+04 277 an25ab75 1.47 -1.35 -2.82 -0.217 0.52875E+04 278 an30ab70 1.98 -1.10 -3.08 -0.237 0.57739E+04 Calculations done for 136.5306 Deg. C; 500.0000 bar Mixer fraction: 0.6000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 136.531 .10887E+01 2.617 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.9036E+02 New heat: 2.503 New temperature: 130.157 New mixer fraction: 0.7000000 Resulting temperature: 130.157Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 130.16 C Pressure = 500.00 bar Mixer fraction = 0.7000000 Water: Moles liquid = 0.9450E+02 kg liquid = 0.1702E+01 Moles total = 0.9417E+02 kg total = 0.1697E+01 Activity = 0.9700 Stoichiometric ionic strength = .1024534E+01 Osmotic coef. = 0.9302 True ionic strength = .8315605E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.15914E-04 -4.7982 0.95253E-05 -5.0211 0.59856E+00 -0.2229 2 H2O 0.97003E+00 -0.0132 0.97003E+00 -0.0132 3 Cl- 0.81374E+00 -0.0895 0.48534E+00 -0.3140 0.59643E+00 -0.2244 4 SO4-- 0.10380E-03 -3.9838 0.10568E-04 -4.9760 0.10181E+00 -0.9922 5 HCO3- 0.15634E-01 -1.8059 0.94340E-02 -2.0253 0.60343E+00 -0.2194 6 HS- 0.30222E-06 -6.5197 0.18046E-06 -6.7436 0.59710E+00 -0.2240 7 H4SiO4 0.16487E-02 -2.7829 0.16487E-02 -2.7829 0.10000E+01 0.0000 8 Al+++ 0.17462E-11 -11.7579 0.92773E-14 -14.0326 0.53127E-02 -2.2747 9 Ca++ 0.97163E-03 -3.0125 0.92210E-04 -4.0352 0.94903E-01 -1.0227 10 Mg++ 0.83073E-04 -4.0805 0.75981E-05 -5.1193 0.91462E-01 -1.0388 11 Fe++ 0.78461E-06 -6.1053 0.72383E-07 -7.1404 0.92254E-01 -1.0350 12 K+ 0.26473E-01 -1.5772 0.15969E-01 -1.7967 0.60321E+00 -0.2195 13 Na+ 0.80144E+00 -0.0961 0.47570E+00 -0.3227 0.59356E+00 -0.2265 14 Mn++ 0.10242E-04 -4.9896 0.95119E-06 -6.0217 0.92867E-01 -1.0321 15 Zn++ 0.64693E-07 -7.1891 0.59682E-08 -8.2242 0.92254E-01 -1.0350 16 Cu+ 0.47742E-12 -12.3211 0.28325E-12 -12.5478 0.59331E+00 -0.2267 17 Pb++ 0.30286E-08 -8.5188 0.29465E-09 -9.5307 0.97291E-01 -1.0119 18 Ag+ 0.13539E-11 -11.8684 0.81401E-12 -12.0894 0.60125E+00 -0.2209 19 Au+ 0.16993E-22 -22.7697 0.10269E-22 -22.9885 0.60435E+00 -0.2187 20 Ba++ 0.16507E-05 -5.7823 0.16333E-06 -6.7869 0.98949E-01 -1.0046 21 F- 0.83758E-03 -3.0770 0.49362E-03 -3.3066 0.58934E+00 -0.2296 22 H2AsO3- 0.10102E-06 -6.9956 0.68772E-07 -7.1626 0.68081E+00 -0.1670 24 HSiO3- 0.56668E-06 -6.2467 0.33799E-06 -6.4711 0.59643E+00 -0.2244 25 Ca(HSiO3)+ 0.17178E-08 -8.7650 0.10382E-08 -8.9837 0.60435E+00 -0.2187 26 Mg(HSiO3)+ 0.15479E-09 -9.8103 0.93548E-10 -10.0290 0.60435E+00 -0.2187 27 NaHSiO3,aq 0.16852E-05 -5.7733 0.16852E-05 -5.7733 0.10000E+01 0.0000 31 AgCl,aq 0.22737E-09 -9.6433 0.22737E-09 -9.6433 0.10000E+01 0.0000 32 AgCl2- 0.73010E-08 -8.1366 0.43545E-08 -8.3611 0.59643E+00 -0.2244 33 AgCl3-2 0.27179E-08 -8.5658 0.27204E-09 -9.5654 0.10009E+00 -0.9996 34 AgCl4-3 0.16884E-09 -9.7725 0.93339E-12 -12.0299 0.55283E-02 -2.2574 38 Ag(HS),aq 0.40751E-08 -8.3899 0.40751E-08 -8.3899 0.10000E+01 0.0000 40 AlO+ 0.14944E-09 -9.8255 0.90314E-10 -10.0442 0.60435E+00 -0.2187 41 AlOH+2 0.18592E-10 -10.7307 0.17403E-11 -11.7594 0.93601E-01 -1.0287 42 HAlO2,aq 0.47115E-08 -8.3268 0.47115E-08 -8.3268 0.10000E+01 0.0000 43 AlO2- 0.43582E-08 -8.3607 0.25704E-08 -8.5900 0.58978E+00 -0.2293 44 AsO2- 0.41261E-07 -7.3845 0.24609E-07 -7.6089 0.59643E+00 -0.2244 45 HAsO2,aq 0.26960E-04 -4.5693 0.26960E-04 -4.5693 0.10000E+01 0.0000 46 H3AsO3,aq 0.49049E-04 -4.3094 0.49049E-04 -4.3094 0.10000E+01 0.0000 48 H2AsO4- 0.12328E-10 -10.9091 0.73525E-11 -11.1336 0.59643E+00 -0.2244 62 BaCO3,aq 0.11142E-09 -9.9530 0.11142E-09 -9.9530 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.37379E-06 -6.4274 0.22794E-06 -6.6422 0.60982E+00 -0.2148 64 BaCl+ 0.36240E-06 -6.4408 0.21901E-06 -6.6595 0.60435E+00 -0.2187 65 BaF+ 0.48977E-09 -9.3100 0.29599E-09 -9.5287 0.60435E+00 -0.2187 66 CH4,aq 0.17257E-09 -9.7630 0.15592E-09 -9.8071 0.90356E+00 -0.0440 71 CO,aq 0.64904E-10 -10.1877 0.64904E-10 -10.1877 0.10000E+01 0.0000 72 CO2,aq 0.18985E+00 -0.7216 0.17154E+00 -0.7656 0.90356E+00 -0.0440 73 CO3-2 0.12743E-05 -5.8947 0.12754E-06 -6.8943 0.10009E+00 -0.9996 74 CaCO3,aq 0.25597E-06 -6.5918 0.25597E-06 -6.5918 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.57261E-04 -4.2421 0.34605E-04 -4.4609 0.60435E+00 -0.2187 76 CaCl+ 0.19379E-03 -3.7127 0.11712E-03 -3.9314 0.60435E+00 -0.2187 77 CaCl2,aq 0.11461E-04 -4.9408 0.11461E-04 -4.9408 0.10000E+01 0.0000 78 CaF+ 0.17984E-05 -5.7451 0.10869E-05 -5.9638 0.60435E+00 -0.2187 79 CaOH+ 0.61963E-08 -8.2079 0.37447E-08 -8.4266 0.60435E+00 -0.2187 80 CaSO4,aq 0.42337E-06 -6.3733 0.42337E-06 -6.3733 0.10000E+01 0.0000 81 HCl,aq 0.13136E-05 -5.8815 0.13136E-05 -5.8815 0.10000E+01 0.0000 90 CuCl,aq 0.67559E-09 -9.1703 0.67559E-09 -9.1703 0.10000E+01 0.0000 91 CuCl2- 0.88837E-08 -8.0514 0.52985E-08 -8.2758 0.59643E+00 -0.2244 92 CuCl3-2 0.11999E-08 -8.9209 0.12010E-09 -9.9205 0.10009E+00 -0.9996 98 HF,aq 0.48009E-04 -4.3187 0.48009E-04 -4.3187 0.10000E+01 0.0000 99 HF2- 0.11768E-07 -7.9293 0.70186E-08 -8.1538 0.59643E+00 -0.2244 101 FeCl+ 0.13368E-06 -6.8739 0.80789E-07 -7.0926 0.60435E+00 -0.2187 102 FeCl2,aq 0.13816E-10 -10.8596 0.13816E-10 -10.8596 0.10000E+01 0.0000 104 FeF+ 0.40517E-08 -8.3924 0.24486E-08 -8.6111 0.60435E+00 -0.2187 107 FeOH+ 0.16040E-08 -8.7948 0.96937E-09 -9.0135 0.60435E+00 -0.2187 113 H2,aq 0.10803E-07 -7.9664 0.97616E-08 -8.0105 0.90356E+00 -0.0440 114 KCl,aq 0.22216E-03 -3.6533 0.22216E-03 -3.6533 0.10000E+01 0.0000 115 KHSO4,aq 0.18154E-10 -10.7410 0.18154E-10 -10.7410 0.10000E+01 0.0000 116 KOH,aq 0.28166E-08 -8.5503 0.28166E-08 -8.5503 0.10000E+01 0.0000 117 KSO4- 0.62625E-05 -5.2033 0.37351E-05 -5.4277 0.59643E+00 -0.2244 118 MgCO3,aq 0.41752E-08 -8.3793 0.41752E-08 -8.3793 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.47638E-05 -5.3220 0.28790E-05 -5.5408 0.60435E+00 -0.2187 120 MgCl+ 0.12549E-04 -4.9014 0.75842E-05 -5.1201 0.60435E+00 -0.2187 121 MgF+ 0.50756E-06 -6.2945 0.30675E-06 -6.5132 0.60435E+00 -0.2187 122 MgOH+ 0.23069E-08 -8.6370 0.13942E-08 -8.8557 0.60435E+00 -0.2187 124 MnF+ 0.18536E-07 -7.7320 0.11202E-07 -7.9507 0.60435E+00 -0.2187 126 MnOH+ 0.22776E-08 -8.6425 0.13765E-08 -8.8612 0.60435E+00 -0.2187 131 MnCl+ 0.99845E-05 -5.0007 0.60341E-05 -5.2194 0.60435E+00 -0.2187 132 MnSO4,aq 0.44304E-08 -8.3536 0.44304E-08 -8.3536 0.10000E+01 0.0000 133 NaCl,aq 0.93579E-01 -1.0288 0.93579E-01 -1.0288 0.10000E+01 0.0000 134 NaF,aq 0.68359E-04 -4.1652 0.68359E-04 -4.1652 0.10000E+01 0.0000 135 NaOH,aq 0.75569E-07 -7.1217 0.75569E-07 -7.1217 0.10000E+01 0.0000 137 OH- 0.36300E-06 -6.4401 0.21409E-06 -6.6694 0.58978E+00 -0.2293 140 PbCl+ 0.20782E-07 -7.6823 0.12559E-07 -7.9010 0.60435E+00 -0.2187 141 PbCl2,aq 0.44204E-07 -7.3545 0.44204E-07 -7.3545 0.10000E+01 0.0000 142 PbCl3- 0.18654E-07 -7.7292 0.11126E-07 -7.9537 0.59643E+00 -0.2244 143 PbCl4-2 0.13045E-07 -7.8845 0.13057E-08 -8.8841 0.10009E+00 -0.9996 144 PbF+ 0.41340E-10 -10.3836 0.24984E-10 -10.6023 0.60435E+00 -0.2187 148 Pb(HS)2,aq 0.24742E-10 -10.6066 0.24742E-10 -10.6066 0.10000E+01 0.0000 150 H2S,aq 0.45962E-05 -5.3376 0.41529E-05 -5.3816 0.90356E+00 -0.0440 158 HSO3- 0.16462E-10 -10.7835 0.98183E-11 -11.0080 0.59643E+00 -0.2244 159 HSO4- 0.31450E-06 -6.5024 0.19206E-06 -6.7166 0.61069E+00 -0.2142 173 ZnCl+ 0.16479E-05 -5.7831 0.99589E-06 -6.0018 0.60435E+00 -0.2187 174 ZnCl2,aq 0.28044E-06 -6.5522 0.28044E-06 -6.5522 0.10000E+01 0.0000 175 ZnCl3- 0.29661E-07 -7.5278 0.17691E-07 -7.7523 0.59643E+00 -0.2244 176 ZnF+ 0.21293E-09 -9.6718 0.12868E-09 -9.8905 0.60435E+00 -0.2187 178 ZnOH+ 0.34759E-07 -7.4589 0.21007E-07 -7.6776 0.60435E+00 -0.2187 Charge balance for all species = -.7614E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1591369E-04 0.1899946E+00 0.1800913E+03 0.0000 2 H2O 0.1000000E+01 0.5531837E+02 0.9371900E+06 0.0000 3 Cl- 0.8137363E+00 0.9077808E+00 0.3026570E+05 4.7072 4 SO4-- 0.1038041E-03 0.1108060E-03 0.1000991E+02 5.0662 5 HCO3- 0.1563391E-01 0.2055506E+00 0.1179473E+05 2.9958 6 HS- 0.3022223E-06 0.4905451E-05 0.1525654E+00 -1.7225 7 H4SiO4 0.1648684E-02 0.1650937E-02 0.1492246E+03 -2.7829 8 Al+++ 0.1746244E-11 0.9239479E-08 0.2344393E-03 1.0308 9 Ca++ 0.9716254E-03 0.1236626E-02 0.4660807E+02 6.0070 10 Mg++ 0.8307314E-04 0.1009005E-03 0.2306912E+01 4.9229 11 Fe++ 0.7846062E-06 0.9239563E-06 0.4852528E-01 2.9019 12 K+ 0.2647287E-01 0.2670130E-01 0.9818568E+03 3.2244 13 Na+ 0.8014429E+00 0.8950918E+00 0.1935172E+05 4.6985 14 Mn++ 0.1024245E-04 0.2025215E-04 0.1046311E+01 4.0205 15 Zn++ 0.6469325E-07 0.2057652E-05 0.1264932E+00 1.8181 16 Cu+ 0.4774157E-12 0.1075964E-07 0.6429272E-03 -7.5267 17 Pb++ 0.3028592E-08 0.9978033E-07 0.1944153E-01 0.5116 18 Ag+ 0.1353863E-11 0.1449206E-07 0.1470102E-02 -7.0682 19 Au+ 0.1699266E-22 0.1827404E-11 0.3384892E-06 -17.9673 20 Ba++ 0.1650674E-05 0.2387462E-05 0.3083545E+00 3.2553 21 F- 0.8375847E-03 0.9563056E-03 0.1708525E+02 1.7145 22 H2AsO3- 0.1010157E-06 0.7615161E-04 0.8947103E+01 -2.1415 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234456E+00 -.1043203E-04 0.0000000E+00 2 H2O 0.9417363E+02 0.9417363E+02 -.1518400E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886355E-03 0.3796000E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.8351007E-05 0.5679303E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810545E-02 0.1195775E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.1572923E-07 0.2391550E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1572937E-05 0.3036800E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.3502933E-05 0.3965243E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1831714E-07 0.1518400E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1698654E-06 0.1395155E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.2467118E-07 0.4024569E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628008E-02 0.2391550E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2541E-20 Mass of aqueous solution: 0.181027E+04 g Temperature = 130.16 C Pressure = 500.00 bar Mixer frac. = 0.7000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2012E-06 -6.696 0.4986E-04 -4.302 4.960 0.7002E-05 bornite 0.3037E-07 -7.518 0.1524E-04 -4.817 1.516 0.2998E-05 topaz 0.1196E-05 -5.922 0.2201E-03 -3.657 21.89 0.6161E-04 galena 0.1395E-05 -5.855 0.3338E-03 -3.477 33.20 0.4393E-04 sphalerite 0.3965E-05 -5.402 0.3863E-03 -3.413 38.43 0.9448E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 0.7000000 Solid products produced: Mass = 0.001005 g Volume = 0.000210 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.1525E+03 GOLD Q/K: 0.1232 SILVER Q/K: 0.1221 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 130.1570 deg.C Sat. pressure: 47.9474 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8975E-01 0.7726 0.3325E+01 0.4303E+01 CO2,gas 0.9102E+00 0.9067 0.3957E+02 0.4364E+02 CH4,gas 0.7962E-08 1.0457 0.3992E-06 0.3818E-06 H2,gas 0.3258E-06 1.0240 0.1600E-04 0.1562E-04 H2S,gas 0.5392E-05 0.8643 0.2234E-03 0.2585E-03 S2,gas 0.9443E-17 1.0000 0.4528E-15 0.4528E-15 CO,gas 0.2845E-08 1.0000 0.1364E-06 0.1364E-06 SO3,gas 0.3559E-29 1.0000 0.1706E-27 0.1706E-27 O2,gas 0.1035E-48 1.0000 0.4961E-47 0.4961E-47 SO2,gas 0.2101E-13 1.0000 0.1007E-11 0.1007E-11 HF,gas 0.8944E-08 1.0000 0.4288E-06 0.4288E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -25.90 -25.90 0.00 0.000 0.00000E+00 206 bornite -82.19 -82.19 0.00 0.000 0.00000E+00 226 topaz -17.38 -17.38 0.00 0.000 0.00000E+00 261 galena -11.25 -11.25 0.00 0.000 0.00000E+00 273 sphalerite -9.95 -9.95 0.00 0.000 -0.32782E-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 2.16 -0.01 -2.18 -2.177 0.40180E+04 0.522 2 CO2,gas -5.93 -7.03 -1.10 -0.367 0.20329E+04 1.597 3 CH4,gas 5.29 -3.81 -9.10 -2.274 0.16790E+05 -6.399 4 H2,gas 8.30 0.80 -7.49 -4.283 0.13832E+05 -4.796 5 H2S,gas -5.41 -11.76 -6.35 -3.175 0.11718E+05 -3.651 6 S2,gas -7.09 -25.13 -18.04 -2.776 0.33298E+05 -15.344 7 CO,gas 3.34 -6.22 -9.56 -2.943 0.17650E+05 -6.865 8 SO3,gas 15.46 -15.01 -30.47 -7.617 0.56226E+05 -27.768 9 O2,gas 48.38 -1.63 -50.00 -33.336 0.92280E+05 -47.304 10 SO2,gas 0.50 -14.19 -14.70 -3.919 0.27121E+05 -11.997 11 HF,gas 0.74 -8.33 -9.07 -4.533 0.16732E+05 -6.368 12 HCl,gas 2.49 -5.34 -7.83 -3.914 0.14445E+05 -7.827 17 albite-high 0.18 -2.57 -2.74 -0.211 0.50623E+04 18 albite -0.76 -2.57 -1.81 -0.139 0.33397E+04 22 analcite 2.67 0.18 -2.49 -0.277 0.46007E+04 23 andalusite 3.10 -0.73 -3.84 -0.384 0.70844E+04 26 anhydrite -5.52 -9.01 -3.49 -1.743 0.64340E+04 27 ankerite -2.50 -5.18 -2.68 -0.447 0.49450E+04 34 aragonite 0.73 -1.04 -1.77 -0.589 0.32634E+04 36 calcite 0.59 -1.04 -1.63 -0.543 0.30085E+04 37 carnegieite-low 7.88 2.95 -4.93 -0.704 0.90956E+04 50 chloritoid-Fe 6.89 2.14 -4.75 -0.317 0.87718E+04 53 coesite -2.16 -2.76 -0.60 -0.200 0.11096E+04 58 corundum 6.17 2.02 -4.14 -0.377 0.76476E+04 60 cristobalite -2.32 -2.76 -0.44 -0.146 0.80817E+03 65 diaspore 1.96 1.00 -0.96 -0.160 0.17691E+04 66 diamond -2.76 -5.41 -2.65 -0.757 0.48926E+04 69 dolomite,ordered -0.02 -3.16 -3.15 -0.525 0.58086E+04 83 gibbsite 3.15 0.99 -2.16 -0.309 0.39886E+04 86 goethite 5.77 2.48 -3.30 -0.713 0.60829E+04 87 graphite -3.17 -5.41 -2.24 -0.639 0.41263E+04 90 halite 1.58 -0.64 -2.21 -1.106 0.40821E+04 92 heulandite -6.39 -11.36 -4.97 -0.226 0.91716E+04 96 jadeite 3.47 0.19 -3.28 -0.328 0.60570E+04 99 kaolinite -2.41 -3.52 -1.10 -0.100 0.20356E+04 100 kyanite 2.98 -0.73 -3.72 -0.372 0.68574E+04 102 laumontite 1.63 -3.06 -4.70 -0.313 0.86681E+04 104 leucite 3.37 -1.28 -4.66 -0.466 0.85938E+04 107 magnesite 0.27 -2.12 -2.40 -0.799 0.44242E+04 117 microcline -2.61 -4.04 -1.44 -0.110 0.26488E+04 121 muscovite 0.62 -2.03 -2.65 -0.156 0.48996E+04 122 paragonite 2.09 -0.56 -2.65 -0.156 0.48847E+04 123 nepheline 7.22 2.95 -4.27 -0.610 0.78842E+04 143 pyrite -20.27 -21.43 -1.16 -0.273 0.21414E+04 144 pyrrhotite -4.37 -8.86 -4.49 -1.498 0.82942E+04 145 pyrrhotiteFe0.875 -5.97 -9.32 -3.35 -1.233 0.61879E+04 147 pyrophyllite -6.93 -9.02 -2.09 -0.130 0.38531E+04 148 quartz -2.72 -2.76 -0.04 -0.013 0.73025E+02 153 rhodochrosite -1.14 -3.03 -1.89 -0.629 0.34850E+04 155 sanidine -1.48 -4.04 -2.56 -0.197 0.47167E+04 157 siderite -2.77 -4.14 -1.37 -0.458 0.25353E+04 158 sillimanite 3.32 -0.73 -4.06 -0.406 0.74908E+04 165 stilbite -7.41 -11.37 -3.96 -0.189 0.73109E+04 171 sulfur -8.77 -12.56 -3.79 -1.167 0.70002E+04 172 sylvite 1.45 -2.11 -3.56 -1.780 0.65705E+04 180 topaz-H 2.93 -0.75 -3.68 -0.334 0.67862E+04 181 tridymite -2.37 -2.76 -0.39 -0.130 0.71992E+03 184 troilite-low -4.49 -8.86 -4.38 -1.459 0.80752E+04 196 akaganeite 6.92 2.48 -4.44 -0.960 0.81936E+04 198 arsenic -6.60 -10.94 -4.35 -1.122 0.80243E+04 201 beidellite-Ca -3.03 -6.78 -3.76 -0.233 0.69379E+04 202 beidellite-H -3.63 -7.78 -4.15 -0.265 0.76507E+04 203 beidellite-K -2.79 -6.71 -3.92 -0.240 0.72392E+04 204 beidellite-Mg -3.23 -6.96 -3.74 -0.231 0.68938E+04 205 beidellite-Na -2.65 -6.23 -3.57 -0.219 0.65959E+04 208 chalcedony -2.54 -2.76 -0.21 -0.071 0.39187E+03 209 chalcocite -25.62 -26.82 -1.20 -0.301 0.22184E+04 211 covellite -18.45 -19.69 -1.24 -0.472 0.22875E+04 212 dawsonite 1.18 -1.34 -2.52 -0.316 0.46589E+04 214 montmorillonite-Ca -3.16 -6.74 -3.58 -0.222 0.66079E+04 215 montmorillonite-K -3.00 -6.67 -3.66 -0.224 0.67622E+04 216 montmorillonite-Mg -3.37 -6.92 -3.56 -0.220 0.65607E+04 217 montmorillonite-Na -2.82 -6.18 -3.37 -0.206 0.62128E+04 230 gypsum -4.98 -9.04 -4.06 -1.015 0.74898E+04 246 acanthite -25.78 -25.90 -0.12 -0.031 0.22858E+03 252 barite -9.25 -11.76 -2.52 -1.258 0.46447E+04 253 boehmite 3.33 1.00 -2.32 -0.387 0.42888E+04 254 cerussite -2.69 -6.53 -3.84 -1.281 0.70933E+04 255 chalcopyrite -26.89 -28.55 -1.67 -0.310 0.30769E+04 257 copper,native -2.49 -7.13 -4.63 -1.612 0.85523E+04 258 dolomite,disordered 0.59 -3.16 -3.75 -0.625 0.69242E+04 260 fluorite -9.76 -10.65 -0.89 -0.296 0.16367E+04 262 gold,native -16.66 -17.57 -0.91 -0.316 0.16785E+04 263 silver,native -5.75 -6.67 -0.91 -0.318 0.16856E+04 270 silica-amorphous -1.88 -2.76 -0.87 -0.291 0.16133E+04 271 smithsonite -1.00 -5.23 -4.23 -1.410 0.78048E+04 274 wurtzite -8.25 -9.95 -1.70 -0.565 0.31294E+04 276 an20ab80 1.22 -1.55 -2.78 -0.214 0.51241E+04 277 an25ab75 1.75 -1.30 -3.05 -0.234 0.56208E+04 278 an30ab70 2.27 -1.05 -3.32 -0.255 0.61268E+04 Calculations done for 130.1570 Deg. C; 500.0000 bar Mixer fraction: 0.7000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 130.157 .10245E+01 2.503 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.9591E+02 New heat: 2.402 New temperature: 124.470 New mixer fraction: 0.8000000 Resulting temperature: 124.470Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 124.47 C Pressure = 500.00 bar Mixer fraction = 0.8000000 Water: Moles liquid = 0.1000E+03 kg liquid = 0.1802E+01 Moles total = 0.9972E+02 kg total = 0.1797E+01 Activity = 0.9717 Stoichiometric ionic strength = .9675060E+00 Osmotic coef. = 0.9306 True ionic strength = .7922521E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.16834E-04 -4.7738 0.10247E-04 -4.9894 0.60870E+00 -0.2156 2 H2O 0.97166E+00 -0.0125 0.97166E+00 -0.0125 3 Cl- 0.77539E+00 -0.1105 0.46785E+00 -0.3299 0.60338E+00 -0.2194 4 SO4-- 0.98412E-04 -4.0069 0.10747E-04 -4.9687 0.10920E+00 -0.9618 5 HCO3- 0.14771E-01 -1.8306 0.90015E-02 -2.0457 0.60939E+00 -0.2151 6 HS- 0.25477E-06 -6.5939 0.15386E-06 -6.8129 0.60394E+00 -0.2190 7 H4SiO4 0.15574E-02 -2.8076 0.15574E-02 -2.8076 0.10000E+01 0.0000 8 Al+++ 0.24870E-11 -11.6043 0.15641E-13 -13.8057 0.62892E-02 -2.2014 9 Ca++ 0.93485E-03 -3.0293 0.95591E-04 -4.0196 0.10225E+00 -0.9903 10 Mg++ 0.79327E-04 -4.1006 0.78522E-05 -5.1050 0.98985E-01 -1.0044 11 Fe++ 0.74792E-06 -6.1261 0.74588E-07 -7.1273 0.99728E-01 -1.0012 12 K+ 0.25033E-01 -1.6015 0.15240E-01 -1.8170 0.60880E+00 -0.2155 13 Na+ 0.76374E+00 -0.1171 0.45845E+00 -0.3387 0.60027E+00 -0.2217 14 Mn++ 0.10327E-04 -4.9860 0.10358E-05 -5.9847 0.10031E+00 -0.9987 15 Zn++ 0.69368E-07 -7.1588 0.69179E-08 -8.1600 0.99728E-01 -1.0012 16 Cu+ 0.34299E-12 -12.4647 0.20581E-12 -12.6865 0.60006E+00 -0.2218 17 Pb++ 0.26968E-08 -8.5691 0.28199E-09 -9.5498 0.10457E+00 -0.9806 18 Ag+ 0.95387E-12 -12.0205 0.57903E-12 -12.2373 0.60703E+00 -0.2168 19 Au+ 0.10862E-22 -22.9641 0.66236E-23 -23.1789 0.60982E+00 -0.2148 20 Ba++ 0.16219E-05 -5.7900 0.17221E-06 -6.7639 0.10618E+00 -0.9739 21 F- 0.79757E-03 -3.0982 0.47743E-03 -3.3211 0.59861E+00 -0.2229 22 H2AsO3- 0.77133E-07 -7.1128 0.52581E-07 -7.2792 0.68169E+00 -0.1664 24 HSiO3- 0.47093E-06 -6.3270 0.28415E-06 -6.5465 0.60338E+00 -0.2194 25 Ca(HSiO3)+ 0.13453E-08 -8.8712 0.82040E-09 -9.0860 0.60982E+00 -0.2148 26 Mg(HSiO3)+ 0.12368E-09 -9.9077 0.75425E-10 -10.1225 0.60982E+00 -0.2148 27 NaHSiO3,aq 0.14314E-05 -5.8442 0.14314E-05 -5.8442 0.10000E+01 0.0000 31 AgCl,aq 0.15909E-09 -9.7984 0.15909E-09 -9.7984 0.10000E+01 0.0000 32 AgCl2- 0.49030E-08 -8.3095 0.29584E-08 -8.5289 0.60338E+00 -0.2194 33 AgCl3-2 0.17137E-08 -8.7661 0.18429E-09 -9.7345 0.10754E+00 -0.9684 34 AgCl4-3 0.96520E-10 -10.0154 0.63409E-12 -12.1978 0.65696E-02 -2.1825 38 Ag(HS),aq 0.36816E-08 -8.4340 0.36816E-08 -8.4340 0.10000E+01 0.0000 40 AlO+ 0.14277E-09 -9.8454 0.87063E-10 -10.0602 0.60982E+00 -0.2148 41 AlOH+2 0.21073E-10 -10.6763 0.21285E-11 -11.6719 0.10101E+00 -0.9957 42 HAlO2,aq 0.36366E-08 -8.4393 0.36366E-08 -8.4393 0.10000E+01 0.0000 43 AlO2- 0.26670E-08 -8.5740 0.15965E-08 -8.7968 0.59863E+00 -0.2228 44 AsO2- 0.34420E-07 -7.4632 0.20769E-07 -7.6826 0.60338E+00 -0.2194 45 HAsO2,aq 0.26165E-04 -4.5823 0.26165E-04 -4.5823 0.10000E+01 0.0000 46 H3AsO3,aq 0.45650E-04 -4.3406 0.45650E-04 -4.3406 0.10000E+01 0.0000 62 BaCO3,aq 0.92939E-10 -10.0318 0.92939E-10 -10.0318 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.31300E-06 -6.5045 0.19243E-06 -6.7157 0.61479E+00 -0.2113 64 BaCl+ 0.31961E-06 -6.4954 0.19490E-06 -6.7102 0.60982E+00 -0.2148 65 BaF+ 0.44179E-09 -9.3548 0.26941E-09 -9.5696 0.60982E+00 -0.2148 66 CH4,aq 0.13843E-09 -9.8588 0.12524E-09 -9.9023 0.90468E+00 -0.0435 71 CO,aq 0.42684E-10 -10.3697 0.42684E-10 -10.3697 0.10000E+01 0.0000 72 CO2,aq 0.17932E+00 -0.7464 0.16223E+00 -0.7899 0.90468E+00 -0.0435 73 CO3-2 0.10849E-05 -5.9646 0.11667E-06 -6.9330 0.10754E+00 -0.9684 74 CaCO3,aq 0.21073E-06 -6.6763 0.21073E-06 -6.6763 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.50369E-04 -4.2978 0.30716E-04 -4.5126 0.60982E+00 -0.2148 76 CaCl+ 0.17085E-03 -3.7674 0.10419E-03 -3.9822 0.60982E+00 -0.2148 77 CaCl2,aq 0.97406E-05 -5.0114 0.97406E-05 -5.0114 0.10000E+01 0.0000 78 CaF+ 0.15860E-05 -5.7997 0.96714E-06 -6.0145 0.60982E+00 -0.2148 79 CaOH+ 0.43074E-08 -8.3658 0.26268E-08 -8.5806 0.60982E+00 -0.2148 80 CaSO4,aq 0.40742E-06 -6.3900 0.40742E-06 -6.3900 0.10000E+01 0.0000 81 HCl,aq 0.12964E-05 -5.8873 0.12964E-05 -5.8873 0.10000E+01 0.0000 90 CuCl,aq 0.48238E-09 -9.3166 0.48238E-09 -9.3166 0.10000E+01 0.0000 91 CuCl2- 0.60532E-08 -8.2180 0.36524E-08 -8.4374 0.60338E+00 -0.2194 92 CuCl3-2 0.77418E-09 -9.1112 0.83255E-10 -10.0796 0.10754E+00 -0.9684 98 HF,aq 0.44105E-04 -4.3555 0.44105E-04 -4.3555 0.10000E+01 0.0000 99 HF2- 0.10321E-07 -7.9863 0.62276E-08 -8.2057 0.60338E+00 -0.2194 101 FeCl+ 0.11929E-06 -6.9234 0.72746E-07 -7.1382 0.60982E+00 -0.2148 104 FeF+ 0.36814E-08 -8.4340 0.22450E-08 -8.6488 0.60982E+00 -0.2148 107 FeOH+ 0.12262E-08 -8.9114 0.74774E-09 -9.1262 0.60982E+00 -0.2148 113 H2,aq 0.77513E-08 -8.1106 0.70125E-08 -8.1541 0.90468E+00 -0.0435 114 KCl,aq 0.18124E-03 -3.7418 0.18124E-03 -3.7418 0.10000E+01 0.0000 115 KHSO4,aq 0.13425E-10 -10.8721 0.13425E-10 -10.8721 0.10000E+01 0.0000 116 KOH,aq 0.20298E-08 -8.6925 0.20298E-08 -8.6925 0.10000E+01 0.0000 117 KSO4- 0.55530E-05 -5.2555 0.33506E-05 -5.4749 0.60338E+00 -0.2194 118 MgCO3,aq 0.35546E-08 -8.4492 0.35546E-08 -8.4492 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.41858E-05 -5.3782 0.25526E-05 -5.5930 0.60982E+00 -0.2148 120 MgCl+ 0.11332E-04 -4.9457 0.69102E-05 -5.1605 0.60982E+00 -0.2148 121 MgF+ 0.45230E-06 -6.3446 0.27582E-06 -6.5594 0.60982E+00 -0.2148 122 MgOH+ 0.16524E-08 -8.7819 0.10076E-08 -8.9967 0.60982E+00 -0.2148 124 MnF+ 0.17585E-07 -7.7549 0.10724E-07 -7.9697 0.60982E+00 -0.2148 126 MnOH+ 0.17955E-08 -8.7458 0.10949E-08 -8.9606 0.60982E+00 -0.2148 131 MnCl+ 0.87782E-05 -5.0566 0.53531E-05 -5.2714 0.60982E+00 -0.2148 132 MnSO4,aq 0.44088E-08 -8.3557 0.44088E-08 -8.3557 0.10000E+01 0.0000 133 NaCl,aq 0.81633E-01 -1.0881 0.81633E-01 -1.0881 0.10000E+01 0.0000 134 NaF,aq 0.59486E-04 -4.2256 0.59486E-04 -4.2256 0.10000E+01 0.0000 135 NaOH,aq 0.56326E-07 -7.2493 0.56326E-07 -7.2493 0.10000E+01 0.0000 137 OH- 0.28327E-06 -6.5478 0.16957E-06 -6.7706 0.59863E+00 -0.2228 140 PbCl+ 0.17358E-07 -7.7605 0.10585E-07 -7.9753 0.60982E+00 -0.2148 141 PbCl2,aq 0.33925E-07 -7.4695 0.33925E-07 -7.4695 0.10000E+01 0.0000 142 PbCl3- 0.13305E-07 -7.8760 0.80281E-08 -8.0954 0.60338E+00 -0.2194 143 PbCl4-2 0.85870E-08 -8.0662 0.92344E-09 -9.0346 0.10754E+00 -0.9684 144 PbF+ 0.35778E-10 -10.4464 0.21818E-10 -10.6612 0.60982E+00 -0.2148 148 Pb(HS)2,aq 0.19428E-10 -10.7116 0.19428E-10 -10.7116 0.10000E+01 0.0000 150 H2S,aq 0.41562E-05 -5.3813 0.37601E-05 -5.4248 0.90468E+00 -0.0435 158 HSO3- 0.11968E-10 -10.9220 0.72215E-11 -11.1414 0.60338E+00 -0.2194 159 HSO4- 0.28304E-06 -6.5482 0.17432E-06 -6.7587 0.61588E+00 -0.2105 173 ZnCl+ 0.14002E-05 -5.8538 0.85387E-06 -6.0686 0.60982E+00 -0.2148 174 ZnCl2,aq 0.22853E-06 -6.6411 0.22853E-06 -6.6411 0.10000E+01 0.0000 175 ZnCl3- 0.23569E-07 -7.6277 0.14221E-07 -7.8471 0.60338E+00 -0.2194 176 ZnF+ 0.21629E-09 -9.6650 0.13190E-09 -9.8798 0.60982E+00 -0.2148 178 ZnOH+ 0.27233E-07 -7.5649 0.16607E-07 -7.7797 0.60982E+00 -0.2148 Charge balance for all species = -.7191E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1683409E-04 0.1794536E+00 0.1706640E+03 0.0000 2 H2O 0.1000000E+01 0.5532890E+02 0.9404781E+06 0.0000 3 Cl- 0.7753866E+00 0.8574155E+00 0.2868134E+05 4.6595 4 SO4-- 0.9841247E-04 0.1046582E-03 0.9485896E+01 5.0101 5 HCO3- 0.1477142E-01 0.1941463E+00 0.1117729E+05 2.9437 6 HS- 0.2547703E-06 0.4416824E-05 0.1378243E+00 -1.8235 7 H4SiO4 0.1557436E-02 0.1559339E-02 0.1414128E+03 -2.8076 8 Al+++ 0.2487028E-11 0.6469850E-08 0.1647083E-03 1.1625 9 Ca++ 0.9348464E-03 0.1168015E-02 0.4416820E+02 5.9592 10 Mg++ 0.7932731E-04 0.9530240E-04 0.2186148E+01 4.8738 11 Fe++ 0.7479153E-06 0.8721230E-06 0.4595499E-01 2.8515 12 K+ 0.2503307E-01 0.2521986E-01 0.9304580E+03 3.1724 13 Na+ 0.7637361E+00 0.8454305E+00 0.1833868E+05 4.6507 14 Mn++ 0.1032654E-04 0.1912852E-04 0.9915380E+00 3.9941 15 Zn++ 0.6936752E-07 0.1749119E-05 0.1078830E+00 1.8188 16 Cu+ 0.3429874E-12 0.7310124E-08 0.4382552E-03 -7.6971 17 Pb++ 0.2696828E-08 0.7592805E-07 0.1484315E-01 0.4290 18 Ag+ 0.9538716E-12 0.1055516E-07 0.1074287E-02 -7.2479 19 Au+ 0.1086155E-22 0.1726016E-11 0.3207698E-06 -18.1895 20 Ba++ 0.1621862E-05 0.2255002E-05 0.2922126E+00 3.2149 21 F- 0.7975743E-03 0.9032458E-03 0.1619082E+02 1.6683 22 H2AsO3- 0.7713347E-07 0.7192658E-04 0.8478735E+01 -2.2898 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234460E+00 -.1082929E-04 0.0000000E+00 2 H2O 0.9972445E+02 0.9972445E+02 -.1569814E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886353E-03 0.3924535E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7960855E-05 0.6069456E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810543E-02 0.1197809E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.1166121E-07 0.2395618E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1571909E-05 0.3139628E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.3152601E-05 0.4315575E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1317572E-07 0.1569814E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1368522E-06 0.1428168E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1902454E-07 0.4081036E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628004E-02 0.2395618E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2965E-20 Mass of aqueous solution: 0.191027E+04 g Temperature = 124.47 C Pressure = 500.00 bar Mixer frac. = 0.8000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2041E-06 -6.690 0.5056E-04 -4.296 4.821 0.7101E-05 bornite 0.3140E-07 -7.503 0.1575E-04 -4.803 1.502 0.3099E-05 topaz 0.1198E-05 -5.922 0.2204E-03 -3.657 21.02 0.6172E-04 galena 0.1428E-05 -5.845 0.3417E-03 -3.466 32.58 0.4497E-04 sphalerite 0.4316E-05 -5.365 0.4205E-03 -3.376 40.09 0.1028E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 0.8000000 Solid products produced: Mass = 0.001049 g Volume = 0.000220 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.9424E+02 GOLD Q/K: 0.1505 SILVER Q/K: 0.1107 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 124.4698 deg.C Sat. pressure: 43.9144 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.8145E-01 0.7874 0.2816E+01 0.3577E+01 CO2,gas 0.9185E+00 0.9091 0.3667E+02 0.4034E+02 CH4,gas 0.7212E-08 1.0405 0.3295E-06 0.3167E-06 H2,gas 0.2656E-06 1.0222 0.1192E-04 0.1166E-04 H2S,gas 0.5192E-05 0.8700 0.1983E-03 0.2280E-03 S2,gas 0.7027E-17 1.0000 0.3086E-15 0.3086E-15 CO,gas 0.2130E-08 1.0000 0.9353E-07 0.9353E-07 SO3,gas 0.1497E-29 1.0000 0.6573E-28 0.6573E-28 O2,gas 0.1828E-49 1.0000 0.8026E-48 0.8026E-48 SO2,gas 0.1438E-13 1.0000 0.6315E-12 0.6315E-12 HF,gas 0.7416E-08 1.0000 0.3256E-06 0.3256E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -26.30 -26.30 0.00 0.000 0.00000E+00 206 bornite -83.23 -83.23 0.00 0.000 0.00000E+00 226 topaz -17.10 -17.10 0.00 0.000 -0.64640E-11 261 galena -11.37 -11.37 0.00 0.000 -0.32320E-11 273 sphalerite -9.98 -9.98 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 2.24 -0.01 -2.25 -2.249 0.40924E+04 0.450 2 CO2,gas -5.89 -7.02 -1.13 -0.378 0.20644E+04 1.564 3 CH4,gas 5.28 -3.90 -9.18 -2.295 0.16704E+05 -6.482 4 H2,gas 8.40 0.77 -7.62 -4.356 0.13869E+05 -4.924 5 H2S,gas -5.40 -11.80 -6.40 -3.201 0.11647E+05 -3.703 6 S2,gas -6.94 -25.15 -18.21 -2.801 0.33131E+05 -15.511 7 CO,gas 3.49 -6.24 -9.73 -2.993 0.17700E+05 -7.029 8 SO3,gas 15.95 -14.94 -30.88 -7.720 0.56187E+05 -28.182 9 O2,gas 49.22 -1.57 -50.79 -33.863 0.92418E+05 -48.095 10 SO2,gas 0.75 -14.15 -14.90 -3.973 0.27107E+05 -12.200 11 HF,gas 0.88 -8.31 -9.19 -4.593 0.16714E+05 -6.487 12 HCl,gas 2.65 -5.32 -7.97 -3.987 0.14507E+05 -7.973 17 albite-high 0.35 -2.56 -2.91 -0.223 0.52863E+04 18 albite -0.61 -2.56 -1.95 -0.150 0.35407E+04 22 analcite 2.85 0.21 -2.64 -0.294 0.48081E+04 23 andalusite 3.53 -0.50 -4.03 -0.403 0.73268E+04 26 anhydrite -5.42 -8.99 -3.56 -1.782 0.64838E+04 27 ankerite -2.37 -5.26 -2.89 -0.482 0.52582E+04 34 aragonite 0.80 -1.08 -1.88 -0.627 0.34203E+04 36 calcite 0.67 -1.08 -1.74 -0.581 0.31692E+04 53 coesite -2.19 -2.78 -0.60 -0.199 0.10838E+04 58 corundum 6.64 2.29 -4.35 -0.395 0.79134E+04 60 cristobalite -2.35 -2.78 -0.44 -0.145 0.79332E+03 65 diaspore 2.16 1.14 -1.02 -0.170 0.18570E+04 66 diamond -2.82 -5.45 -2.63 -0.751 0.47810E+04 69 dolomite,ordered 0.15 -3.24 -3.39 -0.565 0.61634E+04 83 gibbsite 3.34 1.13 -2.22 -0.317 0.40370E+04 86 goethite 5.90 2.44 -3.46 -0.749 0.63040E+04 87 graphite -3.24 -5.45 -2.21 -0.631 0.40200E+04 90 halite 1.59 -0.67 -2.26 -1.128 0.41060E+04 96 jadeite 3.65 0.22 -3.43 -0.343 0.62385E+04 99 kaolinite -2.14 -3.30 -1.17 -0.106 0.21206E+04 100 kyanite 3.40 -0.50 -3.90 -0.390 0.70869E+04 102 laumontite 1.98 -2.95 -4.93 -0.329 0.89694E+04 104 leucite 3.57 -1.26 -4.83 -0.483 0.87863E+04 107 magnesite 0.38 -2.16 -2.54 -0.847 0.46214E+04 117 microcline -2.51 -4.04 -1.53 -0.118 0.27839E+04 121 muscovite 1.11 -1.76 -2.87 -0.169 0.52279E+04 122 paragonite 2.61 -0.28 -2.90 -0.170 0.52676E+04 123 nepheline 7.47 3.01 -4.47 -0.638 0.81296E+04 143 pyrite -20.40 -21.53 -1.13 -0.265 0.20495E+04 144 pyrrhotite -4.32 -8.95 -4.63 -1.543 0.84244E+04 145 pyrrhotiteFe0.875 -5.95 -9.40 -3.45 -1.269 0.62788E+04 147 pyrophyllite -6.69 -8.86 -2.17 -0.136 0.39446E+04 148 quartz -2.76 -2.78 -0.03 -0.009 0.49191E+02 153 rhodochrosite -1.08 -3.04 -1.96 -0.654 0.35686E+04 155 sanidine -1.37 -4.04 -2.67 -0.205 0.48516E+04 157 siderite -2.71 -4.18 -1.48 -0.492 0.26844E+04 158 sillimanite 3.76 -0.50 -4.25 -0.425 0.77370E+04 165 stilbite -7.27 -11.33 -4.06 -0.193 0.73839E+04 171 sulfur -8.82 -12.58 -3.76 -1.157 0.68409E+04 172 sylvite 1.44 -2.15 -3.59 -1.796 0.65344E+04 180 topaz-H 3.30 -0.51 -3.81 -0.346 0.69287E+04 181 tridymite -2.40 -2.78 -0.39 -0.129 0.70192E+03 184 troilite-low -4.45 -8.95 -4.51 -1.502 0.81978E+04 196 akaganeite 7.08 2.44 -4.64 -1.004 0.84497E+04 198 arsenic -6.71 -11.07 -4.36 -1.125 0.79341E+04 201 beidellite-Ca -2.66 -6.58 -3.92 -0.243 0.71337E+04 202 beidellite-H -3.28 -7.56 -4.28 -0.273 0.77938E+04 203 beidellite-K -2.44 -6.51 -4.07 -0.249 0.74072E+04 204 beidellite-Mg -2.86 -6.76 -3.90 -0.241 0.70982E+04 205 beidellite-Na -2.30 -6.03 -3.73 -0.228 0.67827E+04 208 chalcedony -2.58 -2.78 -0.20 -0.067 0.36802E+03 209 chalcocite -25.99 -27.20 -1.21 -0.302 0.21998E+04 211 covellite -18.69 -19.89 -1.20 -0.456 0.21801E+04 212 dawsonite 1.32 -1.25 -2.56 -0.321 0.46661E+04 214 montmorillonite-Ca -2.90 -6.65 -3.75 -0.232 0.68190E+04 215 montmorillonite-K -2.76 -6.58 -3.82 -0.234 0.69508E+04 216 montmorillonite-Mg -3.10 -6.83 -3.73 -0.231 0.67798E+04 217 montmorillonite-Na -2.57 -6.10 -3.53 -0.216 0.64152E+04 230 gypsum -4.92 -9.01 -4.09 -1.023 0.74444E+04 246 acanthite -26.18 -26.30 -0.12 -0.029 0.21359E+03 252 barite -9.23 -11.73 -2.51 -1.254 0.45624E+04 253 boehmite 3.56 1.14 -2.42 -0.403 0.43987E+04 254 cerussite -2.69 -6.61 -3.92 -1.306 0.71292E+04 255 chalcopyrite -27.13 -28.84 -1.70 -0.317 0.30985E+04 257 copper,native -2.58 -7.31 -4.73 -1.644 0.86020E+04 258 dolomite,disordered 0.77 -3.24 -4.01 -0.668 0.72944E+04 260 fluorite -9.73 -10.66 -0.93 -0.311 0.16950E+04 262 gold,native -16.98 -17.80 -0.82 -0.286 0.14965E+04 263 silver,native -5.91 -6.86 -0.96 -0.333 0.17393E+04 270 silica-amorphous -1.90 -2.78 -0.88 -0.293 0.16005E+04 271 smithsonite -0.92 -5.22 -4.30 -1.432 0.78176E+04 274 wurtzite -8.26 -9.98 -1.72 -0.573 0.31300E+04 276 an20ab80 1.45 -1.51 -2.97 -0.228 0.53969E+04 277 an25ab75 2.00 -1.25 -3.25 -0.250 0.59110E+04 278 an30ab70 2.55 -0.99 -3.54 -0.272 0.64342E+04 Calculations done for 124.4698 Deg. C; 500.0000 bar Mixer fraction: 0.8000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 124.470 .96751E+00 2.402 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1015E+03 New heat: 2.311 New temperature: 119.361 New mixer fraction: 0.9000000 Resulting temperature: 119.361Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 119.36 C Pressure = 500.00 bar Mixer fraction = 0.9000000 Water: Moles liquid = 0.1056E+03 kg liquid = 0.1902E+01 Moles total = 0.1053E+03 kg total = 0.1897E+01 Activity = 0.9731 Stoichiometric ionic strength = .9164921E+00 Osmotic coef. = 0.9307 True ionic strength = .7560306E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.17657E-04 -4.7531 0.10906E-04 -4.9623 0.61763E+00 -0.2093 2 H2O 0.97312E+00 -0.0118 0.97312E+00 -0.0118 3 Cl- 0.74003E+00 -0.1308 0.45179E+00 -0.3451 0.61051E+00 -0.2143 4 SO4-- 0.93538E-04 -4.0290 0.10885E-04 -4.9632 0.11637E+00 -0.9342 5 HCO3- 0.13999E-01 -1.8539 0.86191E-02 -2.0645 0.61569E+00 -0.2106 6 HS- 0.21787E-06 -6.6618 0.13311E-06 -6.8758 0.61097E+00 -0.2140 7 H4SiO4 0.14757E-02 -2.8310 0.14757E-02 -2.8310 0.10000E+01 0.0000 8 Al+++ 0.34159E-11 -11.4665 0.24968E-13 -13.6026 0.73093E-02 -2.1361 9 Ca++ 0.89986E-03 -3.0458 0.98429E-04 -4.0069 0.10938E+00 -0.9611 10 Mg++ 0.75888E-04 -4.1198 0.80649E-05 -5.0934 0.10627E+00 -0.9736 11 Fe++ 0.71442E-06 -6.1460 0.76423E-07 -7.1168 0.10697E+00 -0.9707 12 K+ 0.23739E-01 -1.6245 0.14595E-01 -1.8358 0.61480E+00 -0.2113 13 Na+ 0.72896E+00 -0.1373 0.44263E+00 -0.3540 0.60721E+00 -0.2167 14 Mn++ 0.10346E-04 -4.9852 0.11124E-05 -5.9538 0.10752E+00 -0.9685 15 Zn++ 0.73390E-07 -7.1344 0.78507E-08 -8.1051 0.10697E+00 -0.9707 16 Cu+ 0.25201E-12 -12.5986 0.15298E-12 -12.8154 0.60702E+00 -0.2168 17 Pb++ 0.24066E-08 -8.6186 0.26864E-09 -9.5708 0.11162E+00 -0.9522 18 Ag+ 0.68885E-12 -12.1619 0.42241E-12 -12.3743 0.61320E+00 -0.2124 19 Au+ 0.71638E-23 -23.1449 0.44110E-23 -23.3555 0.61573E+00 -0.2106 20 Ba++ 0.15879E-05 -5.7992 0.17975E-06 -6.7453 0.11321E+00 -0.9461 21 F- 0.76095E-03 -3.1186 0.46238E-03 -3.3350 0.60764E+00 -0.2164 22 H2AsO3- 0.60269E-07 -7.2199 0.41213E-07 -7.3850 0.68382E+00 -0.1651 24 HSiO3- 0.39676E-06 -6.4015 0.24222E-06 -6.6158 0.61051E+00 -0.2143 25 Ca(HSiO3)+ 0.10729E-08 -8.9694 0.66061E-09 -9.1801 0.61573E+00 -0.2106 26 Mg(HSiO3)+ 0.10042E-09 -9.9982 0.61833E-10 -10.2088 0.61573E+00 -0.2106 27 NaHSiO3,aq 0.12321E-05 -5.9093 0.12321E-05 -5.9093 0.10000E+01 0.0000 31 AgCl,aq 0.11438E-09 -9.9417 0.11438E-09 -9.9417 0.10000E+01 0.0000 32 AgCl2- 0.33909E-08 -8.4697 0.20702E-08 -8.6840 0.61051E+00 -0.2143 33 AgCl3-2 0.11202E-08 -8.9507 0.12855E-09 -9.8909 0.11475E+00 -0.9402 34 AgCl4-3 0.57838E-10 -10.2378 0.44286E-12 -12.3537 0.76570E-02 -2.1159 38 Ag(HS),aq 0.33511E-08 -8.4748 0.33511E-08 -8.4748 0.10000E+01 0.0000 40 AlO+ 0.13662E-09 -9.8645 0.84120E-10 -10.0751 0.61573E+00 -0.2106 41 AlOH+2 0.23544E-10 -10.6281 0.25472E-11 -11.5939 0.10819E+00 -0.9658 42 HAlO2,aq 0.28783E-08 -8.5409 0.28783E-08 -8.5409 0.10000E+01 0.0000 43 AlO2- 0.17129E-08 -8.7663 0.10403E-08 -8.9829 0.60732E+00 -0.2166 44 AsO2- 0.29138E-07 -7.5355 0.17789E-07 -7.7498 0.61051E+00 -0.2143 45 HAsO2,aq 0.25399E-04 -4.5952 0.25399E-04 -4.5952 0.10000E+01 0.0000 46 H3AsO3,aq 0.42658E-04 -4.3700 0.42658E-04 -4.3700 0.10000E+01 0.0000 62 BaCO3,aq 0.78659E-10 -10.1043 0.78659E-10 -10.1043 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.26475E-06 -6.5772 0.16422E-06 -6.7846 0.62030E+00 -0.2074 64 BaCl+ 0.28338E-06 -6.5476 0.17448E-06 -6.7582 0.61573E+00 -0.2106 65 BaF+ 0.39991E-09 -9.3980 0.24624E-09 -9.6086 0.61573E+00 -0.2106 66 CH4,aq 0.11348E-09 -9.9451 0.10281E-09 -9.9880 0.90602E+00 -0.0429 71 CO,aq 0.29121E-10 -10.5358 0.29121E-10 -10.5358 0.10000E+01 0.0000 72 CO2,aq 0.16989E+00 -0.7698 0.15393E+00 -0.8127 0.90602E+00 -0.0429 73 CO3-2 0.93776E-06 -6.0279 0.10761E-06 -6.9681 0.11475E+00 -0.9402 74 CaCO3,aq 0.17662E-06 -6.7530 0.17662E-06 -6.7530 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.44700E-04 -4.3497 0.27523E-04 -4.5603 0.61573E+00 -0.2106 76 CaCl+ 0.15169E-03 -3.8190 0.93402E-04 -4.0296 0.61573E+00 -0.2106 77 CaCl2,aq 0.83852E-05 -5.0765 0.83852E-05 -5.0765 0.10000E+01 0.0000 78 CaF+ 0.14086E-05 -5.8512 0.86730E-06 -6.0618 0.61573E+00 -0.2106 79 CaOH+ 0.30868E-08 -8.5105 0.19006E-08 -8.7211 0.61573E+00 -0.2106 80 CaSO4,aq 0.39216E-06 -6.4065 0.39216E-06 -6.4065 0.10000E+01 0.0000 81 HCl,aq 0.12778E-05 -5.8935 0.12778E-05 -5.8935 0.10000E+01 0.0000 90 CuCl,aq 0.35302E-09 -9.4522 0.35302E-09 -9.4522 0.10000E+01 0.0000 91 CuCl2- 0.42351E-08 -8.3731 0.25855E-08 -8.5874 0.61051E+00 -0.2143 92 CuCl3-2 0.51583E-09 -9.2875 0.59193E-10 -10.2277 0.11475E+00 -0.9402 98 HF,aq 0.40667E-04 -4.3908 0.40667E-04 -4.3908 0.10000E+01 0.0000 99 HF2- 0.90863E-08 -8.0416 0.55473E-08 -8.2559 0.61051E+00 -0.2143 101 FeCl+ 0.10717E-06 -6.9699 0.65987E-07 -7.1805 0.61573E+00 -0.2106 104 FeF+ 0.33615E-08 -8.4735 0.20698E-08 -8.6841 0.61573E+00 -0.2106 107 FeOH+ 0.95914E-09 -9.0181 0.59057E-09 -9.2287 0.61573E+00 -0.2106 113 H2,aq 0.57325E-08 -8.2417 0.51937E-08 -8.2845 0.90602E+00 -0.0429 114 KCl,aq 0.15040E-03 -3.8227 0.15040E-03 -3.8227 0.10000E+01 0.0000 115 KHSO4,aq 0.10163E-10 -10.9930 0.10163E-10 -10.9930 0.10000E+01 0.0000 116 KOH,aq 0.15089E-08 -8.8213 0.15089E-08 -8.8213 0.10000E+01 0.0000 117 KSO4- 0.49677E-05 -5.3038 0.30328E-05 -5.5182 0.61051E+00 -0.2143 118 MgCO3,aq 0.30729E-08 -8.5124 0.30729E-08 -8.5124 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.37084E-05 -5.4308 0.22833E-05 -5.6414 0.61573E+00 -0.2106 120 MgCl+ 0.10287E-04 -4.9877 0.63338E-05 -5.1983 0.61573E+00 -0.2106 121 MgF+ 0.40575E-06 -6.3917 0.24983E-06 -6.6024 0.61573E+00 -0.2106 122 MgOH+ 0.12176E-08 -8.9145 0.74969E-09 -9.1251 0.61573E+00 -0.2106 124 MnF+ 0.16648E-07 -7.7786 0.10251E-07 -7.9892 0.61573E+00 -0.2106 126 MnOH+ 0.14389E-08 -8.8420 0.88598E-09 -9.0526 0.61573E+00 -0.2106 131 MnCl+ 0.77550E-05 -5.1104 0.47749E-05 -5.3210 0.61573E+00 -0.2106 132 MnSO4,aq 0.43659E-08 -8.3599 0.43659E-08 -8.3599 0.10000E+01 0.0000 133 NaCl,aq 0.71978E-01 -1.1428 0.71978E-01 -1.1428 0.10000E+01 0.0000 134 NaF,aq 0.52294E-04 -4.2815 0.52294E-04 -4.2815 0.10000E+01 0.0000 135 NaOH,aq 0.43135E-07 -7.3652 0.43135E-07 -7.3652 0.10000E+01 0.0000 137 OH- 0.22604E-06 -6.6458 0.13728E-06 -6.8624 0.60732E+00 -0.2166 140 PbCl+ 0.14601E-07 -7.8356 0.89902E-08 -8.0462 0.61573E+00 -0.2106 141 PbCl2,aq 0.26452E-07 -7.5775 0.26452E-07 -7.5775 0.10000E+01 0.0000 142 PbCl3- 0.96847E-08 -8.0139 0.59126E-08 -8.2282 0.61051E+00 -0.2143 143 PbCl4-2 0.58133E-08 -8.2356 0.66710E-09 -9.1758 0.11475E+00 -0.9402 144 PbF+ 0.31081E-10 -10.5075 0.19137E-10 -10.7181 0.61573E+00 -0.2106 148 Pb(HS)2,aq 0.15554E-10 -10.8082 0.15554E-10 -10.8082 0.10000E+01 0.0000 150 H2S,aq 0.37887E-05 -5.4215 0.34327E-05 -5.4644 0.90602E+00 -0.0429 159 HSO4- 0.25573E-06 -6.5922 0.15895E-06 -6.7987 0.62155E+00 -0.2065 173 ZnCl+ 0.11968E-05 -5.9220 0.73687E-06 -6.1326 0.61573E+00 -0.2106 174 ZnCl2,aq 0.18843E-06 -6.7248 0.18843E-06 -6.7248 0.10000E+01 0.0000 175 ZnCl3- 0.18950E-07 -7.7224 0.11569E-07 -7.9367 0.61051E+00 -0.2143 176 ZnF+ 0.21738E-09 -9.6628 0.13385E-09 -9.8734 0.61573E+00 -0.2106 178 ZnOH+ 0.21666E-07 -7.6642 0.13340E-07 -7.8748 0.61573E+00 -0.2106 Charge balance for all species = -.6813E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1765726E-04 0.1700207E+00 0.1621746E+03 0.0000 2 H2O 0.1000000E+01 0.5533833E+02 0.9434390E+06 0.0000 3 Cl- 0.7400265E+00 0.8123451E+00 0.2725460E+05 4.6173 4 SO4-- 0.9353841E-04 0.9915680E-04 0.9014021E+01 4.9615 5 HCO3- 0.1399905E-01 0.1839409E+00 0.1062128E+05 2.8978 6 HS- 0.2178691E-06 0.4011560E-05 0.1255510E+00 -1.9134 7 H4SiO4 0.1475741E-02 0.1477371E-02 0.1343782E+03 -2.8310 8 Al+++ 0.3415878E-11 0.4754796E-08 0.1214071E-03 1.2844 9 Ca++ 0.8998584E-03 0.1106618E-02 0.4197108E+02 5.9178 10 Mg++ 0.7588758E-04 0.9029279E-04 0.2077399E+01 4.8313 11 Fe++ 0.7144215E-06 0.8259152E-06 0.4364973E-01 2.8079 12 K+ 0.2373880E-01 0.2389417E-01 0.8841729E+03 3.1265 13 Na+ 0.7289583E+00 0.8009901E+00 0.1742644E+05 4.6084 14 Mn++ 0.1034561E-04 0.1812302E-04 0.9422145E+00 3.9709 15 Zn++ 0.7338951E-07 0.1499411E-05 0.9275674E-01 1.8196 16 Cu+ 0.2520111E-12 0.5104165E-08 0.3069150E-03 -7.8530 17 Pb++ 0.2406632E-08 0.5900452E-07 0.1156912E-01 0.3539 18 Ag+ 0.6888545E-12 0.8035374E-08 0.8202628E-03 -7.4119 19 Au+ 0.7163845E-23 0.1635288E-11 0.3048133E-06 -18.3931 20 Ba++ 0.1587860E-05 0.2136467E-05 0.2776767E+00 3.1794 21 F- 0.7609499E-03 0.8557650E-03 0.1538540E+02 1.6273 22 H2AsO3- 0.6026946E-07 0.6814573E-04 0.8056965E+01 -2.4226 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234463E+00 -.1116312E-04 0.0000000E+00 2 H2O 0.1052753E+03 0.1052753E+03 -.1604470E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886353E-03 0.4011175E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7631566E-05 0.6398744E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810542E-02 0.1199117E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.9045493E-08 0.2398233E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1571216E-05 0.3208940E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2852470E-05 0.4615706E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.9710130E-08 0.1604470E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1122498E-06 0.1452771E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1528644E-07 0.4118417E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628002E-02 0.2398233E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.201027E+04 g Temperature = 119.36 C Pressure = 500.00 bar Mixer frac. = 0.9000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2059E-06 -6.686 0.5103E-04 -4.292 4.703 0.7166E-05 bornite 0.3209E-07 -7.494 0.1610E-04 -4.793 1.484 0.3168E-05 topaz 0.1199E-05 -5.921 0.2207E-03 -3.656 20.34 0.6178E-04 galena 0.1453E-05 -5.838 0.3476E-03 -3.459 32.03 0.4575E-04 sphalerite 0.4616E-05 -5.336 0.4497E-03 -3.347 41.44 0.1100E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 0.9000000 Solid products produced: Mass = 0.001085 g Volume = 0.000228 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.4203E+02 GOLD Q/K: 0.1807 SILVER Q/K: 0.1013 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 119.3607 deg.C Sat. pressure: 40.4322 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.7467E-01 0.8008 0.2418E+01 0.3019E+01 CO2,gas 0.9253E+00 0.9115 0.3410E+02 0.3741E+02 CH4,gas 0.6614E-08 1.0362 0.2771E-06 0.2674E-06 H2,gas 0.2210E-06 1.0207 0.9121E-05 0.8936E-05 H2S,gas 0.5017E-05 0.8753 0.1775E-03 0.2028E-03 S2,gas 0.5347E-17 1.0000 0.2162E-15 0.2162E-15 CO,gas 0.1635E-08 1.0000 0.6612E-07 0.6612E-07 SO3,gas 0.6747E-30 1.0000 0.2728E-28 0.2728E-28 O2,gas 0.3740E-50 1.0000 0.1512E-48 0.1512E-48 SO2,gas 0.1014E-13 1.0000 0.4101E-12 0.4101E-12 HF,gas 0.6234E-08 1.0000 0.2521E-06 0.2521E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -26.66 -26.66 0.00 0.000 0.00000E+00 206 bornite -84.19 -84.19 0.00 0.000 -0.25524E-10 226 topaz -16.86 -16.86 0.00 0.000 0.63809E-11 261 galena -11.48 -11.48 0.00 0.000 0.00000E+00 273 sphalerite -10.02 -10.02 0.00 0.000 -0.63809E-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 2.30 -0.01 -2.32 -2.316 0.41590E+04 0.383 2 CO2,gas -5.85 -7.02 -1.17 -0.389 0.20945E+04 1.533 3 CH4,gas 5.27 -3.99 -9.26 -2.314 0.16625E+05 -6.557 4 H2,gas 8.49 0.75 -7.74 -4.422 0.13900E+05 -5.040 5 H2S,gas -5.39 -11.84 -6.45 -3.225 0.11584E+05 -3.751 6 S2,gas -6.81 -25.18 -18.36 -2.825 0.32983E+05 -15.665 7 CO,gas 3.63 -6.25 -9.88 -3.040 0.17743E+05 -7.180 8 SO3,gas 16.39 -14.88 -31.26 -7.816 0.56151E+05 -28.564 9 O2,gas 49.99 -1.52 -51.52 -34.346 0.92532E+05 -48.820 10 SO2,gas 0.97 -14.11 -15.09 -4.023 0.27096E+05 -12.387 11 HF,gas 1.00 -8.30 -9.30 -4.649 0.16699E+05 -6.598 12 HCl,gas 2.80 -5.31 -8.11 -4.054 0.14564E+05 -8.109 17 albite-high 0.50 -2.55 -3.05 -0.235 0.54841E+04 18 albite -0.48 -2.55 -2.07 -0.159 0.37189E+04 22 analcite 3.02 0.24 -2.78 -0.309 0.49899E+04 23 andalusite 3.92 -0.27 -4.20 -0.420 0.75356E+04 26 anhydrite -5.34 -8.97 -3.63 -1.817 0.65282E+04 27 ankerite -2.25 -5.33 -3.08 -0.513 0.55312E+04 34 aragonite 0.87 -1.11 -1.98 -0.660 0.35575E+04 36 calcite 0.73 -1.11 -1.84 -0.614 0.33095E+04 53 coesite -2.22 -2.81 -0.59 -0.197 0.10627E+04 58 corundum 7.07 2.53 -4.53 -0.412 0.81416E+04 60 cristobalite -2.37 -2.81 -0.44 -0.145 0.78182E+03 65 diaspore 2.34 1.26 -1.08 -0.179 0.19313E+04 66 diamond -2.88 -5.49 -2.61 -0.745 0.46809E+04 69 dolomite,ordered 0.30 -3.30 -3.60 -0.601 0.64738E+04 83 gibbsite 3.52 1.25 -2.27 -0.324 0.40765E+04 86 goethite 6.03 2.41 -3.62 -0.782 0.64958E+04 87 graphite -3.30 -5.49 -2.19 -0.624 0.39249E+04 90 halite 1.60 -0.70 -2.30 -1.149 0.41274E+04 96 jadeite 3.82 0.25 -3.56 -0.356 0.63969E+04 99 kaolinite -1.88 -3.10 -1.22 -0.111 0.21927E+04 100 kyanite 3.78 -0.27 -4.06 -0.406 0.72846E+04 104 leucite 3.76 -1.23 -4.98 -0.498 0.89533E+04 107 magnesite 0.47 -2.20 -2.67 -0.890 0.47939E+04 117 microcline -2.42 -4.03 -1.62 -0.124 0.29022E+04 121 muscovite 1.55 -1.51 -3.07 -0.180 0.55106E+04 122 paragonite 3.09 -0.03 -3.12 -0.183 0.55997E+04 123 nepheline 7.71 3.06 -4.65 -0.664 0.83430E+04 143 pyrite -20.52 -21.62 -1.09 -0.257 0.19649E+04 144 pyrrhotite -4.28 -9.03 -4.75 -1.584 0.85348E+04 145 pyrrhotiteFe0.875 -5.94 -9.47 -3.54 -1.301 0.63555E+04 147 pyrophyllite -6.47 -8.71 -2.24 -0.140 0.40251E+04 148 quartz -2.79 -2.81 -0.02 -0.006 0.29777E+02 153 rhodochrosite -1.03 -3.06 -2.03 -0.676 0.36426E+04 155 sanidine -1.27 -4.03 -2.77 -0.213 0.49692E+04 157 siderite -2.65 -4.22 -1.57 -0.522 0.28140E+04 158 sillimanite 4.15 -0.27 -4.43 -0.443 0.79494E+04 165 stilbite -7.15 -11.29 -4.15 -0.198 0.74494E+04 171 sulfur -8.86 -12.59 -3.73 -1.148 0.66997E+04 172 sylvite 1.44 -2.18 -3.62 -1.810 0.65017E+04 180 topaz-H 3.64 -0.29 -3.92 -0.357 0.70495E+04 181 tridymite -2.42 -2.81 -0.38 -0.128 0.68738E+03 184 troilite-low -4.41 -9.03 -4.62 -1.541 0.83018E+04 196 akaganeite 7.24 2.41 -4.83 -1.044 0.86724E+04 198 arsenic -6.81 -11.19 -4.37 -1.128 0.78524E+04 201 beidellite-Ca -2.32 -6.39 -4.07 -0.252 0.73045E+04 202 beidellite-H -2.96 -7.37 -4.41 -0.281 0.79180E+04 203 beidellite-K -2.13 -6.33 -4.20 -0.257 0.75524E+04 204 beidellite-Mg -2.52 -6.57 -4.05 -0.251 0.72763E+04 205 beidellite-Na -1.98 -5.84 -3.87 -0.237 0.69453E+04 208 chalcedony -2.61 -2.81 -0.19 -0.065 0.34864E+03 209 chalcocite -26.33 -27.54 -1.22 -0.304 0.21868E+04 211 covellite -18.91 -20.07 -1.16 -0.442 0.20856E+04 212 dawsonite 1.44 -1.16 -2.60 -0.325 0.46702E+04 214 montmorillonite-Ca -2.66 -6.56 -3.90 -0.241 0.70049E+04 215 montmorillonite-K -2.54 -6.51 -3.96 -0.243 0.71162E+04 216 montmorillonite-Mg -2.86 -6.74 -3.88 -0.240 0.69725E+04 217 montmorillonite-Na -2.35 -6.02 -3.67 -0.225 0.65937E+04 230 gypsum -4.87 -8.99 -4.12 -1.031 0.74037E+04 246 acanthite -26.55 -26.66 -0.11 -0.028 0.20034E+03 252 barite -9.21 -11.71 -2.50 -1.250 0.44907E+04 253 boehmite 3.76 1.26 -2.50 -0.417 0.44923E+04 254 cerussite -2.69 -6.67 -3.99 -1.329 0.71616E+04 255 chalcopyrite -27.36 -29.10 -1.73 -0.323 0.31146E+04 257 copper,native -2.66 -7.48 -4.81 -1.674 0.86453E+04 258 dolomite,disordered 0.94 -3.30 -4.24 -0.707 0.76184E+04 260 fluorite -9.70 -10.68 -0.97 -0.324 0.17478E+04 262 gold,native -17.27 -18.02 -0.74 -0.258 0.13347E+04 263 silver,native -6.04 -7.04 -0.99 -0.346 0.17861E+04 270 silica-amorphous -1.92 -2.81 -0.89 -0.295 0.15901E+04 271 smithsonite -0.85 -5.21 -4.36 -1.453 0.78298E+04 274 wurtzite -8.28 -10.02 -1.74 -0.581 0.31305E+04 276 an20ab80 1.66 -1.48 -3.14 -0.241 0.56368E+04 277 an25ab75 2.22 -1.21 -3.43 -0.264 0.61658E+04 278 an30ab70 2.79 -0.94 -3.73 -0.287 0.67043E+04 Calculations done for 119.3607 Deg. C; 500.0000 bar Mixer fraction: 0.9000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 119.361 .91649E+00 2.311 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1070E+03 New heat: 2.229 New temperature: 114.750 New mixer fraction: 1.0000000 Resulting temperature: 114.750Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705884E+00 Osmotic coef. = 0.9306 True ionic strength = .7228320E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18376E-04 -4.7358 0.11496E-04 -4.9395 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70761E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13303E-01 -1.8760 0.82635E-02 -2.0828 0.62116E+00 -0.2068 6 HS- 0.18857E-06 -6.7245 0.11636E-06 -6.9342 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45626E-11 -11.3408 0.38111E-13 -13.4189 0.83531E-02 -2.0782 9 Ca++ 0.86681E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72724E-04 -4.1383 0.82292E-05 -5.0846 0.11316E+00 -0.9463 11 Fe++ 0.68375E-06 -6.1651 0.77818E-07 -7.1089 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.76923E-07 -7.1139 0.87546E-08 -8.0578 0.11381E+00 -0.9438 16 Cu+ 0.18866E-12 -12.7243 0.11566E-12 -12.9368 0.61306E+00 -0.2125 17 Pb++ 0.21513E-08 -8.6673 0.25446E-09 -9.5944 0.11828E+00 -0.9271 18 Ag+ 0.50751E-12 -12.2946 0.31393E-12 -12.5032 0.61856E+00 -0.2086 19 Au+ 0.48474E-23 -23.3145 0.30096E-23 -23.5215 0.62086E+00 -0.2070 20 Ba++ 0.15512E-05 -5.8093 0.18587E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72756E-03 -3.1381 0.44774E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48118E-07 -7.3177 0.32992E-07 -7.4816 0.68565E+00 -0.1639 24 HSiO3- 0.33881E-06 -6.4700 0.20894E-06 -6.6800 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.86975E-09 -9.0606 0.54000E-09 -9.2676 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82781E-10 -10.0821 0.51396E-10 -10.2891 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10722E-05 -5.9697 0.10722E-05 -5.9697 0.10000E+01 0.0000 31 AgCl,aq 0.83853E-10 -10.0765 0.83853E-10 -10.0765 0.10000E+01 0.0000 32 AgCl2- 0.23995E-08 -8.6199 0.14797E-08 -8.8298 0.61667E+00 -0.2099 33 AgCl3-2 0.75357E-09 -9.1229 0.91594E-10 -10.0381 0.12155E+00 -0.9153 34 AgCl4-3 0.36026E-10 -10.4434 0.31593E-12 -12.5004 0.87695E-02 -2.0570 38 Ag(HS),aq 0.30630E-08 -8.5139 0.30630E-08 -8.5139 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81313E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26056E-10 -10.5841 0.29954E-11 -11.5235 0.11496E+00 -0.9395 42 HAlO2,aq 0.23173E-08 -8.6350 0.23173E-08 -8.6350 0.10000E+01 0.0000 43 AlO2- 0.11455E-08 -8.9410 0.70423E-09 -9.1523 0.61480E+00 -0.2113 44 AsO2- 0.24997E-07 -7.6021 0.15415E-07 -7.8121 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67129E-10 -10.1731 0.67129E-10 -10.1731 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22584E-06 -6.6462 0.14116E-06 -6.8503 0.62508E+00 -0.2041 64 BaCl+ 0.25234E-06 -6.5980 0.15667E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36291E-09 -9.4402 0.22532E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.94683E-10 -10.0237 0.85923E-10 -10.0659 0.90748E+00 -0.0422 71 CO,aq 0.20441E-10 -10.6895 0.20441E-10 -10.6895 0.10000E+01 0.0000 72 CO2,aq 0.16141E+00 -0.7921 0.14647E+00 -0.8342 0.90748E+00 -0.0422 73 CO3-2 0.82051E-06 -6.0859 0.99731E-07 -7.0012 0.12155E+00 -0.9153 74 CaCO3,aq 0.14960E-06 -6.8251 0.14960E-06 -6.8251 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39954E-04 -4.3984 0.24806E-04 -4.6054 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84140E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72810E-05 -5.1378 0.72810E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22655E-08 -8.6448 0.14066E-08 -8.8518 0.62086E+00 -0.2070 80 CaSO4,aq 0.37651E-06 -6.4242 0.37651E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12571E-05 -5.9006 0.12571E-05 -5.9006 0.10000E+01 0.0000 90 CuCl,aq 0.26291E-09 -9.5802 0.26291E-09 -9.5802 0.10000E+01 0.0000 91 CuCl2- 0.30207E-08 -8.5199 0.18628E-08 -8.7298 0.61667E+00 -0.2099 92 CuCl3-2 0.35169E-09 -9.4538 0.42746E-10 -10.3691 0.12155E+00 -0.9153 98 HF,aq 0.37546E-04 -4.4254 0.37546E-04 -4.4254 0.10000E+01 0.0000 99 HF2- 0.80138E-08 -8.0962 0.49419E-08 -8.3061 0.61667E+00 -0.2099 101 FeCl+ 0.96825E-07 -7.0140 0.60115E-07 -7.2210 0.62086E+00 -0.2070 104 FeF+ 0.30816E-08 -8.5112 0.19132E-08 -8.7182 0.62086E+00 -0.2070 107 FeOH+ 0.76449E-09 -9.1166 0.47464E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.43441E-08 -8.3621 0.39421E-08 -8.4043 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11459E-08 -8.9408 0.11459E-08 -8.9408 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26781E-08 -8.5722 0.26781E-08 -8.5722 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33096E-05 -5.4802 0.20548E-05 -5.6872 0.62086E+00 -0.2070 120 MgCl+ 0.93806E-05 -5.0278 0.58241E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91844E-09 -9.0370 0.57022E-09 -9.2440 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97731E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11688E-08 -8.9323 0.72566E-09 -9.1393 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46265E-04 -4.3347 0.46265E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33673E-07 -7.4727 0.33673E-07 -7.4727 0.10000E+01 0.0000 137 OH- 0.18381E-06 -6.7356 0.11300E-06 -6.9469 0.61480E+00 -0.2113 140 PbCl+ 0.12344E-07 -7.9085 0.76640E-08 -8.1155 0.62086E+00 -0.2070 141 PbCl2,aq 0.20824E-07 -7.6814 0.20824E-07 -7.6814 0.10000E+01 0.0000 142 PbCl3- 0.71508E-08 -8.1456 0.44097E-08 -8.3556 0.61667E+00 -0.2099 143 PbCl4-2 0.40130E-08 -8.3965 0.48777E-09 -9.3118 0.12155E+00 -0.9153 144 PbF+ 0.27067E-10 -10.5676 0.16805E-10 -10.7746 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.12636E-10 -10.8984 0.12636E-10 -10.8984 0.10000E+01 0.0000 150 H2S,aq 0.34771E-05 -5.4588 0.31554E-05 -5.5009 0.90748E+00 -0.0422 159 HSO4- 0.23178E-06 -6.6349 0.14521E-06 -6.8380 0.62647E+00 -0.2031 173 ZnCl+ 0.10278E-05 -5.9881 0.63815E-06 -6.1951 0.62086E+00 -0.2070 174 ZnCl2,aq 0.15657E-06 -6.8053 0.15657E-06 -6.8053 0.10000E+01 0.0000 175 ZnCl3- 0.15400E-07 -7.8125 0.94966E-08 -8.0224 0.61667E+00 -0.2099 176 ZnF+ 0.21698E-09 -9.6636 0.13472E-09 -9.8706 0.62086E+00 -0.2070 178 ZnOH+ 0.17462E-07 -7.7579 0.10842E-07 -7.9649 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1837562E-04 0.1615300E+00 0.1544897E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461192E+06 0.0000 3 Cl- 0.7076060E+00 0.7717764E+00 0.2596308E+05 4.5793 4 SO4-- 0.8912274E-04 0.9420486E-04 0.8586869E+01 4.9192 5 HCO3- 0.1330333E-01 0.1747549E+00 0.1011797E+05 2.8566 6 HS- 0.1885742E-06 0.3669982E-05 0.1151691E+00 -1.9947 7 H4SiO4 0.1402179E-02 0.1403591E-02 0.1280104E+03 -2.8532 8 Al+++ 0.4562571E-11 0.3624343E-08 0.9279127E-04 1.3994 9 Ca++ 0.8668089E-03 0.1051354E-02 0.3998219E+02 5.8817 10 Mg++ 0.7272351E-04 0.8578355E-04 0.1978957E+01 4.7943 11 Fe++ 0.6837525E-06 0.7844261E-06 0.4156843E-01 2.7700 12 K+ 0.2257024E-01 0.2270089E-01 0.8422744E+03 3.0854 13 Na+ 0.6970663E+00 0.7609885E+00 0.1660065E+05 4.5704 14 Mn++ 0.1031861E-04 0.1721796E-04 0.8975655E+00 3.9507 15 Zn++ 0.7692280E-07 0.1294414E-05 0.8029036E-01 1.8212 16 Cu+ 0.1886634E-12 0.3635524E-08 0.2191926E-03 -7.9973 17 Pb++ 0.2151319E-08 0.4652342E-07 0.9146441E-02 0.2845 18 Ag+ 0.5075119E-12 0.6336580E-08 0.6485857E-03 -7.5637 19 Au+ 0.4847442E-23 0.1553621E-11 0.2903690E-06 -18.5820 20 Ba++ 0.1551161E-05 0.2029771E-05 0.2645183E+00 3.1481 21 F- 0.7275551E-03 0.8130270E-03 0.1465631E+02 1.5905 22 H2AsO3- 0.4811845E-07 0.6474252E-04 0.7675168E+01 -2.5421 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234466E+00 -.1144903E-04 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1628774E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886352E-03 0.4071934E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7348748E-05 0.6681563E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200011E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7257361E-08 0.2400022E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570730E-05 0.3257548E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2591926E-05 0.4876250E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.7279749E-08 0.1628774E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.9315819E-07 0.1471862E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1268833E-07 0.4144398E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400022E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1694E-20 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2072E-06 -6.684 0.5135E-04 -4.289 4.602 0.7211E-05 bornite 0.3258E-07 -7.487 0.1635E-04 -4.787 1.465 0.3216E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 19.79 0.6183E-04 galena 0.1472E-05 -5.832 0.3521E-03 -3.453 31.56 0.4635E-04 sphalerite 0.4876E-05 -5.312 0.4751E-03 -3.323 42.58 0.1162E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.001116 g Volume = 0.000235 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: -.5995E+01 GOLD Q/K: 0.2143 SILVER Q/K: 0.0934 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3084 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8132 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.6121E-08 1.0325 0.2358E-06 0.2284E-06 H2,gas 0.1872E-06 1.0193 0.7118E-05 0.6983E-05 H2S,gas 0.4866E-05 0.8805 0.1598E-03 0.1815E-03 S2,gas 0.4141E-17 1.0000 0.1545E-15 0.1545E-15 CO,gas 0.1281E-08 1.0000 0.4778E-07 0.4778E-07 SO3,gas 0.3206E-30 1.0000 0.1196E-28 0.1196E-28 O2,gas 0.8569E-51 1.0000 0.3197E-49 0.3197E-49 SO2,gas 0.7314E-14 1.0000 0.2729E-12 0.2729E-12 HF,gas 0.5298E-08 1.0000 0.1977E-06 0.1977E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.63059E-11 206 bornite -85.08 -85.08 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 0.00000E+00 261 galena -11.59 -11.59 0.00 0.000 0.00000E+00 273 sphalerite -10.05 -10.05 0.00 0.000 0.00000E+00 262 gold,native -17.55 -18.22 -0.67 -0.233 0.11874E+04 263 silver,native -6.17 -7.20 -1.03 -0.358 0.18278E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -4.07 -9.33 -2.332 0.16554E+05 -6.627 4 H2,gas 8.58 0.73 -7.85 -4.484 0.13928E+05 -5.148 5 H2S,gas -5.38 -11.87 -6.50 -3.248 0.11529E+05 -3.796 6 S2,gas -6.70 -25.21 -18.51 -2.848 0.32855E+05 -15.811 7 CO,gas 3.75 -6.27 -10.02 -3.083 0.17785E+05 -7.321 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.922 9 O2,gas 50.71 -1.48 -52.19 -34.796 0.92643E+05 -49.495 10 SO2,gas 1.18 -14.09 -15.26 -4.070 0.27091E+05 -12.564 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56603E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38772E+04 22 analcite 3.18 0.27 -2.90 -0.322 0.51515E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77181E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57766E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36809E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34357E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83411E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19954E+04 66 diamond -2.94 -5.53 -2.59 -0.739 0.45913E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67535E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41098E+04 86 goethite 6.14 2.38 -3.76 -0.812 0.66664E+04 87 graphite -3.37 -5.53 -2.16 -0.618 0.38398E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65368E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22532E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74570E+04 107 magnesite 0.56 -2.23 -2.79 -0.930 0.49497E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30053E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57555E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58904E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85324E+04 143 pyrite -20.64 -21.71 -1.06 -0.250 0.18872E+04 144 pyrrhotite -4.24 -9.10 -4.86 -1.621 0.86320E+04 145 pyrrhotiteFe0.875 -5.92 -9.54 -3.62 -1.331 0.64226E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40934E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37112E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50719E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29303E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81350E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75046E+04 171 sulfur -8.90 -12.60 -3.70 -1.140 0.65741E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71527E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -9.10 -4.73 -1.576 0.83932E+04 196 akaganeite 7.38 2.38 -5.00 -1.081 0.88707E+04 198 arsenic -6.91 -11.29 -4.38 -1.131 0.77778E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74524E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.289 0.80247E+04 203 beidellite-K -1.84 -6.16 -4.33 -0.265 0.76773E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74311E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70861E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -27.87 -1.22 -0.306 0.21736E+04 211 covellite -19.11 -20.24 -1.13 -0.430 0.20016E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46752E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71681E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72605E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71421E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67503E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45738E+04 254 cerussite -2.68 -6.74 -4.05 -1.351 0.71935E+04 255 chalcopyrite -27.58 -29.34 -1.76 -0.328 0.31275E+04 257 copper,native -2.74 -7.63 -4.89 -1.702 0.86845E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79106E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -5.20 -4.42 -1.473 0.78433E+04 274 wurtzite -8.29 -10.05 -1.76 -0.588 0.31311E+04 276 an20ab80 1.85 -1.44 -3.30 -0.254 0.58496E+04 277 an25ab75 2.44 -1.17 -3.60 -0.277 0.63918E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69439E+04 gold,native MINTRY= -0.337E-11 mineral removed from matrix silver,native Not in solid solution anymore ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 20 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9745 Stoichiometric ionic strength = .8709265E+00 Osmotic coef. = 0.9307 True ionic strength = .7230276E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.17398E-04 -4.7595 0.10884E-04 -4.9632 0.62559E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70735E+00 -0.1504 0.43620E+00 -0.3603 0.61667E+00 -0.2099 4 SO4-- 0.59043E-05 -5.2288 0.72679E-06 -6.1386 0.12310E+00 -0.9098 5 HCO3- 0.13991E-01 -1.8542 0.86905E-02 -2.0610 0.62116E+00 -0.2068 6 HS- 0.91618E-09 -9.0380 0.56533E-09 -9.2477 0.61705E+00 -0.2097 7 H4SiO4 0.14021E-02 -2.8532 0.14021E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.40816E-11 -11.3892 0.34084E-13 -13.4675 0.83506E-02 -2.0783 9 Ca++ 0.86545E-03 -3.0628 0.10047E-03 -3.9979 0.11609E+00 -0.9352 10 Mg++ 0.72583E-04 -4.1392 0.82122E-05 -5.0855 0.11314E+00 -0.9464 11 Fe++ 0.72344E-06 -6.1406 0.82324E-07 -7.0845 0.11380E+00 -0.9439 12 K+ 0.22575E-01 -1.6464 0.13996E-01 -1.8540 0.62001E+00 -0.2076 13 Na+ 0.69709E+00 -0.1567 0.42747E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10323E-04 -4.9862 0.11801E-05 -5.9281 0.11431E+00 -0.9419 15 Zn++ 0.14993E-04 -4.8241 0.17061E-05 -5.7680 0.11380E+00 -0.9439 16 Cu+ 0.12011E-10 -10.9204 0.73636E-11 -11.1329 0.61306E+00 -0.2125 17 Pb++ 0.41930E-06 -6.3775 0.49589E-07 -7.3046 0.11827E+00 -0.9271 18 Ag+ 0.70849E-11 -11.1497 0.43824E-11 -11.3583 0.61856E+00 -0.2086 19 Au+ 0.42424E-21 -21.3724 0.26339E-21 -21.5794 0.62086E+00 -0.2070 20 Ba++ 0.15424E-05 -5.8118 0.18479E-06 -6.7333 0.11981E+00 -0.9215 21 F- 0.72931E-03 -3.1371 0.44882E-03 -3.3479 0.61541E+00 -0.2108 22 H2AsO3- 0.50819E-07 -7.2940 0.34844E-07 -7.4579 0.68565E+00 -0.1639 24 HSiO3- 0.35783E-06 -6.4463 0.22066E-06 -6.6563 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.91701E-09 -9.0376 0.56934E-09 -9.2446 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.87246E-10 -10.0593 0.54168E-10 -10.2663 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.11324E-05 -5.9460 0.11324E-05 -5.9460 0.10000E+01 0.0000 31 AgCl,aq 0.11701E-08 -8.9318 0.11701E-08 -8.9318 0.10000E+01 0.0000 32 AgCl2- 0.33472E-07 -7.4753 0.20641E-07 -7.6853 0.61667E+00 -0.2099 33 AgCl3-2 0.10509E-07 -7.9784 0.12772E-08 -8.8937 0.12153E+00 -0.9153 34 AgCl4-3 0.50232E-09 -9.2990 0.44039E-11 -11.3562 0.87670E-02 -2.0572 38 Ag(HS),aq 0.20774E-09 -9.6825 0.20774E-09 -9.6825 0.10000E+01 0.0000 40 AlO+ 0.13066E-09 -9.8839 0.81120E-10 -10.0909 0.62086E+00 -0.2070 41 AlOH+2 0.24615E-10 -10.6088 0.28294E-11 -11.5483 0.11495E+00 -0.9395 42 HAlO2,aq 0.24417E-08 -8.6123 0.24417E-08 -8.6123 0.10000E+01 0.0000 43 AlO2- 0.12747E-08 -8.8946 0.78370E-09 -9.1058 0.61480E+00 -0.2113 44 AsO2- 0.26400E-07 -7.5784 0.16280E-07 -7.7883 0.61667E+00 -0.2099 45 HAsO2,aq 0.24652E-04 -4.6082 0.24652E-04 -4.6082 0.10000E+01 0.0000 46 H3AsO3,aq 0.40014E-04 -4.3978 0.40014E-04 -4.3978 0.10000E+01 0.0000 48 H2AsO4- 0.11995E-10 -10.9210 0.73968E-11 -11.1310 0.61667E+00 -0.2099 62 BaCO3,aq 0.74133E-10 -10.1300 0.74133E-10 -10.1300 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.23614E-06 -6.6268 0.14760E-06 -6.8309 0.62508E+00 -0.2041 64 BaCl+ 0.25080E-06 -6.6007 0.15571E-06 -6.8077 0.62086E+00 -0.2070 65 BaF+ 0.36169E-09 -9.4417 0.22456E-09 -9.6487 0.62086E+00 -0.2070 71 CO,aq 0.10738E-10 -10.9691 0.10738E-10 -10.9691 0.10000E+01 0.0000 72 CO2,aq 0.16072E+00 -0.7939 0.14585E+00 -0.8361 0.90748E+00 -0.0422 73 CO3-2 0.91150E-06 -6.0402 0.11078E-06 -6.9556 0.12153E+00 -0.9153 74 CaCO3,aq 0.16589E-06 -6.7802 0.16589E-06 -6.7802 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.41947E-04 -4.3773 0.26043E-04 -4.5843 0.62086E+00 -0.2070 76 CaCl+ 0.13524E-03 -3.8689 0.83967E-04 -4.0759 0.62086E+00 -0.2070 77 CaCl2,aq 0.72633E-05 -5.1389 0.72633E-05 -5.1389 0.10000E+01 0.0000 78 CaF+ 0.12600E-05 -5.8996 0.78230E-06 -6.1066 0.62086E+00 -0.2070 79 CaOH+ 0.23887E-08 -8.6218 0.14831E-08 -8.8288 0.62086E+00 -0.2070 80 CaSO4,aq 0.24898E-07 -7.6038 0.24898E-07 -7.6038 0.10000E+01 0.0000 81 HCl,aq 0.11898E-05 -5.9245 0.11898E-05 -5.9245 0.10000E+01 0.0000 90 CuCl,aq 0.16732E-07 -7.7765 0.16732E-07 -7.7765 0.10000E+01 0.0000 91 CuCl2- 0.19217E-06 -6.7163 0.11851E-06 -6.9263 0.61667E+00 -0.2099 92 CuCl3-2 0.22368E-07 -7.6504 0.27184E-08 -8.5657 0.12153E+00 -0.9153 98 HF,aq 0.35635E-04 -4.4481 0.35635E-04 -4.4481 0.10000E+01 0.0000 99 HF2- 0.76243E-08 -8.1178 0.47017E-08 -8.3277 0.61667E+00 -0.2099 101 FeCl+ 0.10239E-06 -6.9897 0.63573E-07 -7.1967 0.62086E+00 -0.2070 104 FeF+ 0.32679E-08 -8.4857 0.20289E-08 -8.6927 0.62086E+00 -0.2070 107 FeOH+ 0.85420E-09 -9.0684 0.53034E-09 -9.2754 0.62086E+00 -0.2070 113 H2,aq 0.22918E-08 -8.6398 0.20797E-08 -8.6820 0.90748E+00 -0.0422 114 KCl,aq 0.12616E-03 -3.8991 0.12616E-03 -3.8991 0.10000E+01 0.0000 116 KOH,aq 0.12105E-08 -8.9170 0.12105E-08 -8.9170 0.10000E+01 0.0000 117 KSO4- 0.29620E-06 -6.5284 0.18266E-06 -6.7384 0.61667E+00 -0.2099 118 MgCO3,aq 0.29686E-08 -8.5274 0.29686E-08 -8.5274 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.34735E-05 -5.4592 0.21565E-05 -5.6662 0.62086E+00 -0.2070 120 MgCl+ 0.93578E-05 -5.0288 0.58099E-05 -5.2358 0.62086E+00 -0.2070 121 MgF+ 0.36622E-06 -6.4363 0.22737E-06 -6.6433 0.62086E+00 -0.2070 122 MgOH+ 0.96803E-09 -9.0141 0.60101E-09 -9.2211 0.62086E+00 -0.2070 124 MnF+ 0.15784E-07 -7.8018 0.97997E-08 -8.0088 0.62086E+00 -0.2070 126 MnOH+ 0.12348E-08 -8.9084 0.76666E-09 -9.1154 0.62086E+00 -0.2070 131 MnCl+ 0.68777E-05 -5.1626 0.42701E-05 -5.3696 0.62086E+00 -0.2070 132 MnSO4,aq 0.28436E-09 -9.5461 0.28436E-09 -9.5461 0.10000E+01 0.0000 133 NaCl,aq 0.63854E-01 -1.1948 0.63854E-01 -1.1948 0.10000E+01 0.0000 134 NaF,aq 0.46379E-04 -4.3337 0.46379E-04 -4.3337 0.10000E+01 0.0000 135 NaOH,aq 0.35566E-07 -7.4490 0.35566E-07 -7.4490 0.10000E+01 0.0000 137 OH- 0.19413E-06 -6.7119 0.11935E-06 -6.9232 0.61480E+00 -0.2113 140 PbCl+ 0.24047E-05 -5.6189 0.14930E-05 -5.8259 0.62086E+00 -0.2070 141 PbCl2,aq 0.40552E-05 -5.3920 0.40552E-05 -5.3920 0.10000E+01 0.0000 142 PbCl3- 0.13920E-05 -5.8564 0.85841E-06 -6.0663 0.61667E+00 -0.2099 143 PbCl4-2 0.78100E-06 -6.1074 0.94916E-07 -7.0227 0.12153E+00 -0.9153 144 PbF+ 0.52876E-08 -8.2767 0.32829E-08 -8.4837 0.62086E+00 -0.2070 145 PbF2,aq 0.20655E-10 -10.6850 0.20655E-10 -10.6850 0.10000E+01 0.0000 146 PbO,aq 0.22144E-10 -10.6547 0.22144E-10 -10.6547 0.10000E+01 0.0000 150 H2S,aq 0.15995E-07 -7.7960 0.14515E-07 -7.8382 0.90748E+00 -0.0422 159 HSO4- 0.14537E-07 -7.8375 0.91069E-08 -8.0406 0.62647E+00 -0.2031 173 ZnCl+ 0.20023E-03 -3.6985 0.12432E-03 -3.9055 0.62086E+00 -0.2070 174 ZnCl2,aq 0.30491E-04 -4.5158 0.30491E-04 -4.5158 0.10000E+01 0.0000 175 ZnCl3- 0.29978E-05 -5.5232 0.18486E-05 -5.7331 0.61667E+00 -0.2099 176 ZnF+ 0.42388E-07 -7.3728 0.26317E-07 -7.5798 0.62086E+00 -0.2070 177 ZnO,aq 0.49201E-09 -9.3080 0.49201E-09 -9.3080 0.10000E+01 0.0000 178 ZnOH+ 0.35942E-05 -5.4444 0.22315E-05 -5.6514 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1739837E-04 0.1608309E+00 0.1538179E+03 0.0000 2 H2O 0.1000000E+01 0.5534751E+02 0.9461115E+06 0.0000 3 Cl- 0.7073454E+00 0.7717812E+00 0.2596270E+05 4.6029 4 SO4-- 0.5904278E-05 0.6239615E-05 0.5687355E+00 3.7878 5 HCO3- 0.1399080E-01 0.1747559E+00 0.1011782E+05 2.9022 6 HS- 0.9161753E-09 0.1769922E-07 0.5554146E-03 -4.2845 7 H4SiO4 0.1402108E-02 0.1403600E-02 0.1280085E+03 -2.8532 8 Al+++ 0.4081574E-11 0.3875736E-08 0.9922542E-04 1.4221 9 Ca++ 0.8654528E-03 0.1051360E-02 0.3998161E+02 5.9285 10 Mg++ 0.7258252E-04 0.8578408E-04 0.1978928E+01 4.8409 11 Fe++ 0.7234412E-06 0.8299608E-06 0.4398050E-01 2.8419 12 K+ 0.2257457E-01 0.2270103E-01 0.8422621E+03 3.1092 13 Na+ 0.6970921E+00 0.7609932E+00 0.1660040E+05 4.5941 14 Mn++ 0.1032306E-04 0.1721806E-04 0.8975525E+00 3.9983 15 Zn++ 0.1499262E-04 0.2523494E-03 0.1565249E+02 4.1584 16 Cu+ 0.1201123E-10 0.2312849E-06 0.1394432E-01 -6.1697 17 Pb++ 0.4193034E-06 0.9057617E-05 0.1780678E+01 2.6218 18 Ag+ 0.7084854E-11 0.4586836E-07 0.4694795E-02 -6.3951 19 Au+ 0.4242391E-21 0.1553631E-11 0.2903648E-06 -16.6162 20 Ba++ 0.1542414E-05 0.2029783E-05 0.2645145E+00 3.1931 21 F- 0.7293101E-03 0.8130323E-03 0.1465610E+02 1.6153 22 H2AsO3- 0.5081877E-07 0.6474292E-04 0.7675056E+01 -2.4947 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3220448E+00 0.1390367E-02 0.0000000E+00 2 H2O 0.1108261E+03 0.1108268E+03 -.7045807E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1249409E-04 0.1761452E-03 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.3544058E-07 0.1399487E-04 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1199759E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7760700E-08 0.2399518E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1661898E-05 -.5859268E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.5052996E-03 -.4978314E-03 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4631205E-06 -.2929634E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1813680E-04 -.1657178E-04 0.0000000E+00 18 Ag+ 0.4271281E-06 0.9184593E-07 0.3352822E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2399518E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.3388E-19 Mass of aqueous solution: 0.211030E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.7048E-03 -3.152 0.1746 -0.758 -589.1 0.2453E-01 bornite -.5859E-07 1.000 -.2940E-04 1.000 0.9918E-01 -.5784E-05 topaz 0.1200E-05 -5.921 0.2208E-03 -3.656 -.7448 0.6182E-04 galena -.1657E-04 1.000 -.3965E-02 1.000 13.37 -.5218E-03 sphalerite -.4978E-03 1.000 -.4850E-01 1.000 163.6 -.1186E-01 silver,native -.1409E-02 1.000 -.1520 1.000 512.8 -.1448E-01 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 silver,native 0.1000E+01 0.1698E-01 0.0170 -1.770 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = -0.029646 g Volume = -0.002279 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.700 AFFINITY: -.2698E+04 GOLD Q/K: 14.3875 SILVER Q/K: 1.0000 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.1442 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6932E-01 0.8140 0.2096E+01 0.2575E+01 CO2,gas 0.9307E+00 0.9145 0.3161E+02 0.3457E+02 CH4,gas 0.4743E-09 1.0324 0.1819E-07 0.1762E-07 H2,gas 0.9918E-07 1.0192 0.3755E-05 0.3684E-05 H2S,gas 0.2247E-07 0.8810 0.7353E-06 0.8346E-06 S2,gas 0.3162E-21 1.0000 0.1175E-19 0.1175E-19 CO,gas 0.6758E-09 1.0000 0.2510E-07 0.2510E-07 SO3,gas 0.1912E-31 1.0000 0.7102E-30 0.7102E-30 O2,gas 0.3092E-50 1.0000 0.1149E-48 0.1149E-48 SO2,gas 0.2301E-15 1.0000 0.8549E-14 0.8549E-14 HF,gas 0.5051E-08 1.0000 0.1876E-06 0.1876E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 -0.63059E-11 226 topaz -16.63 -16.63 0.00 0.000 -0.12612E-10 263 silver,native -6.17 -6.17 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.400 0.21284E+04 1.500 3 CH4,gas 5.26 -5.18 -10.44 -2.610 0.18529E+05 -7.740 4 H2,gas 8.58 0.45 -8.12 -4.642 0.14420E+05 -5.425 5 H2S,gas -5.38 -14.21 -8.83 -4.416 0.15677E+05 -6.134 6 S2,gas -6.70 -29.33 -22.63 -3.481 0.40166E+05 -19.930 7 CO,gas 3.75 -6.55 -10.30 -3.169 0.18281E+05 -7.600 8 SO3,gas 16.79 -16.05 -32.85 -8.212 0.58303E+05 -30.149 9 O2,gas 50.71 -0.93 -51.64 -34.426 0.91657E+05 -48.940 10 SO2,gas 1.18 -15.59 -16.77 -4.471 0.29761E+05 -14.068 11 HF,gas 1.11 -8.31 -9.43 -4.713 0.16730E+05 -6.727 12 HCl,gas 2.94 -5.32 -8.26 -4.130 0.14661E+05 -8.260 17 albite-high 0.64 -2.50 -3.14 -0.242 0.55780E+04 18 albite -0.36 -2.50 -2.14 -0.164 0.37949E+04 22 analcite 3.18 0.32 -2.86 -0.317 0.50692E+04 23 andalusite 4.28 -0.02 -4.30 -0.430 0.76375E+04 26 anhydrite -5.26 -10.14 -4.88 -2.441 0.86639E+04 27 ankerite -2.14 -5.28 -3.14 -0.523 0.55725E+04 34 aragonite 0.93 -1.10 -2.03 -0.676 0.36012E+04 36 calcite 0.80 -1.10 -1.89 -0.630 0.33561E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.81 -4.65 -0.423 0.82605E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77218E+03 65 diaspore 2.50 1.40 -1.10 -0.184 0.19551E+04 66 diamond -2.94 -6.09 -3.14 -0.898 0.55805E+04 69 dolomite,ordered 0.44 -3.28 -3.72 -0.619 0.65945E+04 83 gibbsite 3.68 1.39 -2.29 -0.328 0.40695E+04 86 goethite 6.14 2.59 -3.54 -0.766 0.62922E+04 87 graphite -3.37 -6.09 -2.72 -0.777 0.48290E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41492E+04 96 jadeite 3.97 0.33 -3.64 -0.364 0.64545E+04 99 kaolinite -1.65 -2.87 -1.22 -0.111 0.21727E+04 100 kyanite 4.14 -0.02 -4.16 -0.416 0.73765E+04 107 magnesite 0.56 -2.18 -2.74 -0.915 0.48703E+04 117 microcline -2.34 -3.98 -1.65 -0.127 0.29229E+04 121 muscovite 1.97 -1.18 -3.15 -0.185 0.55924E+04 122 paragonite 3.53 0.30 -3.23 -0.190 0.57274E+04 123 nepheline 7.92 3.16 -4.76 -0.680 0.84500E+04 147 pyrophyllite -6.26 -8.52 -2.26 -0.141 0.40130E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12812E+02 153 rhodochrosite -0.98 -3.03 -2.05 -0.682 0.36300E+04 155 sanidine -1.17 -3.98 -2.81 -0.216 0.49894E+04 157 siderite -2.60 -4.18 -1.58 -0.527 0.28059E+04 158 sillimanite 4.52 -0.02 -4.54 -0.454 0.80545E+04 165 stilbite -7.03 -11.17 -4.14 -0.197 0.73414E+04 172 sylvite 1.43 -2.21 -3.65 -1.824 0.64734E+04 180 topaz-H 3.95 -0.03 -3.98 -0.362 0.70721E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67483E+03 196 akaganeite 7.38 2.59 -4.79 -1.035 0.84965E+04 198 arsenic -6.91 -11.71 -4.80 -1.238 0.85173E+04 201 beidellite-Ca -2.01 -6.15 -4.14 -0.256 0.73450E+04 202 beidellite-H -2.66 -7.13 -4.47 -0.285 0.79309E+04 203 beidellite-K -1.84 -6.10 -4.26 -0.261 0.75696E+04 204 beidellite-Mg -2.20 -6.33 -4.13 -0.255 0.73238E+04 205 beidellite-Na -1.68 -5.61 -3.93 -0.241 0.69785E+04 206 bornite -85.08 -85.08 0.00 0.000 -0.25224E-10 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33174E+03 209 chalcocite -26.64 -26.55 0.09 0.023 -0.16582E+03 211 covellite -19.11 -20.61 -1.50 -0.571 0.26596E+04 212 dawsonite 1.56 -1.03 -2.59 -0.324 0.45960E+04 214 montmorillonite-Ca -2.44 -6.42 -3.98 -0.246 0.70601E+04 215 montmorillonite-K -2.34 -6.37 -4.03 -0.247 0.71522E+04 216 montmorillonite-Mg -2.63 -6.60 -3.96 -0.245 0.70340E+04 217 montmorillonite-Na -2.14 -5.88 -3.74 -0.229 0.66420E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -12.87 -3.68 -1.838 0.65252E+04 253 boehmite 3.95 1.40 -2.55 -0.426 0.45335E+04 254 cerussite -2.68 -4.40 -1.72 -0.572 0.30483E+04 255 chalcopyrite -27.58 -31.98 -4.40 -0.818 0.78064E+04 256 chlorargyrite -7.22 -11.72 -4.49 -2.247 0.79781E+04 257 copper,native -2.74 -5.94 -3.20 -1.114 0.56869E+04 258 dolomite,disordered 1.09 -3.28 -4.37 -0.728 0.77516E+04 260 fluorite -9.68 -10.69 -1.01 -0.337 0.17964E+04 261 galena -11.59 -11.59 0.00 0.000 0.00000E+00 262 gold,native -17.55 -16.39 1.16 0.403 -0.20554E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -2.87 -2.08 -0.694 0.36981E+04 273 sphalerite -10.05 -10.05 0.00 0.000 0.00000E+00 274 wurtzite -8.29 -10.05 -1.76 -0.588 0.31311E+04 275 zincite 7.78 4.15 -3.64 -0.909 0.64543E+04 276 an20ab80 1.85 -1.39 -3.24 -0.249 0.57511E+04 277 an25ab75 2.44 -1.11 -3.54 -0.273 0.62892E+04 278 an30ab70 3.02 -0.83 -3.85 -0.296 0.68372E+04 silver,native MINTRY= -0.600E-05 mineral removed from matrix ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 12 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705965E+00 Osmotic coef. = 0.9306 True ionic strength = .7228352E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18366E-04 -4.7360 0.11490E-04 -4.9397 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70760E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89125E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13310E-01 -1.8758 0.82673E-02 -2.0826 0.62116E+00 -0.2068 6 HS- 0.35493E-06 -6.4499 0.21901E-06 -6.6595 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45579E-11 -11.3412 0.38072E-13 -13.4194 0.83530E-02 -2.0782 9 Ca++ 0.86679E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72722E-04 -4.1383 0.82290E-05 -5.0847 0.11316E+00 -0.9463 11 Fe++ 0.69793E-06 -6.1562 0.79432E-07 -7.1000 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.22164E-06 -6.6544 0.25225E-07 -7.5982 0.11381E+00 -0.9438 16 Cu+ 0.44099E-11 -11.3556 0.27035E-11 -11.5681 0.61306E+00 -0.2125 17 Pb++ 0.36117E-07 -7.4423 0.42719E-08 -8.3694 0.11828E+00 -0.9271 18 Ag+ 0.36983E-12 -12.4320 0.22876E-12 -12.6406 0.61856E+00 -0.2086 19 Au+ 0.25764E-23 -23.5890 0.15996E-23 -23.7960 0.62086E+00 -0.2070 20 Ba++ 0.15511E-05 -5.8094 0.18586E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72757E-03 -3.1381 0.44775E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48143E-07 -7.3175 0.33009E-07 -7.4814 0.68565E+00 -0.1639 24 HSiO3- 0.33898E-06 -6.4698 0.20904E-06 -6.6798 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.87017E-09 -9.0604 0.54026E-09 -9.2674 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82821E-10 -10.0819 0.51420E-10 -10.2889 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10728E-05 -5.9695 0.10728E-05 -5.9695 0.10000E+01 0.0000 31 AgCl,aq 0.61105E-10 -10.2139 0.61105E-10 -10.2139 0.10000E+01 0.0000 32 AgCl2- 0.17485E-08 -8.7573 0.10783E-08 -8.9673 0.61667E+00 -0.2099 33 AgCl3-2 0.54913E-09 -9.2603 0.66745E-10 -10.1756 0.12155E+00 -0.9153 34 AgCl4-3 0.26252E-10 -10.5808 0.23022E-12 -12.6379 0.87694E-02 -2.0570 38 Ag(HS),aq 0.42011E-08 -8.3766 0.42011E-08 -8.3766 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81312E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26043E-10 -10.5843 0.29939E-11 -11.5238 0.11496E+00 -0.9395 42 HAlO2,aq 0.23184E-08 -8.6348 0.23184E-08 -8.6348 0.10000E+01 0.0000 43 AlO2- 0.11466E-08 -8.9406 0.70492E-09 -9.1519 0.61480E+00 -0.2113 44 AsO2- 0.25010E-07 -7.6019 0.15423E-07 -7.8118 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67190E-10 -10.1727 0.67190E-10 -10.1727 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22593E-06 -6.6460 0.14122E-06 -6.8501 0.62508E+00 -0.2041 64 BaCl+ 0.25233E-06 -6.5980 0.15666E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36290E-09 -9.4402 0.22531E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.17829E-09 -9.7489 0.16179E-09 -9.7910 0.90748E+00 -0.0422 71 CO,aq 0.23945E-10 -10.6208 0.23945E-10 -10.6208 0.10000E+01 0.0000 72 CO2,aq 0.16140E+00 -0.7921 0.14647E+00 -0.8343 0.90748E+00 -0.0422 73 CO3-2 0.82131E-06 -6.0855 0.99827E-07 -7.0007 0.12155E+00 -0.9153 74 CaCO3,aq 0.14975E-06 -6.8246 0.14975E-06 -6.8246 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39972E-04 -4.3982 0.24817E-04 -4.6053 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84138E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72808E-05 -5.1378 0.72808E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22666E-08 -8.6446 0.14072E-08 -8.8516 0.62086E+00 -0.2070 80 CaSO4,aq 0.37651E-06 -6.4242 0.37651E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12565E-05 -5.9009 0.12565E-05 -5.9009 0.10000E+01 0.0000 90 CuCl,aq 0.61452E-08 -8.2115 0.61452E-08 -8.2115 0.10000E+01 0.0000 91 CuCl2- 0.70607E-07 -7.1512 0.43541E-07 -7.3611 0.61667E+00 -0.2099 92 CuCl3-2 0.82203E-08 -8.0851 0.99915E-09 -9.0004 0.12155E+00 -0.9153 98 HF,aq 0.37528E-04 -4.4256 0.37528E-04 -4.4256 0.10000E+01 0.0000 99 HF2- 0.80101E-08 -8.0964 0.49396E-08 -8.3063 0.61667E+00 -0.2099 101 FeCl+ 0.98832E-07 -7.0051 0.61361E-07 -7.2121 0.62086E+00 -0.2070 104 FeF+ 0.31455E-08 -8.5023 0.19529E-08 -8.7093 0.62086E+00 -0.2070 107 FeOH+ 0.78073E-09 -9.1075 0.48473E-09 -9.3145 0.62086E+00 -0.2070 113 H2,aq 0.50888E-08 -8.2934 0.46180E-08 -8.3356 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11465E-08 -8.9406 0.11465E-08 -8.9406 0.10000E+01 0.0000 117 KSO4- 0.44708E-05 -5.3496 0.27570E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26807E-08 -8.5718 0.26807E-08 -8.5718 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33111E-05 -5.4800 0.20557E-05 -5.6870 0.62086E+00 -0.2070 120 MgCl+ 0.93804E-05 -5.0278 0.58240E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91888E-09 -9.0367 0.57050E-09 -9.2437 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97733E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11694E-08 -8.9320 0.72603E-09 -9.1390 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42916E-08 -8.3674 0.42916E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46266E-04 -4.3347 0.46266E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33690E-07 -7.4725 0.33690E-07 -7.4725 0.10000E+01 0.0000 137 OH- 0.18390E-06 -6.7354 0.11306E-06 -6.9467 0.61480E+00 -0.2113 140 PbCl+ 0.20723E-06 -6.6835 0.12866E-06 -6.8905 0.62086E+00 -0.2070 141 PbCl2,aq 0.34960E-06 -6.4564 0.34960E-06 -6.4564 0.10000E+01 0.0000 142 PbCl3- 0.12005E-06 -6.9206 0.74029E-07 -7.1306 0.61667E+00 -0.2099 143 PbCl4-2 0.67370E-07 -7.1715 0.81885E-08 -8.0868 0.12155E+00 -0.9153 144 PbF+ 0.45442E-09 -9.3425 0.28213E-09 -9.5495 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.75153E-09 -9.1241 0.75153E-09 -9.1241 0.10000E+01 0.0000 150 H2S,aq 0.65413E-05 -5.1843 0.59361E-05 -5.2265 0.90748E+00 -0.0422 159 HSO4- 0.23167E-06 -6.6351 0.14514E-06 -6.8382 0.62647E+00 -0.2031 173 ZnCl+ 0.29615E-05 -5.5285 0.18387E-05 -5.7355 0.62086E+00 -0.2070 174 ZnCl2,aq 0.45113E-06 -6.3457 0.45113E-06 -6.3457 0.10000E+01 0.0000 175 ZnCl3- 0.44371E-07 -7.3529 0.27362E-07 -7.5628 0.61667E+00 -0.2099 176 ZnF+ 0.62521E-09 -9.2040 0.38817E-09 -9.4110 0.62086E+00 -0.2070 178 ZnOH+ 0.50340E-07 -7.2981 0.31254E-07 -7.5051 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1836636E-04 0.1615268E+00 0.1544866E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461189E+06 0.0000 3 Cl- 0.7076022E+00 0.7717765E+00 0.2596307E+05 4.5795 4 SO4-- 0.8912505E-04 0.9420690E-04 0.8587051E+01 4.9197 5 HCO3- 0.1330953E-01 0.1747549E+00 0.1011796E+05 2.8570 6 HS- 0.3549320E-06 0.6903410E-05 0.2166385E+00 -1.7199 7 H4SiO4 0.1402178E-02 0.1403591E-02 0.1280103E+03 -2.8532 8 Al+++ 0.4557894E-11 0.3626570E-08 0.9284823E-04 1.3997 9 Ca++ 0.8667945E-03 0.1051354E-02 0.3998217E+02 5.8821 10 Mg++ 0.7272227E-04 0.8578356E-04 0.1978956E+01 4.7947 11 Fe++ 0.6979332E-06 0.8006944E-06 0.4243050E-01 2.7794 12 K+ 0.2257024E-01 0.2270089E-01 0.8422741E+03 3.0856 13 Na+ 0.6970667E+00 0.7609886E+00 0.1660064E+05 4.5706 14 Mn++ 0.1031865E-04 0.1721796E-04 0.8975652E+00 3.9511 15 Zn++ 0.2216397E-06 0.3729625E-05 0.2313424E+00 2.2812 16 Cu+ 0.4409875E-11 0.8497688E-07 0.5123414E-02 -6.6284 17 Pb++ 0.3611683E-07 0.7815751E-06 0.1536565E+00 1.5100 18 Ag+ 0.3698328E-12 0.6587009E-08 0.6742182E-03 -7.7009 19 Au+ 0.2576389E-23 0.1553621E-11 0.2903689E-06 -18.8563 20 Ba++ 0.1551082E-05 0.2029771E-05 0.2645182E+00 3.1485 21 F- 0.7275714E-03 0.8130271E-03 0.1465630E+02 1.5907 22 H2AsO3- 0.4814270E-07 0.6474253E-04 0.7675165E+01 -2.5417 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234402E+00 -.5007003E-05 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 0.0000000E+00 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886393E-03 0.0000000E+00 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.1382334E-04 0.2069692E-06 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200009E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7261819E-08 0.2400017E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1603305E-05 0.0000000E+00 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.7468176E-05 0.0000000E+00 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1701571E-06 0.0000000E+00 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1565021E-05 0.0000000E+00 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1318978E-07 0.4139383E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400017E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2070E-06 -6.684 0.5129E-04 -4.290 18.85 0.7202E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 81.15 0.6183E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.000272 g Volume = 0.000069 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2982E+03 GOLD Q/K: 0.1233 SILVER Q/K: 0.0737 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3071 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8133 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.1153E-07 1.0325 0.4440E-06 0.4300E-06 H2,gas 0.2192E-06 1.0193 0.8338E-05 0.8180E-05 H2S,gas 0.9154E-05 0.8805 0.3007E-03 0.3415E-03 S2,gas 0.1068E-16 1.0000 0.3984E-15 0.3984E-15 CO,gas 0.1500E-08 1.0000 0.5597E-07 0.5597E-07 SO3,gas 0.3203E-30 1.0000 0.1195E-28 0.1195E-28 O2,gas 0.6245E-51 1.0000 0.2330E-49 0.2330E-49 SO2,gas 0.8560E-14 1.0000 0.3193E-12 0.3193E-12 HF,gas 0.5296E-08 1.0000 0.1976E-06 0.1976E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 0.63059E-11 206 bornite -85.08 -77.16 7.92 0.592 -0.14053E+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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -3.79 -9.05 -2.263 0.16066E+05 -6.353 4 H2,gas 8.58 0.80 -7.78 -4.445 0.13806E+05 -5.079 5 H2S,gas -5.38 -11.60 -6.22 -3.110 0.11042E+05 -3.522 6 S2,gas -6.70 -24.80 -18.10 -2.784 0.32124E+05 -15.400 7 CO,gas 3.75 -6.20 -9.95 -3.062 0.17663E+05 -7.252 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.923 9 O2,gas 50.71 -1.62 -52.33 -34.888 0.92887E+05 -49.633 10 SO2,gas 1.18 -14.02 -15.19 -4.052 0.26970E+05 -12.496 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56596E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38764E+04 22 analcite 3.18 0.28 -2.90 -0.322 0.51508E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77174E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.38 -3.24 -0.541 0.57593E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36801E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34350E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83404E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19950E+04 66 diamond -2.94 -5.39 -2.45 -0.700 0.43474E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67521E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41094E+04 86 goethite 6.14 2.36 -3.78 -0.817 0.67108E+04 87 graphite -3.37 -5.39 -2.03 -0.579 0.35959E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65361E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22524E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74563E+04 107 magnesite 0.56 -2.23 -2.79 -0.929 0.49490E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30045E+04 121 muscovite 1.97 -1.27 -3.24 -0.191 0.57540E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58889E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85317E+04 143 pyrite -20.64 -21.22 -0.57 -0.135 0.10183E+04 144 pyrrhotite -4.24 -8.82 -4.58 -1.526 0.81283E+04 145 pyrrhotiteFe0.875 -5.92 -9.27 -3.34 -1.230 0.59360E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40927E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37105E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50711E+04 157 siderite -2.60 -4.24 -1.64 -0.547 0.29137E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81343E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75031E+04 171 sulfur -8.90 -12.40 -3.50 -1.076 0.62089E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71519E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -8.82 -4.44 -1.482 0.78894E+04 198 arsenic -6.91 -11.19 -4.28 -1.104 0.75949E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74514E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.288 0.80238E+04 203 beidellite-K -1.84 -6.16 -4.32 -0.265 0.76763E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74302E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70851E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -24.86 1.79 0.447 -0.31732E+04 211 covellite -19.11 -18.63 0.48 0.183 -0.85443E+03 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46744E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71671E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72595E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71411E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67493E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45734E+04 254 cerussite -2.68 -5.51 -2.83 -0.942 0.50184E+04 255 chalcopyrite -27.58 -27.45 0.13 0.024 -0.23227E+03 257 copper,native -2.74 -6.23 -3.49 -1.214 0.61936E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79091E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 261 galena -11.59 -10.09 1.50 0.500 -0.26622E+04 262 gold,native -17.55 -18.46 -0.91 -0.316 0.16133E+04 263 silver,native -6.17 -7.30 -1.13 -0.394 0.20104E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -4.74 -3.96 -1.320 0.70268E+04 273 sphalerite -10.05 -9.32 0.73 0.245 -0.13037E+04 274 wurtzite -8.29 -9.32 -1.03 -0.343 0.18274E+04 276 an20ab80 1.85 -1.44 -3.30 -0.253 0.58487E+04 277 an25ab75 2.44 -1.16 -3.60 -0.277 0.63909E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69429E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705964E+00 Osmotic coef. = 0.9306 True ionic strength = .7228351E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18367E-04 -4.7360 0.11490E-04 -4.9397 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70760E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13309E-01 -1.8758 0.82672E-02 -2.0826 0.62116E+00 -0.2068 6 HS- 0.35163E-06 -6.4539 0.21697E-06 -6.6636 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45580E-11 -11.3412 0.38073E-13 -13.4194 0.83530E-02 -2.0782 9 Ca++ 0.86679E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72722E-04 -4.1383 0.82290E-05 -5.0847 0.11316E+00 -0.9463 11 Fe++ 0.68351E-06 -6.1653 0.77790E-07 -7.1091 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.22164E-06 -6.6544 0.25225E-07 -7.5982 0.11381E+00 -0.9438 16 Cu+ 0.11638E-12 -12.9341 0.71348E-13 -13.1466 0.61306E+00 -0.2125 17 Pb++ 0.36117E-07 -7.4423 0.42720E-08 -8.3694 0.11828E+00 -0.9271 18 Ag+ 0.37157E-12 -12.4300 0.22983E-12 -12.6386 0.61856E+00 -0.2086 19 Au+ 0.26006E-23 -23.5849 0.16146E-23 -23.7919 0.62086E+00 -0.2070 20 Ba++ 0.15511E-05 -5.8094 0.18586E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72757E-03 -3.1381 0.44775E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48142E-07 -7.3175 0.33009E-07 -7.4814 0.68565E+00 -0.1639 24 HSiO3- 0.33898E-06 -6.4698 0.20904E-06 -6.6798 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.87017E-09 -9.0604 0.54025E-09 -9.2674 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82820E-10 -10.0819 0.51420E-10 -10.2889 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10728E-05 -5.9695 0.10728E-05 -5.9695 0.10000E+01 0.0000 31 AgCl,aq 0.61391E-10 -10.2119 0.61391E-10 -10.2119 0.10000E+01 0.0000 32 AgCl2- 0.17567E-08 -8.7553 0.10833E-08 -8.9652 0.61667E+00 -0.2099 33 AgCl3-2 0.55170E-09 -9.2583 0.67058E-10 -10.1736 0.12155E+00 -0.9153 34 AgCl4-3 0.26375E-10 -10.5788 0.23130E-12 -12.6358 0.87694E-02 -2.0570 38 Ag(HS),aq 0.41815E-08 -8.3787 0.41815E-08 -8.3787 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81312E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26043E-10 -10.5843 0.29939E-11 -11.5238 0.11496E+00 -0.9395 42 HAlO2,aq 0.23184E-08 -8.6348 0.23184E-08 -8.6348 0.10000E+01 0.0000 43 AlO2- 0.11466E-08 -8.9406 0.70491E-09 -9.1519 0.61480E+00 -0.2113 44 AsO2- 0.25009E-07 -7.6019 0.15423E-07 -7.8118 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67189E-10 -10.1727 0.67189E-10 -10.1727 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22593E-06 -6.6460 0.14122E-06 -6.8501 0.62508E+00 -0.2041 64 BaCl+ 0.25233E-06 -6.5980 0.15666E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36290E-09 -9.4402 0.22531E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.17663E-09 -9.7529 0.16029E-09 -9.7951 0.90748E+00 -0.0422 71 CO,aq 0.23889E-10 -10.6218 0.23889E-10 -10.6218 0.10000E+01 0.0000 72 CO2,aq 0.16140E+00 -0.7921 0.14647E+00 -0.8343 0.90748E+00 -0.0422 73 CO3-2 0.82130E-06 -6.0855 0.99826E-07 -7.0008 0.12155E+00 -0.9153 74 CaCO3,aq 0.14974E-06 -6.8247 0.14974E-06 -6.8247 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39971E-04 -4.3983 0.24817E-04 -4.6053 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84138E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72808E-05 -5.1378 0.72808E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22666E-08 -8.6446 0.14072E-08 -8.8516 0.62086E+00 -0.2070 80 CaSO4,aq 0.37650E-06 -6.4242 0.37650E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12565E-05 -5.9008 0.12565E-05 -5.9008 0.10000E+01 0.0000 90 CuCl,aq 0.16218E-09 -9.7900 0.16218E-09 -9.7900 0.10000E+01 0.0000 91 CuCl2- 0.18634E-08 -8.7297 0.11491E-08 -8.9397 0.61667E+00 -0.2099 92 CuCl3-2 0.21694E-09 -9.6637 0.26368E-10 -10.5789 0.12155E+00 -0.9153 98 HF,aq 0.37528E-04 -4.4256 0.37528E-04 -4.4256 0.10000E+01 0.0000 99 HF2- 0.80102E-08 -8.0964 0.49397E-08 -8.3063 0.61667E+00 -0.2099 101 FeCl+ 0.96790E-07 -7.0142 0.60093E-07 -7.2212 0.62086E+00 -0.2070 104 FeF+ 0.30805E-08 -8.5114 0.19126E-08 -8.7184 0.62086E+00 -0.2070 107 FeOH+ 0.76459E-09 -9.1166 0.47471E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.50769E-08 -8.2944 0.46072E-08 -8.3366 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11465E-08 -8.9406 0.11465E-08 -8.9406 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26806E-08 -8.5718 0.26806E-08 -8.5718 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33111E-05 -5.4800 0.20557E-05 -5.6870 0.62086E+00 -0.2070 120 MgCl+ 0.93804E-05 -5.0278 0.58240E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91887E-09 -9.0367 0.57050E-09 -9.2437 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97733E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11694E-08 -8.9320 0.72602E-09 -9.1390 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46266E-04 -4.3347 0.46266E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33690E-07 -7.4725 0.33690E-07 -7.4725 0.10000E+01 0.0000 137 OH- 0.18390E-06 -6.7354 0.11306E-06 -6.9467 0.61480E+00 -0.2113 140 PbCl+ 0.20724E-06 -6.6835 0.12867E-06 -6.8905 0.62086E+00 -0.2070 141 PbCl2,aq 0.34960E-06 -6.4564 0.34960E-06 -6.4564 0.10000E+01 0.0000 142 PbCl3- 0.12005E-06 -6.9206 0.74031E-07 -7.1306 0.61667E+00 -0.2099 143 PbCl4-2 0.67371E-07 -7.1715 0.81887E-08 -8.0868 0.12155E+00 -0.9153 144 PbF+ 0.45443E-09 -9.3425 0.28214E-09 -9.5495 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.73763E-09 -9.1322 0.73763E-09 -9.1322 0.10000E+01 0.0000 150 H2S,aq 0.64805E-05 -5.1884 0.58810E-05 -5.2306 0.90748E+00 -0.0422 159 HSO4- 0.23167E-06 -6.6351 0.14513E-06 -6.8382 0.62647E+00 -0.2031 173 ZnCl+ 0.29615E-05 -5.5285 0.18387E-05 -5.7355 0.62086E+00 -0.2070 174 ZnCl2,aq 0.45113E-06 -6.3457 0.45113E-06 -6.3457 0.10000E+01 0.0000 175 ZnCl3- 0.44371E-07 -7.3529 0.27362E-07 -7.5628 0.61667E+00 -0.2099 176 ZnF+ 0.62521E-09 -9.2040 0.38817E-09 -9.4110 0.62086E+00 -0.2070 178 ZnOH+ 0.50339E-07 -7.2981 0.31254E-07 -7.5051 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1836652E-04 0.1615268E+00 0.1544866E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461189E+06 0.0000 3 Cl- 0.7076023E+00 0.7717765E+00 0.2596307E+05 4.5795 4 SO4-- 0.8912309E-04 0.9420483E-04 0.8586863E+01 4.9196 5 HCO3- 0.1330942E-01 0.1747549E+00 0.1011796E+05 2.8570 6 HS- 0.3516315E-06 0.6839287E-05 0.2146262E+00 -1.7239 7 H4SiO4 0.1402178E-02 0.1403591E-02 0.1280103E+03 -2.8532 8 Al+++ 0.4557975E-11 0.3626531E-08 0.9284724E-04 1.3997 9 Ca++ 0.8667947E-03 0.1051354E-02 0.3998217E+02 5.8821 10 Mg++ 0.7272229E-04 0.8578356E-04 0.1978957E+01 4.7947 11 Fe++ 0.6835100E-06 0.7841476E-06 0.4155365E-01 2.7703 12 K+ 0.2257024E-01 0.2270089E-01 0.8422741E+03 3.0856 13 Na+ 0.6970667E+00 0.7609886E+00 0.1660064E+05 4.5706 14 Mn++ 0.1031864E-04 0.1721796E-04 0.8975652E+00 3.9511 15 Zn++ 0.2216396E-06 0.3729625E-05 0.2313424E+00 2.2812 16 Cu+ 0.1163793E-12 0.2242593E-08 0.1352101E-03 -8.2069 17 Pb++ 0.3611745E-07 0.7815751E-06 0.1536565E+00 1.5100 18 Ag+ 0.3715660E-12 0.6578622E-08 0.6733597E-03 -7.6989 19 Au+ 0.2600623E-23 0.1553621E-11 0.2903689E-06 -18.8522 20 Ba++ 0.1551084E-05 0.2029771E-05 0.2645182E+00 3.1485 21 F- 0.7275711E-03 0.8130271E-03 0.1465630E+02 1.5907 22 H2AsO3- 0.4814228E-07 0.6474253E-04 0.7675165E+01 -2.5417 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234403E+00 -.5102270E-05 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1656666E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4141664E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.1369494E-04 0.3353692E-06 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200009E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7261741E-08 0.2400017E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570172E-05 0.3313331E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.7468176E-05 0.0000000E+00 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4490553E-08 0.1656666E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1565021E-05 0.0000000E+00 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1317299E-07 0.4139551E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400017E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2070E-06 -6.684 0.5129E-04 -4.290 17.76 0.7203E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 76.48 0.6183E-04 bornite 0.3313E-07 -7.480 0.1663E-04 -4.779 5.758 0.3271E-05 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.000289 g Volume = 0.000072 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2937E+03 GOLD Q/K: 0.1243 SILVER Q/K: 0.0739 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3071 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8133 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.1142E-07 1.0325 0.4399E-06 0.4260E-06 H2,gas 0.2187E-06 1.0193 0.8318E-05 0.8161E-05 H2S,gas 0.9069E-05 0.8805 0.2979E-03 0.3383E-03 S2,gas 0.1053E-16 1.0000 0.3929E-15 0.3929E-15 CO,gas 0.1497E-08 1.0000 0.5584E-07 0.5584E-07 SO3,gas 0.3203E-30 1.0000 0.1195E-28 0.1195E-28 O2,gas 0.6274E-51 1.0000 0.2341E-49 0.2341E-49 SO2,gas 0.8540E-14 1.0000 0.3186E-12 0.3186E-12 HF,gas 0.5296E-08 1.0000 0.1976E-06 0.1976E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 -0.63059E-11 206 bornite -85.08 -85.08 0.00 0.000 0.50448E-10 226 topaz -16.63 -16.63 0.00 0.000 -0.63059E-11 261 galena -11.59 -10.09 1.50 0.499 -0.26551E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -3.80 -9.06 -2.264 0.16073E+05 -6.357 4 H2,gas 8.58 0.80 -7.78 -4.445 0.13807E+05 -5.080 5 H2S,gas -5.38 -11.60 -6.22 -3.112 0.11049E+05 -3.526 6 S2,gas -6.70 -24.80 -18.10 -2.785 0.32135E+05 -15.406 7 CO,gas 3.75 -6.20 -9.95 -3.062 0.17664E+05 -7.253 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.923 9 O2,gas 50.71 -1.62 -52.33 -34.886 0.92883E+05 -49.631 10 SO2,gas 1.18 -14.02 -15.20 -4.052 0.26972E+05 -12.497 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56596E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38765E+04 22 analcite 3.18 0.28 -2.90 -0.322 0.51508E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77174E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57754E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36802E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34350E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83404E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19950E+04 66 diamond -2.94 -5.39 -2.45 -0.700 0.43510E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67521E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41094E+04 86 goethite 6.14 2.35 -3.79 -0.819 0.67260E+04 87 graphite -3.37 -5.39 -2.03 -0.579 0.35995E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65361E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22524E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74563E+04 107 magnesite 0.56 -2.23 -2.79 -0.929 0.49490E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30046E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57540E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58889E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85317E+04 143 pyrite -20.64 -21.23 -0.59 -0.139 0.10470E+04 144 pyrrhotite -4.24 -8.83 -4.59 -1.531 0.81516E+04 145 pyrrhotiteFe0.875 -5.92 -9.28 -3.36 -1.234 0.59571E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40927E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37105E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50711E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29298E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81343E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75031E+04 171 sulfur -8.90 -12.40 -3.50 -1.077 0.62143E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71519E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -8.83 -4.46 -1.486 0.79127E+04 198 arsenic -6.91 -11.19 -4.28 -1.105 0.75976E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74514E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.288 0.80238E+04 203 beidellite-K -1.84 -6.16 -4.32 -0.265 0.76763E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74302E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70851E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -28.02 -1.37 -0.343 0.24378E+04 211 covellite -19.11 -20.21 -1.10 -0.419 0.19538E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46744E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71672E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72596E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71411E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67493E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73696E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45734E+04 254 cerussite -2.68 -5.51 -2.83 -0.942 0.50184E+04 255 chalcopyrite -27.58 -29.04 -1.46 -0.272 0.25992E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79092E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 262 gold,native -17.55 -18.45 -0.91 -0.315 0.16070E+04 263 silver,native -6.17 -7.30 -1.13 -0.393 0.20077E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -4.74 -3.96 -1.320 0.70268E+04 273 sphalerite -10.05 -9.32 0.73 0.243 -0.12965E+04 274 wurtzite -8.29 -9.32 -1.03 -0.345 0.18346E+04 276 an20ab80 1.85 -1.44 -3.30 -0.253 0.58487E+04 277 an25ab75 2.44 -1.16 -3.60 -0.277 0.63909E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69429E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 9 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705945E+00 Osmotic coef. = 0.9306 True ionic strength = .7228347E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18369E-04 -4.7359 0.11491E-04 -4.9396 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70760E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13308E-01 -1.8759 0.82663E-02 -2.0827 0.62116E+00 -0.2068 6 HS- 0.31291E-06 -6.5046 0.19308E-06 -6.7143 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45591E-11 -11.3411 0.38082E-13 -13.4193 0.83530E-02 -2.0782 9 Ca++ 0.86680E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72723E-04 -4.1383 0.82291E-05 -5.0847 0.11316E+00 -0.9463 11 Fe++ 0.68355E-06 -6.1652 0.77794E-07 -7.1091 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.22164E-06 -6.6544 0.25225E-07 -7.5982 0.11381E+00 -0.9438 16 Cu+ 0.12740E-12 -12.8948 0.78104E-13 -13.1073 0.61306E+00 -0.2125 17 Pb++ 0.12960E-08 -8.8874 0.15329E-09 -9.8145 0.11828E+00 -0.9271 18 Ag+ 0.39391E-12 -12.4046 0.24366E-12 -12.6132 0.61856E+00 -0.2086 19 Au+ 0.29230E-23 -23.5342 0.18148E-23 -23.7412 0.62086E+00 -0.2070 20 Ba++ 0.15511E-05 -5.8094 0.18586E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72757E-03 -3.1381 0.44775E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48137E-07 -7.3175 0.33005E-07 -7.4814 0.68565E+00 -0.1639 24 HSiO3- 0.33894E-06 -6.4699 0.20901E-06 -6.6798 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.87007E-09 -9.0604 0.54019E-09 -9.2675 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82811E-10 -10.0819 0.51414E-10 -10.2889 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10726E-05 -5.9695 0.10726E-05 -5.9695 0.10000E+01 0.0000 31 AgCl,aq 0.65083E-10 -10.1865 0.65083E-10 -10.1865 0.10000E+01 0.0000 32 AgCl2- 0.18623E-08 -8.7299 0.11485E-08 -8.9399 0.61667E+00 -0.2099 33 AgCl3-2 0.58488E-09 -9.2329 0.71090E-10 -10.1482 0.12155E+00 -0.9153 34 AgCl4-3 0.27962E-10 -10.5534 0.24521E-12 -12.6105 0.87694E-02 -2.0570 38 Ag(HS),aq 0.39448E-08 -8.4040 0.39448E-08 -8.4040 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81312E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26046E-10 -10.5843 0.29943E-11 -11.5237 0.11496E+00 -0.9395 42 HAlO2,aq 0.23181E-08 -8.6349 0.23181E-08 -8.6349 0.10000E+01 0.0000 43 AlO2- 0.11463E-08 -8.9407 0.70474E-09 -9.1520 0.61480E+00 -0.2113 44 AsO2- 0.25007E-07 -7.6019 0.15421E-07 -7.8119 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67175E-10 -10.1728 0.67175E-10 -10.1728 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22591E-06 -6.6461 0.14121E-06 -6.8501 0.62508E+00 -0.2041 64 BaCl+ 0.25233E-06 -6.5980 0.15666E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36291E-09 -9.4402 0.22531E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.15717E-09 -9.8036 0.14262E-09 -9.8458 0.90748E+00 -0.0422 71 CO,aq 0.23202E-10 -10.6345 0.23202E-10 -10.6345 0.10000E+01 0.0000 72 CO2,aq 0.16140E+00 -0.7921 0.14647E+00 -0.8343 0.90748E+00 -0.0422 73 CO3-2 0.82111E-06 -6.0856 0.99803E-07 -7.0009 0.12155E+00 -0.9153 74 CaCO3,aq 0.14971E-06 -6.8248 0.14971E-06 -6.8248 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39967E-04 -4.3983 0.24814E-04 -4.6053 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84139E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72809E-05 -5.1378 0.72809E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22663E-08 -8.6447 0.14071E-08 -8.8517 0.62086E+00 -0.2070 80 CaSO4,aq 0.37650E-06 -6.4242 0.37650E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12566E-05 -5.9008 0.12566E-05 -5.9008 0.10000E+01 0.0000 90 CuCl,aq 0.17753E-09 -9.7507 0.17753E-09 -9.7507 0.10000E+01 0.0000 91 CuCl2- 0.20398E-08 -8.6904 0.12579E-08 -8.9004 0.61667E+00 -0.2099 92 CuCl3-2 0.23748E-09 -9.6244 0.28865E-10 -10.5396 0.12155E+00 -0.9153 98 HF,aq 0.37532E-04 -4.4256 0.37532E-04 -4.4256 0.10000E+01 0.0000 99 HF2- 0.80111E-08 -8.0963 0.49402E-08 -8.3063 0.61667E+00 -0.2099 101 FeCl+ 0.96795E-07 -7.0141 0.60097E-07 -7.2212 0.62086E+00 -0.2070 104 FeF+ 0.30807E-08 -8.5114 0.19127E-08 -8.7184 0.62086E+00 -0.2070 107 FeOH+ 0.76454E-09 -9.1166 0.47468E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.49308E-08 -8.3071 0.44746E-08 -8.3492 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11464E-08 -8.9407 0.11464E-08 -8.9407 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26801E-08 -8.5719 0.26801E-08 -8.5719 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33107E-05 -5.4801 0.20555E-05 -5.6871 0.62086E+00 -0.2070 120 MgCl+ 0.93805E-05 -5.0278 0.58240E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91877E-09 -9.0368 0.57043E-09 -9.2438 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97732E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11692E-08 -8.9321 0.72594E-09 -9.1391 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46266E-04 -4.3347 0.46266E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33686E-07 -7.4726 0.33686E-07 -7.4726 0.10000E+01 0.0000 137 OH- 0.18388E-06 -6.7355 0.11305E-06 -6.9467 0.61480E+00 -0.2113 140 PbCl+ 0.74363E-08 -8.1286 0.46169E-08 -8.3356 0.62086E+00 -0.2070 141 PbCl2,aq 0.12545E-07 -7.9015 0.12545E-07 -7.9015 0.10000E+01 0.0000 142 PbCl3- 0.43078E-08 -8.3657 0.26565E-08 -8.5757 0.61667E+00 -0.2099 143 PbCl4-2 0.24175E-08 -8.6166 0.29384E-09 -9.5319 0.12155E+00 -0.9153 144 PbF+ 0.16306E-10 -10.7876 0.10124E-10 -10.9947 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.20960E-10 -10.6786 0.20960E-10 -10.6786 0.10000E+01 0.0000 150 H2S,aq 0.57676E-05 -5.2390 0.52339E-05 -5.2812 0.90748E+00 -0.0422 159 HSO4- 0.23170E-06 -6.6351 0.14515E-06 -6.8382 0.62647E+00 -0.2031 173 ZnCl+ 0.29615E-05 -5.5285 0.18387E-05 -5.7355 0.62086E+00 -0.2070 174 ZnCl2,aq 0.45114E-06 -6.3457 0.45114E-06 -6.3457 0.10000E+01 0.0000 175 ZnCl3- 0.44371E-07 -7.3529 0.27362E-07 -7.5628 0.61667E+00 -0.2099 176 ZnF+ 0.62521E-09 -9.2040 0.38817E-09 -9.4110 0.62086E+00 -0.2070 178 ZnOH+ 0.50333E-07 -7.2981 0.31250E-07 -7.5052 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1836869E-04 0.1615276E+00 0.1544874E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461190E+06 0.0000 3 Cl- 0.7076037E+00 0.7717765E+00 0.2596308E+05 4.5795 4 SO4-- 0.8912301E-04 0.9420484E-04 0.8586864E+01 4.9195 5 HCO3- 0.1330797E-01 0.1747549E+00 0.1011797E+05 2.8569 6 HS- 0.3129091E-06 0.6085870E-05 0.1909830E+00 -1.7746 7 H4SiO4 0.1402178E-02 0.1403591E-02 0.1280104E+03 -2.8532 8 Al+++ 0.4559073E-11 0.3626007E-08 0.9283385E-04 1.3996 9 Ca++ 0.8667980E-03 0.1051354E-02 0.3998218E+02 5.8820 10 Mg++ 0.7272257E-04 0.8578356E-04 0.1978957E+01 4.7946 11 Fe++ 0.6835469E-06 0.7841900E-06 0.4155591E-01 2.7702 12 K+ 0.2257024E-01 0.2270089E-01 0.8422742E+03 3.0856 13 Na+ 0.6970665E+00 0.7609885E+00 0.1660064E+05 4.5705 14 Mn++ 0.1031864E-04 0.1721796E-04 0.8975653E+00 3.9510 15 Zn++ 0.2216395E-06 0.3729625E-05 0.2313424E+00 2.2811 16 Cu+ 0.1274000E-12 0.2454968E-08 0.1480147E-03 -8.1677 17 Pb++ 0.1296003E-08 0.2803987E-07 0.5512599E-02 0.0648 18 Ag+ 0.3939095E-12 0.6485938E-08 0.6638730E-03 -7.6736 19 Au+ 0.2922978E-23 0.1553621E-11 0.2903690E-06 -18.8016 20 Ba++ 0.1551102E-05 0.2029771E-05 0.2645183E+00 3.1484 21 F- 0.7275675E-03 0.8130271E-03 0.1465630E+02 1.5907 22 H2AsO3- 0.4813659E-07 0.6474253E-04 0.7675166E+01 -2.5418 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234418E+00 -.6610994E-05 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1652413E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4131033E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.1218630E-04 0.1844006E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200009E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7260693E-08 0.2400018E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570257E-05 0.3304826E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.7468176E-05 0.0000000E+00 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4915812E-08 0.1652413E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.5614685E-07 0.1508874E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1298740E-07 0.4141407E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400018E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2071E-06 -6.684 0.5131E-04 -4.290 7.897 0.7206E-05 bornite 0.3305E-07 -7.481 0.1658E-04 -4.780 2.552 0.3263E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 33.99 0.6183E-04 galena 0.1509E-05 -5.821 0.3610E-03 -3.442 55.56 0.4751E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.000650 g Volume = 0.000120 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2375E+03 GOLD Q/K: 0.1377 SILVER Q/K: 0.0772 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3074 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8132 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.1016E-07 1.0325 0.3914E-06 0.3791E-06 H2,gas 0.2124E-06 1.0193 0.8079E-05 0.7926E-05 H2S,gas 0.8071E-05 0.8805 0.2651E-03 0.3011E-03 S2,gas 0.8843E-17 1.0000 0.3299E-15 0.3299E-15 CO,gas 0.1454E-08 1.0000 0.5424E-07 0.5424E-07 SO3,gas 0.3203E-30 1.0000 0.1195E-28 0.1195E-28 O2,gas 0.6651E-51 1.0000 0.2481E-49 0.2481E-49 SO2,gas 0.8296E-14 1.0000 0.3095E-12 0.3095E-12 HF,gas 0.5297E-08 1.0000 0.1976E-06 0.1976E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.00000E+00 206 bornite -85.08 -85.08 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 -0.63059E-11 261 galena -11.59 -11.59 0.00 0.000 0.00000E+00 273 sphalerite -10.05 -9.37 0.68 0.227 -0.12064E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -3.85 -9.11 -2.277 0.16163E+05 -6.407 4 H2,gas 8.58 0.79 -7.79 -4.452 0.13830E+05 -5.093 5 H2S,gas -5.38 -11.65 -6.28 -3.138 0.11139E+05 -3.577 6 S2,gas -6.70 -24.88 -18.18 -2.797 0.32270E+05 -15.482 7 CO,gas 3.75 -6.21 -9.96 -3.066 0.17687E+05 -7.266 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.923 9 O2,gas 50.71 -1.59 -52.30 -34.870 0.92838E+05 -49.605 10 SO2,gas 1.18 -14.03 -15.21 -4.056 0.26994E+05 -12.509 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56598E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38766E+04 22 analcite 3.18 0.27 -2.90 -0.322 0.51510E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77175E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57757E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36803E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34352E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83405E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19951E+04 66 diamond -2.94 -5.42 -2.48 -0.708 0.43960E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67525E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41095E+04 86 goethite 6.14 2.36 -3.78 -0.818 0.67149E+04 87 graphite -3.37 -5.42 -2.05 -0.587 0.36445E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65363E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22526E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74565E+04 107 magnesite 0.56 -2.23 -2.79 -0.929 0.49492E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30047E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57544E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58892E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85319E+04 143 pyrite -20.64 -21.32 -0.68 -0.160 0.12043E+04 144 pyrrhotite -4.24 -8.88 -4.64 -1.548 0.82416E+04 145 pyrrhotiteFe0.875 -5.92 -9.33 -3.41 -1.252 0.60443E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40928E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37107E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50713E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29300E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81345E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75035E+04 171 sulfur -8.90 -12.44 -3.54 -1.089 0.62817E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71521E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -8.88 -4.51 -1.503 0.80027E+04 198 arsenic -6.91 -11.21 -4.30 -1.110 0.76313E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74517E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.288 0.80240E+04 203 beidellite-K -1.84 -6.16 -4.32 -0.265 0.76766E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74304E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70854E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -27.99 -1.35 -0.336 0.23883E+04 211 covellite -19.11 -20.21 -1.11 -0.421 0.19627E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46746E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71674E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72598E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71413E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67496E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45735E+04 254 cerussite -2.68 -6.96 -4.27 -1.424 0.75836E+04 255 chalcopyrite -27.58 -29.10 -1.52 -0.283 0.26981E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79095E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 262 gold,native -17.55 -18.41 -0.86 -0.299 0.15282E+04 263 silver,native -6.17 -7.28 -1.11 -0.387 0.19740E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -4.74 -3.96 -1.320 0.70270E+04 274 wurtzite -8.29 -9.37 -1.08 -0.361 0.19247E+04 276 an20ab80 1.85 -1.44 -3.30 -0.253 0.58490E+04 277 an25ab75 2.44 -1.16 -3.60 -0.277 0.63911E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69431E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 10 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705884E+00 Osmotic coef. = 0.9306 True ionic strength = .7228320E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18376E-04 -4.7358 0.11496E-04 -4.9395 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70761E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13303E-01 -1.8760 0.82635E-02 -2.0828 0.62116E+00 -0.2068 6 HS- 0.18857E-06 -6.7245 0.11636E-06 -6.9342 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45626E-11 -11.3408 0.38111E-13 -13.4189 0.83531E-02 -2.0782 9 Ca++ 0.86681E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72724E-04 -4.1383 0.82292E-05 -5.0846 0.11316E+00 -0.9463 11 Fe++ 0.68375E-06 -6.1651 0.77818E-07 -7.1089 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.76923E-07 -7.1139 0.87546E-08 -8.0578 0.11381E+00 -0.9438 16 Cu+ 0.18866E-12 -12.7243 0.11566E-12 -12.9368 0.61306E+00 -0.2125 17 Pb++ 0.21513E-08 -8.6673 0.25446E-09 -9.5944 0.11828E+00 -0.9271 18 Ag+ 0.50751E-12 -12.2946 0.31393E-12 -12.5032 0.61856E+00 -0.2086 19 Au+ 0.48474E-23 -23.3145 0.30096E-23 -23.5215 0.62086E+00 -0.2070 20 Ba++ 0.15512E-05 -5.8093 0.18587E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72756E-03 -3.1381 0.44774E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48118E-07 -7.3177 0.32992E-07 -7.4816 0.68565E+00 -0.1639 24 HSiO3- 0.33881E-06 -6.4700 0.20894E-06 -6.6800 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.86975E-09 -9.0606 0.54000E-09 -9.2676 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82781E-10 -10.0821 0.51396E-10 -10.2891 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10722E-05 -5.9697 0.10722E-05 -5.9697 0.10000E+01 0.0000 31 AgCl,aq 0.83853E-10 -10.0765 0.83853E-10 -10.0765 0.10000E+01 0.0000 32 AgCl2- 0.23995E-08 -8.6199 0.14797E-08 -8.8298 0.61667E+00 -0.2099 33 AgCl3-2 0.75357E-09 -9.1229 0.91594E-10 -10.0381 0.12155E+00 -0.9153 34 AgCl4-3 0.36026E-10 -10.4434 0.31593E-12 -12.5004 0.87695E-02 -2.0570 38 Ag(HS),aq 0.30630E-08 -8.5139 0.30630E-08 -8.5139 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81313E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26056E-10 -10.5841 0.29954E-11 -11.5235 0.11496E+00 -0.9395 42 HAlO2,aq 0.23173E-08 -8.6350 0.23173E-08 -8.6350 0.10000E+01 0.0000 43 AlO2- 0.11455E-08 -8.9410 0.70423E-09 -9.1523 0.61480E+00 -0.2113 44 AsO2- 0.24997E-07 -7.6021 0.15415E-07 -7.8121 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67129E-10 -10.1731 0.67129E-10 -10.1731 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22584E-06 -6.6462 0.14116E-06 -6.8503 0.62508E+00 -0.2041 64 BaCl+ 0.25234E-06 -6.5980 0.15667E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36291E-09 -9.4402 0.22532E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.94683E-10 -10.0237 0.85923E-10 -10.0659 0.90748E+00 -0.0422 71 CO,aq 0.20441E-10 -10.6895 0.20441E-10 -10.6895 0.10000E+01 0.0000 72 CO2,aq 0.16141E+00 -0.7921 0.14647E+00 -0.8342 0.90748E+00 -0.0422 73 CO3-2 0.82051E-06 -6.0859 0.99731E-07 -7.0012 0.12155E+00 -0.9153 74 CaCO3,aq 0.14960E-06 -6.8251 0.14960E-06 -6.8251 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39954E-04 -4.3984 0.24806E-04 -4.6054 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84140E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72810E-05 -5.1378 0.72810E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22655E-08 -8.6448 0.14066E-08 -8.8518 0.62086E+00 -0.2070 80 CaSO4,aq 0.37651E-06 -6.4242 0.37651E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12571E-05 -5.9006 0.12571E-05 -5.9006 0.10000E+01 0.0000 90 CuCl,aq 0.26291E-09 -9.5802 0.26291E-09 -9.5802 0.10000E+01 0.0000 91 CuCl2- 0.30207E-08 -8.5199 0.18628E-08 -8.7298 0.61667E+00 -0.2099 92 CuCl3-2 0.35169E-09 -9.4538 0.42746E-10 -10.3691 0.12155E+00 -0.9153 98 HF,aq 0.37546E-04 -4.4254 0.37546E-04 -4.4254 0.10000E+01 0.0000 99 HF2- 0.80138E-08 -8.0962 0.49419E-08 -8.3061 0.61667E+00 -0.2099 101 FeCl+ 0.96825E-07 -7.0140 0.60115E-07 -7.2210 0.62086E+00 -0.2070 104 FeF+ 0.30816E-08 -8.5112 0.19132E-08 -8.7182 0.62086E+00 -0.2070 107 FeOH+ 0.76449E-09 -9.1166 0.47464E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.43441E-08 -8.3621 0.39421E-08 -8.4043 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11459E-08 -8.9408 0.11459E-08 -8.9408 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26781E-08 -8.5722 0.26781E-08 -8.5722 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33096E-05 -5.4802 0.20548E-05 -5.6872 0.62086E+00 -0.2070 120 MgCl+ 0.93806E-05 -5.0278 0.58241E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91844E-09 -9.0370 0.57022E-09 -9.2440 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97731E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11688E-08 -8.9323 0.72566E-09 -9.1393 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46265E-04 -4.3347 0.46265E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33673E-07 -7.4727 0.33673E-07 -7.4727 0.10000E+01 0.0000 137 OH- 0.18381E-06 -6.7356 0.11300E-06 -6.9469 0.61480E+00 -0.2113 140 PbCl+ 0.12344E-07 -7.9085 0.76640E-08 -8.1155 0.62086E+00 -0.2070 141 PbCl2,aq 0.20824E-07 -7.6814 0.20824E-07 -7.6814 0.10000E+01 0.0000 142 PbCl3- 0.71508E-08 -8.1456 0.44097E-08 -8.3556 0.61667E+00 -0.2099 143 PbCl4-2 0.40130E-08 -8.3965 0.48777E-09 -9.3118 0.12155E+00 -0.9153 144 PbF+ 0.27067E-10 -10.5676 0.16805E-10 -10.7746 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.12636E-10 -10.8984 0.12636E-10 -10.8984 0.10000E+01 0.0000 150 H2S,aq 0.34771E-05 -5.4588 0.31554E-05 -5.5009 0.90748E+00 -0.0422 159 HSO4- 0.23178E-06 -6.6349 0.14521E-06 -6.8380 0.62647E+00 -0.2031 173 ZnCl+ 0.10278E-05 -5.9881 0.63815E-06 -6.1951 0.62086E+00 -0.2070 174 ZnCl2,aq 0.15657E-06 -6.8053 0.15657E-06 -6.8053 0.10000E+01 0.0000 175 ZnCl3- 0.15400E-07 -7.8125 0.94966E-08 -8.0224 0.61667E+00 -0.2099 176 ZnF+ 0.21698E-09 -9.6636 0.13472E-09 -9.8706 0.62086E+00 -0.2070 178 ZnOH+ 0.17462E-07 -7.7579 0.10842E-07 -7.9649 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1837562E-04 0.1615300E+00 0.1544897E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461192E+06 0.0000 3 Cl- 0.7076060E+00 0.7717764E+00 0.2596308E+05 4.5793 4 SO4-- 0.8912274E-04 0.9420486E-04 0.8586869E+01 4.9192 5 HCO3- 0.1330333E-01 0.1747549E+00 0.1011797E+05 2.8566 6 HS- 0.1885742E-06 0.3669982E-05 0.1151691E+00 -1.9947 7 H4SiO4 0.1402179E-02 0.1403591E-02 0.1280104E+03 -2.8532 8 Al+++ 0.4562571E-11 0.3624343E-08 0.9279127E-04 1.3994 9 Ca++ 0.8668089E-03 0.1051354E-02 0.3998219E+02 5.8817 10 Mg++ 0.7272351E-04 0.8578355E-04 0.1978957E+01 4.7943 11 Fe++ 0.6837525E-06 0.7844261E-06 0.4156843E-01 2.7700 12 K+ 0.2257024E-01 0.2270089E-01 0.8422744E+03 3.0854 13 Na+ 0.6970663E+00 0.7609885E+00 0.1660065E+05 4.5704 14 Mn++ 0.1031861E-04 0.1721796E-04 0.8975655E+00 3.9507 15 Zn++ 0.7692280E-07 0.1294414E-05 0.8029036E-01 1.8212 16 Cu+ 0.1886634E-12 0.3635524E-08 0.2191926E-03 -7.9973 17 Pb++ 0.2151319E-08 0.4652342E-07 0.9146441E-02 0.2845 18 Ag+ 0.5075119E-12 0.6336580E-08 0.6485857E-03 -7.5637 19 Au+ 0.4847442E-23 0.1553621E-11 0.2903690E-06 -18.5820 20 Ba++ 0.1551161E-05 0.2029771E-05 0.2645183E+00 3.1481 21 F- 0.7275551E-03 0.8130270E-03 0.1465631E+02 1.5905 22 H2AsO3- 0.4811845E-07 0.6474252E-04 0.7675168E+01 -2.5421 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234466E+00 -.1144903E-04 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1628774E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886352E-03 0.4071934E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7348748E-05 0.6681563E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200011E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7257361E-08 0.2400022E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570730E-05 0.3257548E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2591926E-05 0.4876250E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.7279749E-08 0.1628774E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.9315819E-07 0.1471862E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1268833E-07 0.4144398E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400022E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2118E-20 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2072E-06 -6.684 0.5135E-04 -4.289 4.602 0.7211E-05 bornite 0.3258E-07 -7.487 0.1635E-04 -4.787 1.465 0.3216E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 19.79 0.6183E-04 galena 0.1472E-05 -5.832 0.3521E-03 -3.453 31.56 0.4635E-04 sphalerite 0.4876E-05 -5.312 0.4751E-03 -3.323 42.58 0.1162E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.001116 g Volume = 0.000235 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: -.5995E+01 GOLD Q/K: 0.2143 SILVER Q/K: 0.0934 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3084 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8132 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.6121E-08 1.0325 0.2358E-06 0.2284E-06 H2,gas 0.1872E-06 1.0193 0.7118E-05 0.6983E-05 H2S,gas 0.4866E-05 0.8805 0.1598E-03 0.1815E-03 S2,gas 0.4141E-17 1.0000 0.1545E-15 0.1545E-15 CO,gas 0.1281E-08 1.0000 0.4778E-07 0.4778E-07 SO3,gas 0.3206E-30 1.0000 0.1196E-28 0.1196E-28 O2,gas 0.8569E-51 1.0000 0.3197E-49 0.3197E-49 SO2,gas 0.7314E-14 1.0000 0.2729E-12 0.2729E-12 HF,gas 0.5298E-08 1.0000 0.1977E-06 0.1977E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.00000E+00 206 bornite -85.08 -85.08 0.00 0.000 0.25224E-10 226 topaz -16.63 -16.63 0.00 0.000 -0.63059E-11 261 galena -11.59 -11.59 0.00 0.000 0.00000E+00 273 sphalerite -10.05 -10.05 0.00 0.000 0.00000E+00 262 gold,native -17.55 -18.22 -0.67 -0.233 0.11874E+04 263 silver,native -6.17 -7.20 -1.03 -0.358 0.18278E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -4.07 -9.33 -2.332 0.16554E+05 -6.627 4 H2,gas 8.58 0.73 -7.85 -4.484 0.13928E+05 -5.148 5 H2S,gas -5.38 -11.87 -6.50 -3.248 0.11529E+05 -3.796 6 S2,gas -6.70 -25.21 -18.51 -2.848 0.32855E+05 -15.811 7 CO,gas 3.75 -6.27 -10.02 -3.083 0.17785E+05 -7.321 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.922 9 O2,gas 50.71 -1.48 -52.19 -34.796 0.92643E+05 -49.495 10 SO2,gas 1.18 -14.09 -15.26 -4.070 0.27091E+05 -12.564 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56603E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38772E+04 22 analcite 3.18 0.27 -2.90 -0.322 0.51515E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77181E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57766E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36809E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34357E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83411E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19954E+04 66 diamond -2.94 -5.53 -2.59 -0.739 0.45913E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67535E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41098E+04 86 goethite 6.14 2.38 -3.76 -0.812 0.66664E+04 87 graphite -3.37 -5.53 -2.16 -0.618 0.38398E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65368E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22532E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74570E+04 107 magnesite 0.56 -2.23 -2.79 -0.930 0.49497E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30053E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57555E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58904E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85324E+04 143 pyrite -20.64 -21.71 -1.06 -0.250 0.18872E+04 144 pyrrhotite -4.24 -9.10 -4.86 -1.621 0.86320E+04 145 pyrrhotiteFe0.875 -5.92 -9.54 -3.62 -1.331 0.64226E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40934E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37112E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50719E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29303E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81350E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75046E+04 171 sulfur -8.90 -12.60 -3.70 -1.140 0.65741E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71527E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -9.10 -4.73 -1.576 0.83932E+04 196 akaganeite 7.38 2.38 -5.00 -1.081 0.88707E+04 198 arsenic -6.91 -11.29 -4.38 -1.131 0.77778E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74524E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.289 0.80247E+04 203 beidellite-K -1.84 -6.16 -4.33 -0.265 0.76773E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74311E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70861E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -27.87 -1.22 -0.306 0.21736E+04 211 covellite -19.11 -20.24 -1.13 -0.430 0.20016E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46752E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71681E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72605E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71421E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67503E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45738E+04 254 cerussite -2.68 -6.74 -4.05 -1.351 0.71935E+04 255 chalcopyrite -27.58 -29.34 -1.76 -0.328 0.31275E+04 257 copper,native -2.74 -7.63 -4.89 -1.702 0.86845E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79106E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -5.20 -4.42 -1.473 0.78433E+04 274 wurtzite -8.29 -10.05 -1.76 -0.588 0.31311E+04 276 an20ab80 1.85 -1.44 -3.30 -0.254 0.58496E+04 277 an25ab75 2.44 -1.17 -3.60 -0.277 0.63918E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69439E+04 gold,native MINTRY= -0.967E-12 mineral removed from matrix silver,native Not in solid solution anymore ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 19 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9745 Stoichiometric ionic strength = .8709265E+00 Osmotic coef. = 0.9307 True ionic strength = .7230276E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.17398E-04 -4.7595 0.10884E-04 -4.9632 0.62559E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70735E+00 -0.1504 0.43620E+00 -0.3603 0.61667E+00 -0.2099 4 SO4-- 0.59043E-05 -5.2288 0.72679E-06 -6.1386 0.12310E+00 -0.9098 5 HCO3- 0.13991E-01 -1.8542 0.86905E-02 -2.0610 0.62116E+00 -0.2068 6 HS- 0.91618E-09 -9.0380 0.56533E-09 -9.2477 0.61705E+00 -0.2097 7 H4SiO4 0.14021E-02 -2.8532 0.14021E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.40816E-11 -11.3892 0.34084E-13 -13.4675 0.83506E-02 -2.0783 9 Ca++ 0.86545E-03 -3.0628 0.10047E-03 -3.9979 0.11609E+00 -0.9352 10 Mg++ 0.72583E-04 -4.1392 0.82122E-05 -5.0855 0.11314E+00 -0.9464 11 Fe++ 0.72344E-06 -6.1406 0.82324E-07 -7.0845 0.11380E+00 -0.9439 12 K+ 0.22575E-01 -1.6464 0.13996E-01 -1.8540 0.62001E+00 -0.2076 13 Na+ 0.69709E+00 -0.1567 0.42747E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10323E-04 -4.9862 0.11801E-05 -5.9281 0.11431E+00 -0.9419 15 Zn++ 0.14993E-04 -4.8241 0.17061E-05 -5.7680 0.11380E+00 -0.9439 16 Cu+ 0.12011E-10 -10.9204 0.73636E-11 -11.1329 0.61306E+00 -0.2125 17 Pb++ 0.41930E-06 -6.3775 0.49589E-07 -7.3046 0.11827E+00 -0.9271 18 Ag+ 0.70849E-11 -11.1497 0.43824E-11 -11.3583 0.61856E+00 -0.2086 19 Au+ 0.42424E-21 -21.3724 0.26339E-21 -21.5794 0.62086E+00 -0.2070 20 Ba++ 0.15424E-05 -5.8118 0.18479E-06 -6.7333 0.11981E+00 -0.9215 21 F- 0.72931E-03 -3.1371 0.44882E-03 -3.3479 0.61541E+00 -0.2108 22 H2AsO3- 0.50819E-07 -7.2940 0.34844E-07 -7.4579 0.68565E+00 -0.1639 24 HSiO3- 0.35783E-06 -6.4463 0.22066E-06 -6.6563 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.91701E-09 -9.0376 0.56934E-09 -9.2446 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.87246E-10 -10.0593 0.54168E-10 -10.2663 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.11324E-05 -5.9460 0.11324E-05 -5.9460 0.10000E+01 0.0000 31 AgCl,aq 0.11701E-08 -8.9318 0.11701E-08 -8.9318 0.10000E+01 0.0000 32 AgCl2- 0.33472E-07 -7.4753 0.20641E-07 -7.6853 0.61667E+00 -0.2099 33 AgCl3-2 0.10509E-07 -7.9784 0.12772E-08 -8.8937 0.12153E+00 -0.9153 34 AgCl4-3 0.50232E-09 -9.2990 0.44039E-11 -11.3562 0.87670E-02 -2.0572 38 Ag(HS),aq 0.20774E-09 -9.6825 0.20774E-09 -9.6825 0.10000E+01 0.0000 40 AlO+ 0.13066E-09 -9.8839 0.81120E-10 -10.0909 0.62086E+00 -0.2070 41 AlOH+2 0.24615E-10 -10.6088 0.28294E-11 -11.5483 0.11495E+00 -0.9395 42 HAlO2,aq 0.24417E-08 -8.6123 0.24417E-08 -8.6123 0.10000E+01 0.0000 43 AlO2- 0.12747E-08 -8.8946 0.78370E-09 -9.1058 0.61480E+00 -0.2113 44 AsO2- 0.26400E-07 -7.5784 0.16280E-07 -7.7883 0.61667E+00 -0.2099 45 HAsO2,aq 0.24652E-04 -4.6082 0.24652E-04 -4.6082 0.10000E+01 0.0000 46 H3AsO3,aq 0.40014E-04 -4.3978 0.40014E-04 -4.3978 0.10000E+01 0.0000 48 H2AsO4- 0.11995E-10 -10.9210 0.73968E-11 -11.1310 0.61667E+00 -0.2099 62 BaCO3,aq 0.74133E-10 -10.1300 0.74133E-10 -10.1300 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.23614E-06 -6.6268 0.14760E-06 -6.8309 0.62508E+00 -0.2041 64 BaCl+ 0.25080E-06 -6.6007 0.15571E-06 -6.8077 0.62086E+00 -0.2070 65 BaF+ 0.36169E-09 -9.4417 0.22456E-09 -9.6487 0.62086E+00 -0.2070 71 CO,aq 0.10738E-10 -10.9691 0.10738E-10 -10.9691 0.10000E+01 0.0000 72 CO2,aq 0.16072E+00 -0.7939 0.14585E+00 -0.8361 0.90748E+00 -0.0422 73 CO3-2 0.91150E-06 -6.0402 0.11078E-06 -6.9556 0.12153E+00 -0.9153 74 CaCO3,aq 0.16589E-06 -6.7802 0.16589E-06 -6.7802 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.41947E-04 -4.3773 0.26043E-04 -4.5843 0.62086E+00 -0.2070 76 CaCl+ 0.13524E-03 -3.8689 0.83967E-04 -4.0759 0.62086E+00 -0.2070 77 CaCl2,aq 0.72633E-05 -5.1389 0.72633E-05 -5.1389 0.10000E+01 0.0000 78 CaF+ 0.12600E-05 -5.8996 0.78230E-06 -6.1066 0.62086E+00 -0.2070 79 CaOH+ 0.23887E-08 -8.6218 0.14831E-08 -8.8288 0.62086E+00 -0.2070 80 CaSO4,aq 0.24898E-07 -7.6038 0.24898E-07 -7.6038 0.10000E+01 0.0000 81 HCl,aq 0.11898E-05 -5.9245 0.11898E-05 -5.9245 0.10000E+01 0.0000 90 CuCl,aq 0.16732E-07 -7.7765 0.16732E-07 -7.7765 0.10000E+01 0.0000 91 CuCl2- 0.19217E-06 -6.7163 0.11851E-06 -6.9263 0.61667E+00 -0.2099 92 CuCl3-2 0.22368E-07 -7.6504 0.27184E-08 -8.5657 0.12153E+00 -0.9153 98 HF,aq 0.35635E-04 -4.4481 0.35635E-04 -4.4481 0.10000E+01 0.0000 99 HF2- 0.76243E-08 -8.1178 0.47017E-08 -8.3277 0.61667E+00 -0.2099 101 FeCl+ 0.10239E-06 -6.9897 0.63573E-07 -7.1967 0.62086E+00 -0.2070 104 FeF+ 0.32679E-08 -8.4857 0.20289E-08 -8.6927 0.62086E+00 -0.2070 107 FeOH+ 0.85420E-09 -9.0684 0.53034E-09 -9.2754 0.62086E+00 -0.2070 113 H2,aq 0.22918E-08 -8.6398 0.20797E-08 -8.6820 0.90748E+00 -0.0422 114 KCl,aq 0.12616E-03 -3.8991 0.12616E-03 -3.8991 0.10000E+01 0.0000 116 KOH,aq 0.12105E-08 -8.9170 0.12105E-08 -8.9170 0.10000E+01 0.0000 117 KSO4- 0.29620E-06 -6.5284 0.18266E-06 -6.7384 0.61667E+00 -0.2099 118 MgCO3,aq 0.29686E-08 -8.5274 0.29686E-08 -8.5274 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.34735E-05 -5.4592 0.21565E-05 -5.6662 0.62086E+00 -0.2070 120 MgCl+ 0.93578E-05 -5.0288 0.58099E-05 -5.2358 0.62086E+00 -0.2070 121 MgF+ 0.36622E-06 -6.4363 0.22737E-06 -6.6433 0.62086E+00 -0.2070 122 MgOH+ 0.96803E-09 -9.0141 0.60101E-09 -9.2211 0.62086E+00 -0.2070 124 MnF+ 0.15784E-07 -7.8018 0.97997E-08 -8.0088 0.62086E+00 -0.2070 126 MnOH+ 0.12348E-08 -8.9084 0.76666E-09 -9.1154 0.62086E+00 -0.2070 131 MnCl+ 0.68777E-05 -5.1626 0.42701E-05 -5.3696 0.62086E+00 -0.2070 132 MnSO4,aq 0.28436E-09 -9.5461 0.28436E-09 -9.5461 0.10000E+01 0.0000 133 NaCl,aq 0.63854E-01 -1.1948 0.63854E-01 -1.1948 0.10000E+01 0.0000 134 NaF,aq 0.46379E-04 -4.3337 0.46379E-04 -4.3337 0.10000E+01 0.0000 135 NaOH,aq 0.35566E-07 -7.4490 0.35566E-07 -7.4490 0.10000E+01 0.0000 137 OH- 0.19413E-06 -6.7119 0.11935E-06 -6.9232 0.61480E+00 -0.2113 140 PbCl+ 0.24047E-05 -5.6189 0.14930E-05 -5.8259 0.62086E+00 -0.2070 141 PbCl2,aq 0.40552E-05 -5.3920 0.40552E-05 -5.3920 0.10000E+01 0.0000 142 PbCl3- 0.13920E-05 -5.8564 0.85841E-06 -6.0663 0.61667E+00 -0.2099 143 PbCl4-2 0.78100E-06 -6.1074 0.94916E-07 -7.0227 0.12153E+00 -0.9153 144 PbF+ 0.52876E-08 -8.2767 0.32829E-08 -8.4837 0.62086E+00 -0.2070 145 PbF2,aq 0.20655E-10 -10.6850 0.20655E-10 -10.6850 0.10000E+01 0.0000 146 PbO,aq 0.22144E-10 -10.6547 0.22144E-10 -10.6547 0.10000E+01 0.0000 150 H2S,aq 0.15995E-07 -7.7960 0.14515E-07 -7.8382 0.90748E+00 -0.0422 159 HSO4- 0.14537E-07 -7.8375 0.91069E-08 -8.0406 0.62647E+00 -0.2031 173 ZnCl+ 0.20023E-03 -3.6985 0.12432E-03 -3.9055 0.62086E+00 -0.2070 174 ZnCl2,aq 0.30491E-04 -4.5158 0.30491E-04 -4.5158 0.10000E+01 0.0000 175 ZnCl3- 0.29978E-05 -5.5232 0.18486E-05 -5.7331 0.61667E+00 -0.2099 176 ZnF+ 0.42388E-07 -7.3728 0.26317E-07 -7.5798 0.62086E+00 -0.2070 177 ZnO,aq 0.49201E-09 -9.3080 0.49201E-09 -9.3080 0.10000E+01 0.0000 178 ZnOH+ 0.35942E-05 -5.4444 0.22315E-05 -5.6514 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1739837E-04 0.1608309E+00 0.1538179E+03 0.0000 2 H2O 0.1000000E+01 0.5534751E+02 0.9461115E+06 0.0000 3 Cl- 0.7073454E+00 0.7717812E+00 0.2596270E+05 4.6029 4 SO4-- 0.5904278E-05 0.6239615E-05 0.5687355E+00 3.7878 5 HCO3- 0.1399080E-01 0.1747559E+00 0.1011782E+05 2.9022 6 HS- 0.9161753E-09 0.1769922E-07 0.5554146E-03 -4.2845 7 H4SiO4 0.1402108E-02 0.1403600E-02 0.1280085E+03 -2.8532 8 Al+++ 0.4081574E-11 0.3875736E-08 0.9922542E-04 1.4221 9 Ca++ 0.8654528E-03 0.1051360E-02 0.3998161E+02 5.9285 10 Mg++ 0.7258252E-04 0.8578408E-04 0.1978928E+01 4.8409 11 Fe++ 0.7234412E-06 0.8299608E-06 0.4398050E-01 2.8419 12 K+ 0.2257457E-01 0.2270103E-01 0.8422621E+03 3.1092 13 Na+ 0.6970921E+00 0.7609932E+00 0.1660040E+05 4.5941 14 Mn++ 0.1032306E-04 0.1721806E-04 0.8975525E+00 3.9983 15 Zn++ 0.1499262E-04 0.2523494E-03 0.1565249E+02 4.1584 16 Cu+ 0.1201123E-10 0.2312849E-06 0.1394432E-01 -6.1697 17 Pb++ 0.4193034E-06 0.9057617E-05 0.1780678E+01 2.6218 18 Ag+ 0.7084854E-11 0.4586836E-07 0.4694795E-02 -6.3951 19 Au+ 0.4242391E-21 0.1553631E-11 0.2903648E-06 -16.6162 20 Ba++ 0.1542414E-05 0.2029783E-05 0.2645145E+00 3.1931 21 F- 0.7293101E-03 0.8130323E-03 0.1465610E+02 1.6153 22 H2AsO3- 0.5081877E-07 0.6474292E-04 0.7675056E+01 -2.4947 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3220448E+00 0.1390367E-02 0.0000000E+00 2 H2O 0.1108261E+03 0.1108268E+03 -.7045807E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1249409E-04 0.1761452E-03 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.3544058E-07 0.1399487E-04 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1199759E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7760700E-08 0.2399518E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1661898E-05 -.5859268E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.5052996E-03 -.4978314E-03 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4631205E-06 -.2929634E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1813680E-04 -.1657178E-04 0.0000000E+00 18 Ag+ 0.4271281E-06 0.9184593E-07 0.3352822E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2399518E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.2168E-18 Mass of aqueous solution: 0.211030E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.7048E-03 -3.152 0.1746 -0.758 -589.1 0.2453E-01 bornite -.5859E-07 1.000 -.2940E-04 1.000 0.9918E-01 -.5784E-05 topaz 0.1200E-05 -5.921 0.2208E-03 -3.656 -.7448 0.6182E-04 galena -.1657E-04 1.000 -.3965E-02 1.000 13.37 -.5218E-03 sphalerite -.4978E-03 1.000 -.4850E-01 1.000 163.6 -.1186E-01 silver,native -.1409E-02 1.000 -.1520 1.000 512.8 -.1448E-01 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 silver,native 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = -0.029646 g Volume = -0.002279 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.700 AFFINITY: -.2698E+04 GOLD Q/K: 14.3875 SILVER Q/K: 1.0000 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.1442 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6932E-01 0.8140 0.2096E+01 0.2575E+01 CO2,gas 0.9307E+00 0.9145 0.3161E+02 0.3457E+02 CH4,gas 0.4743E-09 1.0324 0.1819E-07 0.1762E-07 H2,gas 0.9918E-07 1.0192 0.3755E-05 0.3684E-05 H2S,gas 0.2247E-07 0.8810 0.7353E-06 0.8346E-06 S2,gas 0.3162E-21 1.0000 0.1175E-19 0.1175E-19 CO,gas 0.6758E-09 1.0000 0.2510E-07 0.2510E-07 SO3,gas 0.1912E-31 1.0000 0.7102E-30 0.7102E-30 O2,gas 0.3092E-50 1.0000 0.1149E-48 0.1149E-48 SO2,gas 0.2301E-15 1.0000 0.8549E-14 0.8549E-14 HF,gas 0.5051E-08 1.0000 0.1876E-06 0.1876E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 -0.12612E-10 263 silver,native -6.17 -6.17 0.00 0.000 0.31530E-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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.400 0.21284E+04 1.500 3 CH4,gas 5.26 -5.18 -10.44 -2.610 0.18529E+05 -7.740 4 H2,gas 8.58 0.45 -8.12 -4.642 0.14420E+05 -5.425 5 H2S,gas -5.38 -14.21 -8.83 -4.416 0.15677E+05 -6.134 6 S2,gas -6.70 -29.33 -22.63 -3.481 0.40166E+05 -19.930 7 CO,gas 3.75 -6.55 -10.30 -3.169 0.18281E+05 -7.600 8 SO3,gas 16.79 -16.05 -32.85 -8.212 0.58303E+05 -30.149 9 O2,gas 50.71 -0.93 -51.64 -34.426 0.91657E+05 -48.940 10 SO2,gas 1.18 -15.59 -16.77 -4.471 0.29761E+05 -14.068 11 HF,gas 1.11 -8.31 -9.43 -4.713 0.16730E+05 -6.727 12 HCl,gas 2.94 -5.32 -8.26 -4.130 0.14661E+05 -8.260 17 albite-high 0.64 -2.50 -3.14 -0.242 0.55780E+04 18 albite -0.36 -2.50 -2.14 -0.164 0.37949E+04 22 analcite 3.18 0.32 -2.86 -0.317 0.50692E+04 23 andalusite 4.28 -0.02 -4.30 -0.430 0.76375E+04 26 anhydrite -5.26 -10.14 -4.88 -2.441 0.86639E+04 27 ankerite -2.14 -5.28 -3.14 -0.523 0.55725E+04 34 aragonite 0.93 -1.10 -2.03 -0.676 0.36012E+04 36 calcite 0.80 -1.10 -1.89 -0.630 0.33561E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.81 -4.65 -0.423 0.82605E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77218E+03 65 diaspore 2.50 1.40 -1.10 -0.184 0.19551E+04 66 diamond -2.94 -6.09 -3.14 -0.898 0.55805E+04 69 dolomite,ordered 0.44 -3.28 -3.72 -0.619 0.65945E+04 83 gibbsite 3.68 1.39 -2.29 -0.328 0.40695E+04 86 goethite 6.14 2.59 -3.54 -0.766 0.62922E+04 87 graphite -3.37 -6.09 -2.72 -0.777 0.48290E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41492E+04 96 jadeite 3.97 0.33 -3.64 -0.364 0.64545E+04 99 kaolinite -1.65 -2.87 -1.22 -0.111 0.21727E+04 100 kyanite 4.14 -0.02 -4.16 -0.416 0.73765E+04 107 magnesite 0.56 -2.18 -2.74 -0.915 0.48703E+04 117 microcline -2.34 -3.98 -1.65 -0.127 0.29229E+04 121 muscovite 1.97 -1.18 -3.15 -0.185 0.55924E+04 122 paragonite 3.53 0.30 -3.23 -0.190 0.57274E+04 123 nepheline 7.92 3.16 -4.76 -0.680 0.84500E+04 147 pyrophyllite -6.26 -8.52 -2.26 -0.141 0.40130E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12812E+02 153 rhodochrosite -0.98 -3.03 -2.05 -0.682 0.36300E+04 155 sanidine -1.17 -3.98 -2.81 -0.216 0.49894E+04 157 siderite -2.60 -4.18 -1.58 -0.527 0.28059E+04 158 sillimanite 4.52 -0.02 -4.54 -0.454 0.80545E+04 165 stilbite -7.03 -11.17 -4.14 -0.197 0.73414E+04 172 sylvite 1.43 -2.21 -3.65 -1.824 0.64734E+04 180 topaz-H 3.95 -0.03 -3.98 -0.362 0.70721E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67483E+03 196 akaganeite 7.38 2.59 -4.79 -1.035 0.84965E+04 198 arsenic -6.91 -11.71 -4.80 -1.238 0.85173E+04 201 beidellite-Ca -2.01 -6.15 -4.14 -0.256 0.73450E+04 202 beidellite-H -2.66 -7.13 -4.47 -0.285 0.79309E+04 203 beidellite-K -1.84 -6.10 -4.26 -0.261 0.75696E+04 204 beidellite-Mg -2.20 -6.33 -4.13 -0.255 0.73238E+04 205 beidellite-Na -1.68 -5.61 -3.93 -0.241 0.69785E+04 206 bornite -85.08 -85.08 0.00 0.000 0.00000E+00 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33174E+03 209 chalcocite -26.64 -26.55 0.09 0.023 -0.16582E+03 211 covellite -19.11 -20.61 -1.50 -0.571 0.26596E+04 212 dawsonite 1.56 -1.03 -2.59 -0.324 0.45960E+04 214 montmorillonite-Ca -2.44 -6.42 -3.98 -0.246 0.70601E+04 215 montmorillonite-K -2.34 -6.37 -4.03 -0.247 0.71522E+04 216 montmorillonite-Mg -2.63 -6.60 -3.96 -0.245 0.70340E+04 217 montmorillonite-Na -2.14 -5.88 -3.74 -0.229 0.66420E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -12.87 -3.68 -1.838 0.65252E+04 253 boehmite 3.95 1.40 -2.55 -0.426 0.45335E+04 254 cerussite -2.68 -4.40 -1.72 -0.572 0.30483E+04 255 chalcopyrite -27.58 -31.98 -4.40 -0.818 0.78064E+04 256 chlorargyrite -7.22 -11.72 -4.49 -2.247 0.79781E+04 257 copper,native -2.74 -5.94 -3.20 -1.114 0.56869E+04 258 dolomite,disordered 1.09 -3.28 -4.37 -0.728 0.77516E+04 260 fluorite -9.68 -10.69 -1.01 -0.337 0.17964E+04 261 galena -11.59 -11.59 0.00 0.000 0.00000E+00 262 gold,native -17.55 -16.39 1.16 0.403 -0.20554E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -2.87 -2.08 -0.694 0.36981E+04 273 sphalerite -10.05 -10.05 0.00 0.000 0.00000E+00 274 wurtzite -8.29 -10.05 -1.76 -0.588 0.31311E+04 275 zincite 7.78 4.15 -3.64 -0.909 0.64543E+04 276 an20ab80 1.85 -1.39 -3.24 -0.249 0.57511E+04 277 an25ab75 2.44 -1.11 -3.54 -0.273 0.62892E+04 278 an30ab70 3.02 -0.83 -3.85 -0.296 0.68372E+04 silver,native MINTRY= -0.600E-05 mineral removed from matrix ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 12 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705965E+00 Osmotic coef. = 0.9306 True ionic strength = .7228352E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18366E-04 -4.7360 0.11490E-04 -4.9397 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70760E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89125E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13310E-01 -1.8758 0.82673E-02 -2.0826 0.62116E+00 -0.2068 6 HS- 0.35493E-06 -6.4499 0.21901E-06 -6.6595 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45579E-11 -11.3412 0.38072E-13 -13.4194 0.83530E-02 -2.0782 9 Ca++ 0.86679E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72722E-04 -4.1383 0.82290E-05 -5.0847 0.11316E+00 -0.9463 11 Fe++ 0.69793E-06 -6.1562 0.79432E-07 -7.1000 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.22164E-06 -6.6544 0.25225E-07 -7.5982 0.11381E+00 -0.9438 16 Cu+ 0.44099E-11 -11.3556 0.27035E-11 -11.5681 0.61306E+00 -0.2125 17 Pb++ 0.36117E-07 -7.4423 0.42719E-08 -8.3694 0.11828E+00 -0.9271 18 Ag+ 0.36983E-12 -12.4320 0.22876E-12 -12.6406 0.61856E+00 -0.2086 19 Au+ 0.25764E-23 -23.5890 0.15996E-23 -23.7960 0.62086E+00 -0.2070 20 Ba++ 0.15511E-05 -5.8094 0.18586E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72757E-03 -3.1381 0.44775E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48143E-07 -7.3175 0.33009E-07 -7.4814 0.68565E+00 -0.1639 24 HSiO3- 0.33898E-06 -6.4698 0.20904E-06 -6.6798 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.87017E-09 -9.0604 0.54026E-09 -9.2674 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82821E-10 -10.0819 0.51420E-10 -10.2889 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10728E-05 -5.9695 0.10728E-05 -5.9695 0.10000E+01 0.0000 31 AgCl,aq 0.61105E-10 -10.2139 0.61105E-10 -10.2139 0.10000E+01 0.0000 32 AgCl2- 0.17485E-08 -8.7573 0.10783E-08 -8.9673 0.61667E+00 -0.2099 33 AgCl3-2 0.54913E-09 -9.2603 0.66745E-10 -10.1756 0.12155E+00 -0.9153 34 AgCl4-3 0.26252E-10 -10.5808 0.23022E-12 -12.6379 0.87694E-02 -2.0570 38 Ag(HS),aq 0.42011E-08 -8.3766 0.42011E-08 -8.3766 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81312E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26043E-10 -10.5843 0.29939E-11 -11.5238 0.11496E+00 -0.9395 42 HAlO2,aq 0.23184E-08 -8.6348 0.23184E-08 -8.6348 0.10000E+01 0.0000 43 AlO2- 0.11466E-08 -8.9406 0.70492E-09 -9.1519 0.61480E+00 -0.2113 44 AsO2- 0.25010E-07 -7.6019 0.15423E-07 -7.8118 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67190E-10 -10.1727 0.67190E-10 -10.1727 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22593E-06 -6.6460 0.14122E-06 -6.8501 0.62508E+00 -0.2041 64 BaCl+ 0.25233E-06 -6.5980 0.15666E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36290E-09 -9.4402 0.22531E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.17829E-09 -9.7489 0.16179E-09 -9.7910 0.90748E+00 -0.0422 71 CO,aq 0.23945E-10 -10.6208 0.23945E-10 -10.6208 0.10000E+01 0.0000 72 CO2,aq 0.16140E+00 -0.7921 0.14647E+00 -0.8343 0.90748E+00 -0.0422 73 CO3-2 0.82131E-06 -6.0855 0.99827E-07 -7.0007 0.12155E+00 -0.9153 74 CaCO3,aq 0.14975E-06 -6.8246 0.14975E-06 -6.8246 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39972E-04 -4.3982 0.24817E-04 -4.6053 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84138E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72808E-05 -5.1378 0.72808E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22666E-08 -8.6446 0.14072E-08 -8.8516 0.62086E+00 -0.2070 80 CaSO4,aq 0.37651E-06 -6.4242 0.37651E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12565E-05 -5.9009 0.12565E-05 -5.9009 0.10000E+01 0.0000 90 CuCl,aq 0.61452E-08 -8.2115 0.61452E-08 -8.2115 0.10000E+01 0.0000 91 CuCl2- 0.70607E-07 -7.1512 0.43541E-07 -7.3611 0.61667E+00 -0.2099 92 CuCl3-2 0.82203E-08 -8.0851 0.99915E-09 -9.0004 0.12155E+00 -0.9153 98 HF,aq 0.37528E-04 -4.4256 0.37528E-04 -4.4256 0.10000E+01 0.0000 99 HF2- 0.80101E-08 -8.0964 0.49396E-08 -8.3063 0.61667E+00 -0.2099 101 FeCl+ 0.98832E-07 -7.0051 0.61361E-07 -7.2121 0.62086E+00 -0.2070 104 FeF+ 0.31455E-08 -8.5023 0.19529E-08 -8.7093 0.62086E+00 -0.2070 107 FeOH+ 0.78073E-09 -9.1075 0.48473E-09 -9.3145 0.62086E+00 -0.2070 113 H2,aq 0.50888E-08 -8.2934 0.46180E-08 -8.3356 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11465E-08 -8.9406 0.11465E-08 -8.9406 0.10000E+01 0.0000 117 KSO4- 0.44708E-05 -5.3496 0.27570E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26807E-08 -8.5718 0.26807E-08 -8.5718 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33111E-05 -5.4800 0.20557E-05 -5.6870 0.62086E+00 -0.2070 120 MgCl+ 0.93804E-05 -5.0278 0.58240E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91888E-09 -9.0367 0.57050E-09 -9.2437 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97733E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11694E-08 -8.9320 0.72603E-09 -9.1390 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42916E-08 -8.3674 0.42916E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46266E-04 -4.3347 0.46266E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33690E-07 -7.4725 0.33690E-07 -7.4725 0.10000E+01 0.0000 137 OH- 0.18390E-06 -6.7354 0.11306E-06 -6.9467 0.61480E+00 -0.2113 140 PbCl+ 0.20723E-06 -6.6835 0.12866E-06 -6.8905 0.62086E+00 -0.2070 141 PbCl2,aq 0.34960E-06 -6.4564 0.34960E-06 -6.4564 0.10000E+01 0.0000 142 PbCl3- 0.12005E-06 -6.9206 0.74029E-07 -7.1306 0.61667E+00 -0.2099 143 PbCl4-2 0.67370E-07 -7.1715 0.81885E-08 -8.0868 0.12155E+00 -0.9153 144 PbF+ 0.45442E-09 -9.3425 0.28213E-09 -9.5495 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.75153E-09 -9.1241 0.75153E-09 -9.1241 0.10000E+01 0.0000 150 H2S,aq 0.65413E-05 -5.1843 0.59361E-05 -5.2265 0.90748E+00 -0.0422 159 HSO4- 0.23167E-06 -6.6351 0.14514E-06 -6.8382 0.62647E+00 -0.2031 173 ZnCl+ 0.29615E-05 -5.5285 0.18387E-05 -5.7355 0.62086E+00 -0.2070 174 ZnCl2,aq 0.45113E-06 -6.3457 0.45113E-06 -6.3457 0.10000E+01 0.0000 175 ZnCl3- 0.44371E-07 -7.3529 0.27362E-07 -7.5628 0.61667E+00 -0.2099 176 ZnF+ 0.62521E-09 -9.2040 0.38817E-09 -9.4110 0.62086E+00 -0.2070 178 ZnOH+ 0.50340E-07 -7.2981 0.31254E-07 -7.5051 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1836636E-04 0.1615268E+00 0.1544866E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461189E+06 0.0000 3 Cl- 0.7076022E+00 0.7717765E+00 0.2596307E+05 4.5795 4 SO4-- 0.8912505E-04 0.9420690E-04 0.8587051E+01 4.9197 5 HCO3- 0.1330953E-01 0.1747549E+00 0.1011796E+05 2.8570 6 HS- 0.3549320E-06 0.6903410E-05 0.2166385E+00 -1.7199 7 H4SiO4 0.1402178E-02 0.1403591E-02 0.1280103E+03 -2.8532 8 Al+++ 0.4557894E-11 0.3626570E-08 0.9284823E-04 1.3997 9 Ca++ 0.8667945E-03 0.1051354E-02 0.3998217E+02 5.8821 10 Mg++ 0.7272227E-04 0.8578356E-04 0.1978956E+01 4.7947 11 Fe++ 0.6979332E-06 0.8006944E-06 0.4243050E-01 2.7794 12 K+ 0.2257024E-01 0.2270089E-01 0.8422741E+03 3.0856 13 Na+ 0.6970667E+00 0.7609886E+00 0.1660064E+05 4.5706 14 Mn++ 0.1031865E-04 0.1721796E-04 0.8975652E+00 3.9511 15 Zn++ 0.2216397E-06 0.3729625E-05 0.2313424E+00 2.2812 16 Cu+ 0.4409875E-11 0.8497688E-07 0.5123414E-02 -6.6284 17 Pb++ 0.3611683E-07 0.7815751E-06 0.1536565E+00 1.5100 18 Ag+ 0.3698328E-12 0.6587009E-08 0.6742182E-03 -7.7009 19 Au+ 0.2576389E-23 0.1553621E-11 0.2903689E-06 -18.8563 20 Ba++ 0.1551082E-05 0.2029771E-05 0.2645182E+00 3.1485 21 F- 0.7275714E-03 0.8130271E-03 0.1465630E+02 1.5907 22 H2AsO3- 0.4814270E-07 0.6474253E-04 0.7675165E+01 -2.5417 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234402E+00 -.5007003E-05 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 0.0000000E+00 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886393E-03 0.0000000E+00 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.1382334E-04 0.2069692E-06 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200009E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7261819E-08 0.2400017E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1603305E-05 0.0000000E+00 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.7468176E-05 0.0000000E+00 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1701571E-06 0.0000000E+00 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1565021E-05 0.0000000E+00 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1318978E-07 0.4139383E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400017E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2070E-06 -6.684 0.5129E-04 -4.290 18.85 0.7202E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 81.15 0.6183E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.000272 g Volume = 0.000069 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2982E+03 GOLD Q/K: 0.1233 SILVER Q/K: 0.0737 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3071 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8133 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.1153E-07 1.0325 0.4440E-06 0.4300E-06 H2,gas 0.2192E-06 1.0193 0.8338E-05 0.8180E-05 H2S,gas 0.9154E-05 0.8805 0.3007E-03 0.3415E-03 S2,gas 0.1068E-16 1.0000 0.3984E-15 0.3984E-15 CO,gas 0.1500E-08 1.0000 0.5597E-07 0.5597E-07 SO3,gas 0.3203E-30 1.0000 0.1195E-28 0.1195E-28 O2,gas 0.6245E-51 1.0000 0.2330E-49 0.2330E-49 SO2,gas 0.8560E-14 1.0000 0.3193E-12 0.3193E-12 HF,gas 0.5296E-08 1.0000 0.1976E-06 0.1976E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 -0.63059E-11 206 bornite -85.08 -77.16 7.92 0.592 -0.14053E+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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -3.79 -9.05 -2.263 0.16066E+05 -6.353 4 H2,gas 8.58 0.80 -7.78 -4.445 0.13806E+05 -5.079 5 H2S,gas -5.38 -11.60 -6.22 -3.110 0.11042E+05 -3.522 6 S2,gas -6.70 -24.80 -18.10 -2.784 0.32124E+05 -15.400 7 CO,gas 3.75 -6.20 -9.95 -3.062 0.17663E+05 -7.252 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.923 9 O2,gas 50.71 -1.62 -52.33 -34.888 0.92887E+05 -49.633 10 SO2,gas 1.18 -14.02 -15.19 -4.052 0.26970E+05 -12.496 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56596E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38764E+04 22 analcite 3.18 0.28 -2.90 -0.322 0.51508E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77174E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.38 -3.24 -0.541 0.57593E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36801E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34350E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83404E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19950E+04 66 diamond -2.94 -5.39 -2.45 -0.700 0.43474E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67521E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41094E+04 86 goethite 6.14 2.36 -3.78 -0.817 0.67108E+04 87 graphite -3.37 -5.39 -2.03 -0.579 0.35959E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65361E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22524E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74563E+04 107 magnesite 0.56 -2.23 -2.79 -0.929 0.49490E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30045E+04 121 muscovite 1.97 -1.27 -3.24 -0.191 0.57540E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58889E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85317E+04 143 pyrite -20.64 -21.22 -0.57 -0.135 0.10183E+04 144 pyrrhotite -4.24 -8.82 -4.58 -1.526 0.81283E+04 145 pyrrhotiteFe0.875 -5.92 -9.27 -3.34 -1.230 0.59360E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40927E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37105E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50711E+04 157 siderite -2.60 -4.24 -1.64 -0.547 0.29137E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81343E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75031E+04 171 sulfur -8.90 -12.40 -3.50 -1.076 0.62089E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71519E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -8.82 -4.44 -1.482 0.78894E+04 198 arsenic -6.91 -11.19 -4.28 -1.104 0.75949E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74514E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.288 0.80238E+04 203 beidellite-K -1.84 -6.16 -4.32 -0.265 0.76763E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74302E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70851E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -24.86 1.79 0.447 -0.31732E+04 211 covellite -19.11 -18.63 0.48 0.183 -0.85443E+03 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46744E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71671E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72595E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71411E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67493E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45734E+04 254 cerussite -2.68 -5.51 -2.83 -0.942 0.50184E+04 255 chalcopyrite -27.58 -27.45 0.13 0.024 -0.23227E+03 257 copper,native -2.74 -6.23 -3.49 -1.214 0.61936E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79091E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 261 galena -11.59 -10.09 1.50 0.500 -0.26622E+04 262 gold,native -17.55 -18.46 -0.91 -0.316 0.16133E+04 263 silver,native -6.17 -7.30 -1.13 -0.394 0.20104E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -4.74 -3.96 -1.320 0.70268E+04 273 sphalerite -10.05 -9.32 0.73 0.245 -0.13037E+04 274 wurtzite -8.29 -9.32 -1.03 -0.343 0.18274E+04 276 an20ab80 1.85 -1.44 -3.30 -0.253 0.58487E+04 277 an25ab75 2.44 -1.16 -3.60 -0.277 0.63909E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69429E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705964E+00 Osmotic coef. = 0.9306 True ionic strength = .7228351E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18367E-04 -4.7360 0.11490E-04 -4.9397 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70760E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13309E-01 -1.8758 0.82672E-02 -2.0826 0.62116E+00 -0.2068 6 HS- 0.35163E-06 -6.4539 0.21697E-06 -6.6636 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45580E-11 -11.3412 0.38073E-13 -13.4194 0.83530E-02 -2.0782 9 Ca++ 0.86679E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72722E-04 -4.1383 0.82290E-05 -5.0847 0.11316E+00 -0.9463 11 Fe++ 0.68351E-06 -6.1653 0.77790E-07 -7.1091 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.22164E-06 -6.6544 0.25225E-07 -7.5982 0.11381E+00 -0.9438 16 Cu+ 0.11638E-12 -12.9341 0.71348E-13 -13.1466 0.61306E+00 -0.2125 17 Pb++ 0.36117E-07 -7.4423 0.42720E-08 -8.3694 0.11828E+00 -0.9271 18 Ag+ 0.37157E-12 -12.4300 0.22983E-12 -12.6386 0.61856E+00 -0.2086 19 Au+ 0.26006E-23 -23.5849 0.16146E-23 -23.7919 0.62086E+00 -0.2070 20 Ba++ 0.15511E-05 -5.8094 0.18586E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72757E-03 -3.1381 0.44775E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48142E-07 -7.3175 0.33009E-07 -7.4814 0.68565E+00 -0.1639 24 HSiO3- 0.33898E-06 -6.4698 0.20904E-06 -6.6798 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.87017E-09 -9.0604 0.54025E-09 -9.2674 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82820E-10 -10.0819 0.51420E-10 -10.2889 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10728E-05 -5.9695 0.10728E-05 -5.9695 0.10000E+01 0.0000 31 AgCl,aq 0.61391E-10 -10.2119 0.61391E-10 -10.2119 0.10000E+01 0.0000 32 AgCl2- 0.17567E-08 -8.7553 0.10833E-08 -8.9652 0.61667E+00 -0.2099 33 AgCl3-2 0.55170E-09 -9.2583 0.67058E-10 -10.1736 0.12155E+00 -0.9153 34 AgCl4-3 0.26375E-10 -10.5788 0.23130E-12 -12.6358 0.87694E-02 -2.0570 38 Ag(HS),aq 0.41815E-08 -8.3787 0.41815E-08 -8.3787 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81312E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26043E-10 -10.5843 0.29939E-11 -11.5238 0.11496E+00 -0.9395 42 HAlO2,aq 0.23184E-08 -8.6348 0.23184E-08 -8.6348 0.10000E+01 0.0000 43 AlO2- 0.11466E-08 -8.9406 0.70491E-09 -9.1519 0.61480E+00 -0.2113 44 AsO2- 0.25009E-07 -7.6019 0.15423E-07 -7.8118 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67189E-10 -10.1727 0.67189E-10 -10.1727 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22593E-06 -6.6460 0.14122E-06 -6.8501 0.62508E+00 -0.2041 64 BaCl+ 0.25233E-06 -6.5980 0.15666E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36290E-09 -9.4402 0.22531E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.17663E-09 -9.7529 0.16029E-09 -9.7951 0.90748E+00 -0.0422 71 CO,aq 0.23889E-10 -10.6218 0.23889E-10 -10.6218 0.10000E+01 0.0000 72 CO2,aq 0.16140E+00 -0.7921 0.14647E+00 -0.8343 0.90748E+00 -0.0422 73 CO3-2 0.82130E-06 -6.0855 0.99826E-07 -7.0008 0.12155E+00 -0.9153 74 CaCO3,aq 0.14974E-06 -6.8247 0.14974E-06 -6.8247 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39971E-04 -4.3983 0.24817E-04 -4.6053 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84138E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72808E-05 -5.1378 0.72808E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22666E-08 -8.6446 0.14072E-08 -8.8516 0.62086E+00 -0.2070 80 CaSO4,aq 0.37650E-06 -6.4242 0.37650E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12565E-05 -5.9008 0.12565E-05 -5.9008 0.10000E+01 0.0000 90 CuCl,aq 0.16218E-09 -9.7900 0.16218E-09 -9.7900 0.10000E+01 0.0000 91 CuCl2- 0.18634E-08 -8.7297 0.11491E-08 -8.9397 0.61667E+00 -0.2099 92 CuCl3-2 0.21694E-09 -9.6637 0.26368E-10 -10.5789 0.12155E+00 -0.9153 98 HF,aq 0.37528E-04 -4.4256 0.37528E-04 -4.4256 0.10000E+01 0.0000 99 HF2- 0.80102E-08 -8.0964 0.49397E-08 -8.3063 0.61667E+00 -0.2099 101 FeCl+ 0.96790E-07 -7.0142 0.60093E-07 -7.2212 0.62086E+00 -0.2070 104 FeF+ 0.30805E-08 -8.5114 0.19126E-08 -8.7184 0.62086E+00 -0.2070 107 FeOH+ 0.76459E-09 -9.1166 0.47471E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.50769E-08 -8.2944 0.46072E-08 -8.3366 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11465E-08 -8.9406 0.11465E-08 -8.9406 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26806E-08 -8.5718 0.26806E-08 -8.5718 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33111E-05 -5.4800 0.20557E-05 -5.6870 0.62086E+00 -0.2070 120 MgCl+ 0.93804E-05 -5.0278 0.58240E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91887E-09 -9.0367 0.57050E-09 -9.2437 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97733E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11694E-08 -8.9320 0.72602E-09 -9.1390 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46266E-04 -4.3347 0.46266E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33690E-07 -7.4725 0.33690E-07 -7.4725 0.10000E+01 0.0000 137 OH- 0.18390E-06 -6.7354 0.11306E-06 -6.9467 0.61480E+00 -0.2113 140 PbCl+ 0.20724E-06 -6.6835 0.12867E-06 -6.8905 0.62086E+00 -0.2070 141 PbCl2,aq 0.34960E-06 -6.4564 0.34960E-06 -6.4564 0.10000E+01 0.0000 142 PbCl3- 0.12005E-06 -6.9206 0.74031E-07 -7.1306 0.61667E+00 -0.2099 143 PbCl4-2 0.67371E-07 -7.1715 0.81887E-08 -8.0868 0.12155E+00 -0.9153 144 PbF+ 0.45443E-09 -9.3425 0.28214E-09 -9.5495 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.73763E-09 -9.1322 0.73763E-09 -9.1322 0.10000E+01 0.0000 150 H2S,aq 0.64805E-05 -5.1884 0.58810E-05 -5.2306 0.90748E+00 -0.0422 159 HSO4- 0.23167E-06 -6.6351 0.14513E-06 -6.8382 0.62647E+00 -0.2031 173 ZnCl+ 0.29615E-05 -5.5285 0.18387E-05 -5.7355 0.62086E+00 -0.2070 174 ZnCl2,aq 0.45113E-06 -6.3457 0.45113E-06 -6.3457 0.10000E+01 0.0000 175 ZnCl3- 0.44371E-07 -7.3529 0.27362E-07 -7.5628 0.61667E+00 -0.2099 176 ZnF+ 0.62521E-09 -9.2040 0.38817E-09 -9.4110 0.62086E+00 -0.2070 178 ZnOH+ 0.50339E-07 -7.2981 0.31254E-07 -7.5051 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1836652E-04 0.1615268E+00 0.1544866E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461189E+06 0.0000 3 Cl- 0.7076023E+00 0.7717765E+00 0.2596307E+05 4.5795 4 SO4-- 0.8912309E-04 0.9420483E-04 0.8586863E+01 4.9196 5 HCO3- 0.1330942E-01 0.1747549E+00 0.1011796E+05 2.8570 6 HS- 0.3516315E-06 0.6839287E-05 0.2146262E+00 -1.7239 7 H4SiO4 0.1402178E-02 0.1403591E-02 0.1280103E+03 -2.8532 8 Al+++ 0.4557975E-11 0.3626531E-08 0.9284724E-04 1.3997 9 Ca++ 0.8667947E-03 0.1051354E-02 0.3998217E+02 5.8821 10 Mg++ 0.7272229E-04 0.8578356E-04 0.1978957E+01 4.7947 11 Fe++ 0.6835100E-06 0.7841476E-06 0.4155365E-01 2.7703 12 K+ 0.2257024E-01 0.2270089E-01 0.8422741E+03 3.0856 13 Na+ 0.6970667E+00 0.7609886E+00 0.1660064E+05 4.5706 14 Mn++ 0.1031864E-04 0.1721796E-04 0.8975652E+00 3.9511 15 Zn++ 0.2216396E-06 0.3729625E-05 0.2313424E+00 2.2812 16 Cu+ 0.1163793E-12 0.2242593E-08 0.1352101E-03 -8.2069 17 Pb++ 0.3611745E-07 0.7815751E-06 0.1536565E+00 1.5100 18 Ag+ 0.3715660E-12 0.6578622E-08 0.6733597E-03 -7.6989 19 Au+ 0.2600623E-23 0.1553621E-11 0.2903689E-06 -18.8522 20 Ba++ 0.1551084E-05 0.2029771E-05 0.2645182E+00 3.1485 21 F- 0.7275711E-03 0.8130271E-03 0.1465630E+02 1.5907 22 H2AsO3- 0.4814228E-07 0.6474253E-04 0.7675165E+01 -2.5417 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234403E+00 -.5102270E-05 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1656666E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4141664E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.1369494E-04 0.3353692E-06 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200009E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7261741E-08 0.2400017E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570172E-05 0.3313331E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.7468176E-05 0.0000000E+00 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4490553E-08 0.1656666E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.1565021E-05 0.0000000E+00 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1317299E-07 0.4139551E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400017E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2070E-06 -6.684 0.5129E-04 -4.290 17.76 0.7203E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 76.48 0.6183E-04 bornite 0.3313E-07 -7.480 0.1663E-04 -4.779 5.758 0.3271E-05 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.000289 g Volume = 0.000072 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2937E+03 GOLD Q/K: 0.1243 SILVER Q/K: 0.0739 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3071 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8133 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.1142E-07 1.0325 0.4399E-06 0.4260E-06 H2,gas 0.2187E-06 1.0193 0.8318E-05 0.8161E-05 H2S,gas 0.9069E-05 0.8805 0.2979E-03 0.3383E-03 S2,gas 0.1053E-16 1.0000 0.3929E-15 0.3929E-15 CO,gas 0.1497E-08 1.0000 0.5584E-07 0.5584E-07 SO3,gas 0.3203E-30 1.0000 0.1195E-28 0.1195E-28 O2,gas 0.6274E-51 1.0000 0.2341E-49 0.2341E-49 SO2,gas 0.8540E-14 1.0000 0.3186E-12 0.3186E-12 HF,gas 0.5296E-08 1.0000 0.1976E-06 0.1976E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.63059E-11 206 bornite -85.08 -85.08 0.00 0.000 0.50448E-10 226 topaz -16.63 -16.63 0.00 0.000 0.00000E+00 261 galena -11.59 -10.09 1.50 0.499 -0.26551E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -3.80 -9.06 -2.264 0.16073E+05 -6.357 4 H2,gas 8.58 0.80 -7.78 -4.445 0.13807E+05 -5.080 5 H2S,gas -5.38 -11.60 -6.22 -3.112 0.11049E+05 -3.526 6 S2,gas -6.70 -24.80 -18.10 -2.785 0.32135E+05 -15.406 7 CO,gas 3.75 -6.20 -9.95 -3.062 0.17664E+05 -7.253 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.923 9 O2,gas 50.71 -1.62 -52.33 -34.886 0.92883E+05 -49.631 10 SO2,gas 1.18 -14.02 -15.20 -4.052 0.26972E+05 -12.497 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56596E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38765E+04 22 analcite 3.18 0.28 -2.90 -0.322 0.51508E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77174E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57754E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36802E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34350E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83404E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19950E+04 66 diamond -2.94 -5.39 -2.45 -0.700 0.43510E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67521E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41094E+04 86 goethite 6.14 2.35 -3.79 -0.819 0.67260E+04 87 graphite -3.37 -5.39 -2.03 -0.579 0.35995E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65361E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22524E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74563E+04 107 magnesite 0.56 -2.23 -2.79 -0.929 0.49490E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30046E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57540E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58889E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85317E+04 143 pyrite -20.64 -21.23 -0.59 -0.139 0.10470E+04 144 pyrrhotite -4.24 -8.83 -4.59 -1.531 0.81516E+04 145 pyrrhotiteFe0.875 -5.92 -9.28 -3.36 -1.234 0.59571E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40927E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37105E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50711E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29298E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81343E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75031E+04 171 sulfur -8.90 -12.40 -3.50 -1.077 0.62143E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71519E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -8.83 -4.46 -1.486 0.79127E+04 198 arsenic -6.91 -11.19 -4.28 -1.105 0.75976E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74514E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.288 0.80238E+04 203 beidellite-K -1.84 -6.16 -4.32 -0.265 0.76763E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74302E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70851E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -28.02 -1.37 -0.343 0.24378E+04 211 covellite -19.11 -20.21 -1.10 -0.419 0.19538E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46744E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71672E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72596E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71411E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67493E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73696E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45734E+04 254 cerussite -2.68 -5.51 -2.83 -0.942 0.50184E+04 255 chalcopyrite -27.58 -29.04 -1.46 -0.272 0.25992E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79092E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 262 gold,native -17.55 -18.45 -0.91 -0.315 0.16070E+04 263 silver,native -6.17 -7.30 -1.13 -0.393 0.20077E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -4.74 -3.96 -1.320 0.70268E+04 273 sphalerite -10.05 -9.32 0.73 0.243 -0.12965E+04 274 wurtzite -8.29 -9.32 -1.03 -0.345 0.18346E+04 276 an20ab80 1.85 -1.44 -3.30 -0.253 0.58487E+04 277 an25ab75 2.44 -1.16 -3.60 -0.277 0.63909E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69429E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 9 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705945E+00 Osmotic coef. = 0.9306 True ionic strength = .7228347E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18369E-04 -4.7359 0.11491E-04 -4.9396 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70760E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13308E-01 -1.8759 0.82663E-02 -2.0827 0.62116E+00 -0.2068 6 HS- 0.31291E-06 -6.5046 0.19308E-06 -6.7143 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45591E-11 -11.3411 0.38082E-13 -13.4193 0.83530E-02 -2.0782 9 Ca++ 0.86680E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72723E-04 -4.1383 0.82291E-05 -5.0847 0.11316E+00 -0.9463 11 Fe++ 0.68355E-06 -6.1652 0.77794E-07 -7.1091 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.22164E-06 -6.6544 0.25225E-07 -7.5982 0.11381E+00 -0.9438 16 Cu+ 0.12740E-12 -12.8948 0.78104E-13 -13.1073 0.61306E+00 -0.2125 17 Pb++ 0.12960E-08 -8.8874 0.15329E-09 -9.8145 0.11828E+00 -0.9271 18 Ag+ 0.39391E-12 -12.4046 0.24366E-12 -12.6132 0.61856E+00 -0.2086 19 Au+ 0.29230E-23 -23.5342 0.18148E-23 -23.7412 0.62086E+00 -0.2070 20 Ba++ 0.15511E-05 -5.8094 0.18586E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72757E-03 -3.1381 0.44775E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48137E-07 -7.3175 0.33005E-07 -7.4814 0.68565E+00 -0.1639 24 HSiO3- 0.33894E-06 -6.4699 0.20901E-06 -6.6798 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.87007E-09 -9.0604 0.54019E-09 -9.2675 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82811E-10 -10.0819 0.51414E-10 -10.2889 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10726E-05 -5.9695 0.10726E-05 -5.9695 0.10000E+01 0.0000 31 AgCl,aq 0.65083E-10 -10.1865 0.65083E-10 -10.1865 0.10000E+01 0.0000 32 AgCl2- 0.18623E-08 -8.7299 0.11485E-08 -8.9399 0.61667E+00 -0.2099 33 AgCl3-2 0.58488E-09 -9.2329 0.71090E-10 -10.1482 0.12155E+00 -0.9153 34 AgCl4-3 0.27962E-10 -10.5534 0.24521E-12 -12.6105 0.87694E-02 -2.0570 38 Ag(HS),aq 0.39448E-08 -8.4040 0.39448E-08 -8.4040 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81312E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26046E-10 -10.5843 0.29943E-11 -11.5237 0.11496E+00 -0.9395 42 HAlO2,aq 0.23181E-08 -8.6349 0.23181E-08 -8.6349 0.10000E+01 0.0000 43 AlO2- 0.11463E-08 -8.9407 0.70474E-09 -9.1520 0.61480E+00 -0.2113 44 AsO2- 0.25007E-07 -7.6019 0.15421E-07 -7.8119 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67175E-10 -10.1728 0.67175E-10 -10.1728 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22591E-06 -6.6461 0.14121E-06 -6.8501 0.62508E+00 -0.2041 64 BaCl+ 0.25233E-06 -6.5980 0.15666E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36291E-09 -9.4402 0.22531E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.15717E-09 -9.8036 0.14262E-09 -9.8458 0.90748E+00 -0.0422 71 CO,aq 0.23202E-10 -10.6345 0.23202E-10 -10.6345 0.10000E+01 0.0000 72 CO2,aq 0.16140E+00 -0.7921 0.14647E+00 -0.8343 0.90748E+00 -0.0422 73 CO3-2 0.82111E-06 -6.0856 0.99803E-07 -7.0009 0.12155E+00 -0.9153 74 CaCO3,aq 0.14971E-06 -6.8248 0.14971E-06 -6.8248 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39967E-04 -4.3983 0.24814E-04 -4.6053 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84139E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72809E-05 -5.1378 0.72809E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22663E-08 -8.6447 0.14071E-08 -8.8517 0.62086E+00 -0.2070 80 CaSO4,aq 0.37650E-06 -6.4242 0.37650E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12566E-05 -5.9008 0.12566E-05 -5.9008 0.10000E+01 0.0000 90 CuCl,aq 0.17753E-09 -9.7507 0.17753E-09 -9.7507 0.10000E+01 0.0000 91 CuCl2- 0.20398E-08 -8.6904 0.12579E-08 -8.9004 0.61667E+00 -0.2099 92 CuCl3-2 0.23748E-09 -9.6244 0.28865E-10 -10.5396 0.12155E+00 -0.9153 98 HF,aq 0.37532E-04 -4.4256 0.37532E-04 -4.4256 0.10000E+01 0.0000 99 HF2- 0.80111E-08 -8.0963 0.49402E-08 -8.3063 0.61667E+00 -0.2099 101 FeCl+ 0.96795E-07 -7.0141 0.60097E-07 -7.2212 0.62086E+00 -0.2070 104 FeF+ 0.30807E-08 -8.5114 0.19127E-08 -8.7184 0.62086E+00 -0.2070 107 FeOH+ 0.76454E-09 -9.1166 0.47468E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.49308E-08 -8.3071 0.44746E-08 -8.3492 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11464E-08 -8.9407 0.11464E-08 -8.9407 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26801E-08 -8.5719 0.26801E-08 -8.5719 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33107E-05 -5.4801 0.20555E-05 -5.6871 0.62086E+00 -0.2070 120 MgCl+ 0.93805E-05 -5.0278 0.58240E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91877E-09 -9.0368 0.57043E-09 -9.2438 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97732E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11692E-08 -8.9321 0.72594E-09 -9.1391 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46266E-04 -4.3347 0.46266E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33686E-07 -7.4726 0.33686E-07 -7.4726 0.10000E+01 0.0000 137 OH- 0.18388E-06 -6.7355 0.11305E-06 -6.9467 0.61480E+00 -0.2113 140 PbCl+ 0.74363E-08 -8.1286 0.46169E-08 -8.3356 0.62086E+00 -0.2070 141 PbCl2,aq 0.12545E-07 -7.9015 0.12545E-07 -7.9015 0.10000E+01 0.0000 142 PbCl3- 0.43078E-08 -8.3657 0.26565E-08 -8.5757 0.61667E+00 -0.2099 143 PbCl4-2 0.24175E-08 -8.6166 0.29384E-09 -9.5319 0.12155E+00 -0.9153 144 PbF+ 0.16306E-10 -10.7876 0.10124E-10 -10.9947 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.20960E-10 -10.6786 0.20960E-10 -10.6786 0.10000E+01 0.0000 150 H2S,aq 0.57676E-05 -5.2390 0.52339E-05 -5.2812 0.90748E+00 -0.0422 159 HSO4- 0.23170E-06 -6.6351 0.14515E-06 -6.8382 0.62647E+00 -0.2031 173 ZnCl+ 0.29615E-05 -5.5285 0.18387E-05 -5.7355 0.62086E+00 -0.2070 174 ZnCl2,aq 0.45114E-06 -6.3457 0.45114E-06 -6.3457 0.10000E+01 0.0000 175 ZnCl3- 0.44371E-07 -7.3529 0.27362E-07 -7.5628 0.61667E+00 -0.2099 176 ZnF+ 0.62521E-09 -9.2040 0.38817E-09 -9.4110 0.62086E+00 -0.2070 178 ZnOH+ 0.50333E-07 -7.2981 0.31250E-07 -7.5052 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1836869E-04 0.1615276E+00 0.1544874E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461190E+06 0.0000 3 Cl- 0.7076037E+00 0.7717765E+00 0.2596308E+05 4.5795 4 SO4-- 0.8912301E-04 0.9420484E-04 0.8586864E+01 4.9195 5 HCO3- 0.1330797E-01 0.1747549E+00 0.1011797E+05 2.8569 6 HS- 0.3129091E-06 0.6085870E-05 0.1909830E+00 -1.7746 7 H4SiO4 0.1402178E-02 0.1403591E-02 0.1280104E+03 -2.8532 8 Al+++ 0.4559073E-11 0.3626007E-08 0.9283385E-04 1.3996 9 Ca++ 0.8667980E-03 0.1051354E-02 0.3998218E+02 5.8820 10 Mg++ 0.7272257E-04 0.8578356E-04 0.1978957E+01 4.7946 11 Fe++ 0.6835469E-06 0.7841900E-06 0.4155591E-01 2.7702 12 K+ 0.2257024E-01 0.2270089E-01 0.8422742E+03 3.0856 13 Na+ 0.6970665E+00 0.7609885E+00 0.1660064E+05 4.5705 14 Mn++ 0.1031864E-04 0.1721796E-04 0.8975653E+00 3.9510 15 Zn++ 0.2216395E-06 0.3729625E-05 0.2313424E+00 2.2811 16 Cu+ 0.1274000E-12 0.2454968E-08 0.1480147E-03 -8.1677 17 Pb++ 0.1296003E-08 0.2803987E-07 0.5512599E-02 0.0648 18 Ag+ 0.3939095E-12 0.6485938E-08 0.6638730E-03 -7.6736 19 Au+ 0.2922978E-23 0.1553621E-11 0.2903690E-06 -18.8016 20 Ba++ 0.1551102E-05 0.2029771E-05 0.2645183E+00 3.1484 21 F- 0.7275675E-03 0.8130271E-03 0.1465630E+02 1.5907 22 H2AsO3- 0.4813659E-07 0.6474253E-04 0.7675166E+01 -2.5418 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234418E+00 -.6610994E-05 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1652413E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4131033E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.1218630E-04 0.1844006E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200009E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7260693E-08 0.2400018E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570257E-05 0.3304826E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.7468176E-05 0.0000000E+00 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4915812E-08 0.1652413E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.5614685E-07 0.1508874E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1298740E-07 0.4141407E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400018E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2071E-06 -6.684 0.5131E-04 -4.290 7.897 0.7206E-05 bornite 0.3305E-07 -7.481 0.1658E-04 -4.780 2.552 0.3263E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 33.99 0.6183E-04 galena 0.1509E-05 -5.821 0.3610E-03 -3.442 55.56 0.4751E-04 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.000650 g Volume = 0.000120 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: 0.2375E+03 GOLD Q/K: 0.1377 SILVER Q/K: 0.0772 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3074 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8132 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.1016E-07 1.0325 0.3914E-06 0.3791E-06 H2,gas 0.2124E-06 1.0193 0.8079E-05 0.7926E-05 H2S,gas 0.8071E-05 0.8805 0.2651E-03 0.3011E-03 S2,gas 0.8843E-17 1.0000 0.3299E-15 0.3299E-15 CO,gas 0.1454E-08 1.0000 0.5424E-07 0.5424E-07 SO3,gas 0.3203E-30 1.0000 0.1195E-28 0.1195E-28 O2,gas 0.6651E-51 1.0000 0.2481E-49 0.2481E-49 SO2,gas 0.8296E-14 1.0000 0.3095E-12 0.3095E-12 HF,gas 0.5297E-08 1.0000 0.1976E-06 0.1976E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.63059E-11 206 bornite -85.08 -85.08 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 0.00000E+00 261 galena -11.59 -11.59 0.00 0.000 0.63059E-11 273 sphalerite -10.05 -9.37 0.68 0.227 -0.12064E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -3.85 -9.11 -2.277 0.16163E+05 -6.407 4 H2,gas 8.58 0.79 -7.79 -4.452 0.13830E+05 -5.093 5 H2S,gas -5.38 -11.65 -6.28 -3.138 0.11139E+05 -3.577 6 S2,gas -6.70 -24.88 -18.18 -2.797 0.32270E+05 -15.482 7 CO,gas 3.75 -6.21 -9.96 -3.066 0.17687E+05 -7.266 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.923 9 O2,gas 50.71 -1.59 -52.30 -34.870 0.92838E+05 -49.605 10 SO2,gas 1.18 -14.03 -15.21 -4.056 0.26994E+05 -12.509 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56598E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38766E+04 22 analcite 3.18 0.27 -2.90 -0.322 0.51510E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77175E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57757E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36803E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34352E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83405E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19951E+04 66 diamond -2.94 -5.42 -2.48 -0.708 0.43960E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67525E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41095E+04 86 goethite 6.14 2.36 -3.78 -0.818 0.67149E+04 87 graphite -3.37 -5.42 -2.05 -0.587 0.36445E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65363E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22526E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74565E+04 107 magnesite 0.56 -2.23 -2.79 -0.929 0.49492E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30047E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57544E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58892E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85319E+04 143 pyrite -20.64 -21.32 -0.68 -0.160 0.12043E+04 144 pyrrhotite -4.24 -8.88 -4.64 -1.548 0.82416E+04 145 pyrrhotiteFe0.875 -5.92 -9.33 -3.41 -1.252 0.60443E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40928E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37107E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50713E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29300E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81345E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75035E+04 171 sulfur -8.90 -12.44 -3.54 -1.089 0.62817E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71521E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -8.88 -4.51 -1.503 0.80027E+04 198 arsenic -6.91 -11.21 -4.30 -1.110 0.76313E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74517E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.288 0.80240E+04 203 beidellite-K -1.84 -6.16 -4.32 -0.265 0.76766E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74304E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70854E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -27.99 -1.35 -0.336 0.23883E+04 211 covellite -19.11 -20.21 -1.11 -0.421 0.19627E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46746E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71674E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72598E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71413E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67496E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45735E+04 254 cerussite -2.68 -6.96 -4.27 -1.424 0.75836E+04 255 chalcopyrite -27.58 -29.10 -1.52 -0.283 0.26981E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79095E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 262 gold,native -17.55 -18.41 -0.86 -0.299 0.15282E+04 263 silver,native -6.17 -7.28 -1.11 -0.387 0.19740E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -4.74 -3.96 -1.320 0.70270E+04 274 wurtzite -8.29 -9.37 -1.08 -0.361 0.19247E+04 276 an20ab80 1.85 -1.44 -3.30 -0.253 0.58490E+04 277 an25ab75 2.44 -1.16 -3.60 -0.277 0.63911E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69431E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 10 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705884E+00 Osmotic coef. = 0.9306 True ionic strength = .7228320E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18376E-04 -4.7358 0.11496E-04 -4.9395 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70761E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13303E-01 -1.8760 0.82635E-02 -2.0828 0.62116E+00 -0.2068 6 HS- 0.18857E-06 -6.7245 0.11636E-06 -6.9342 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45626E-11 -11.3408 0.38111E-13 -13.4189 0.83531E-02 -2.0782 9 Ca++ 0.86681E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72724E-04 -4.1383 0.82292E-05 -5.0846 0.11316E+00 -0.9463 11 Fe++ 0.68375E-06 -6.1651 0.77818E-07 -7.1089 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.76923E-07 -7.1139 0.87546E-08 -8.0578 0.11381E+00 -0.9438 16 Cu+ 0.18866E-12 -12.7243 0.11566E-12 -12.9368 0.61306E+00 -0.2125 17 Pb++ 0.21513E-08 -8.6673 0.25446E-09 -9.5944 0.11828E+00 -0.9271 18 Ag+ 0.50751E-12 -12.2946 0.31393E-12 -12.5032 0.61856E+00 -0.2086 19 Au+ 0.48474E-23 -23.3145 0.30096E-23 -23.5215 0.62086E+00 -0.2070 20 Ba++ 0.15512E-05 -5.8093 0.18587E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72756E-03 -3.1381 0.44774E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48118E-07 -7.3177 0.32992E-07 -7.4816 0.68565E+00 -0.1639 24 HSiO3- 0.33881E-06 -6.4700 0.20894E-06 -6.6800 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.86975E-09 -9.0606 0.54000E-09 -9.2676 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82781E-10 -10.0821 0.51396E-10 -10.2891 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10722E-05 -5.9697 0.10722E-05 -5.9697 0.10000E+01 0.0000 31 AgCl,aq 0.83853E-10 -10.0765 0.83853E-10 -10.0765 0.10000E+01 0.0000 32 AgCl2- 0.23995E-08 -8.6199 0.14797E-08 -8.8298 0.61667E+00 -0.2099 33 AgCl3-2 0.75357E-09 -9.1229 0.91594E-10 -10.0381 0.12155E+00 -0.9153 34 AgCl4-3 0.36026E-10 -10.4434 0.31593E-12 -12.5004 0.87695E-02 -2.0570 38 Ag(HS),aq 0.30630E-08 -8.5139 0.30630E-08 -8.5139 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81313E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26056E-10 -10.5841 0.29954E-11 -11.5235 0.11496E+00 -0.9395 42 HAlO2,aq 0.23173E-08 -8.6350 0.23173E-08 -8.6350 0.10000E+01 0.0000 43 AlO2- 0.11455E-08 -8.9410 0.70423E-09 -9.1523 0.61480E+00 -0.2113 44 AsO2- 0.24997E-07 -7.6021 0.15415E-07 -7.8121 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67129E-10 -10.1731 0.67129E-10 -10.1731 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22584E-06 -6.6462 0.14116E-06 -6.8503 0.62508E+00 -0.2041 64 BaCl+ 0.25234E-06 -6.5980 0.15667E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36291E-09 -9.4402 0.22532E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.94683E-10 -10.0237 0.85923E-10 -10.0659 0.90748E+00 -0.0422 71 CO,aq 0.20441E-10 -10.6895 0.20441E-10 -10.6895 0.10000E+01 0.0000 72 CO2,aq 0.16141E+00 -0.7921 0.14647E+00 -0.8342 0.90748E+00 -0.0422 73 CO3-2 0.82051E-06 -6.0859 0.99731E-07 -7.0012 0.12155E+00 -0.9153 74 CaCO3,aq 0.14960E-06 -6.8251 0.14960E-06 -6.8251 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39954E-04 -4.3984 0.24806E-04 -4.6054 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84140E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72810E-05 -5.1378 0.72810E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22655E-08 -8.6448 0.14066E-08 -8.8518 0.62086E+00 -0.2070 80 CaSO4,aq 0.37651E-06 -6.4242 0.37651E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12571E-05 -5.9006 0.12571E-05 -5.9006 0.10000E+01 0.0000 90 CuCl,aq 0.26291E-09 -9.5802 0.26291E-09 -9.5802 0.10000E+01 0.0000 91 CuCl2- 0.30207E-08 -8.5199 0.18628E-08 -8.7298 0.61667E+00 -0.2099 92 CuCl3-2 0.35169E-09 -9.4538 0.42746E-10 -10.3691 0.12155E+00 -0.9153 98 HF,aq 0.37546E-04 -4.4254 0.37546E-04 -4.4254 0.10000E+01 0.0000 99 HF2- 0.80138E-08 -8.0962 0.49419E-08 -8.3061 0.61667E+00 -0.2099 101 FeCl+ 0.96825E-07 -7.0140 0.60115E-07 -7.2210 0.62086E+00 -0.2070 104 FeF+ 0.30816E-08 -8.5112 0.19132E-08 -8.7182 0.62086E+00 -0.2070 107 FeOH+ 0.76449E-09 -9.1166 0.47464E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.43441E-08 -8.3621 0.39421E-08 -8.4043 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11459E-08 -8.9408 0.11459E-08 -8.9408 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26781E-08 -8.5722 0.26781E-08 -8.5722 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33096E-05 -5.4802 0.20548E-05 -5.6872 0.62086E+00 -0.2070 120 MgCl+ 0.93806E-05 -5.0278 0.58241E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91844E-09 -9.0370 0.57022E-09 -9.2440 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97731E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11688E-08 -8.9323 0.72566E-09 -9.1393 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46265E-04 -4.3347 0.46265E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33673E-07 -7.4727 0.33673E-07 -7.4727 0.10000E+01 0.0000 137 OH- 0.18381E-06 -6.7356 0.11300E-06 -6.9469 0.61480E+00 -0.2113 140 PbCl+ 0.12344E-07 -7.9085 0.76640E-08 -8.1155 0.62086E+00 -0.2070 141 PbCl2,aq 0.20824E-07 -7.6814 0.20824E-07 -7.6814 0.10000E+01 0.0000 142 PbCl3- 0.71508E-08 -8.1456 0.44097E-08 -8.3556 0.61667E+00 -0.2099 143 PbCl4-2 0.40130E-08 -8.3965 0.48777E-09 -9.3118 0.12155E+00 -0.9153 144 PbF+ 0.27067E-10 -10.5676 0.16805E-10 -10.7746 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.12636E-10 -10.8984 0.12636E-10 -10.8984 0.10000E+01 0.0000 150 H2S,aq 0.34771E-05 -5.4588 0.31554E-05 -5.5009 0.90748E+00 -0.0422 159 HSO4- 0.23178E-06 -6.6349 0.14521E-06 -6.8380 0.62647E+00 -0.2031 173 ZnCl+ 0.10278E-05 -5.9881 0.63815E-06 -6.1951 0.62086E+00 -0.2070 174 ZnCl2,aq 0.15657E-06 -6.8053 0.15657E-06 -6.8053 0.10000E+01 0.0000 175 ZnCl3- 0.15400E-07 -7.8125 0.94966E-08 -8.0224 0.61667E+00 -0.2099 176 ZnF+ 0.21698E-09 -9.6636 0.13472E-09 -9.8706 0.62086E+00 -0.2070 178 ZnOH+ 0.17462E-07 -7.7579 0.10842E-07 -7.9649 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1837562E-04 0.1615300E+00 0.1544897E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461192E+06 0.0000 3 Cl- 0.7076060E+00 0.7717764E+00 0.2596308E+05 4.5793 4 SO4-- 0.8912274E-04 0.9420486E-04 0.8586869E+01 4.9192 5 HCO3- 0.1330333E-01 0.1747549E+00 0.1011797E+05 2.8566 6 HS- 0.1885742E-06 0.3669982E-05 0.1151691E+00 -1.9947 7 H4SiO4 0.1402179E-02 0.1403591E-02 0.1280104E+03 -2.8532 8 Al+++ 0.4562571E-11 0.3624343E-08 0.9279127E-04 1.3994 9 Ca++ 0.8668089E-03 0.1051354E-02 0.3998219E+02 5.8817 10 Mg++ 0.7272351E-04 0.8578355E-04 0.1978957E+01 4.7943 11 Fe++ 0.6837525E-06 0.7844261E-06 0.4156843E-01 2.7700 12 K+ 0.2257024E-01 0.2270089E-01 0.8422744E+03 3.0854 13 Na+ 0.6970663E+00 0.7609885E+00 0.1660065E+05 4.5704 14 Mn++ 0.1031861E-04 0.1721796E-04 0.8975655E+00 3.9507 15 Zn++ 0.7692280E-07 0.1294414E-05 0.8029036E-01 1.8212 16 Cu+ 0.1886634E-12 0.3635524E-08 0.2191926E-03 -7.9973 17 Pb++ 0.2151319E-08 0.4652342E-07 0.9146441E-02 0.2845 18 Ag+ 0.5075119E-12 0.6336580E-08 0.6485857E-03 -7.5637 19 Au+ 0.4847442E-23 0.1553621E-11 0.2903690E-06 -18.5820 20 Ba++ 0.1551161E-05 0.2029771E-05 0.2645183E+00 3.1481 21 F- 0.7275551E-03 0.8130270E-03 0.1465631E+02 1.5905 22 H2AsO3- 0.4811845E-07 0.6474252E-04 0.7675168E+01 -2.5421 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234466E+00 -.1144903E-04 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1628774E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886352E-03 0.4071934E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7348748E-05 0.6681563E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200011E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7257361E-08 0.2400022E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570730E-05 0.3257548E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2591926E-05 0.4876250E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.7279749E-08 0.1628774E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.9315819E-07 0.1471862E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1268833E-07 0.4144398E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3110961E-11 0.0000000E+00 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400022E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2072E-06 -6.684 0.5135E-04 -4.289 4.602 0.7211E-05 bornite 0.3258E-07 -7.487 0.1635E-04 -4.787 1.465 0.3216E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 19.79 0.6183E-04 galena 0.1472E-05 -5.832 0.3521E-03 -3.453 31.56 0.4635E-04 sphalerite 0.4876E-05 -5.312 0.4751E-03 -3.323 42.58 0.1162E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.001116 g Volume = 0.000235 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Estimated lowest electrum affinity for X gold = 0.500 AFFINITY: -.5995E+01 GOLD Q/K: 0.2143 SILVER Q/K: 0.0934 Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3084 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8132 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.6121E-08 1.0325 0.2358E-06 0.2284E-06 H2,gas 0.1872E-06 1.0193 0.7118E-05 0.6983E-05 H2S,gas 0.4866E-05 0.8805 0.1598E-03 0.1815E-03 S2,gas 0.4141E-17 1.0000 0.1545E-15 0.1545E-15 CO,gas 0.1281E-08 1.0000 0.4778E-07 0.4778E-07 SO3,gas 0.3206E-30 1.0000 0.1196E-28 0.1196E-28 O2,gas 0.8569E-51 1.0000 0.3197E-49 0.3197E-49 SO2,gas 0.7314E-14 1.0000 0.2729E-12 0.2729E-12 HF,gas 0.5298E-08 1.0000 0.1977E-06 0.1977E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 0.00000E+00 206 bornite -85.08 -85.08 0.00 0.000 0.25224E-10 226 topaz -16.63 -16.63 0.00 0.000 0.00000E+00 261 galena -11.59 -11.59 0.00 0.000 0.31530E-11 273 sphalerite -10.05 -10.05 0.00 0.000 0.00000E+00 262 gold,native -17.55 -18.22 -0.67 -0.233 0.11874E+04 263 silver,native -6.17 -7.20 -1.03 -0.358 0.18278E+04 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -4.07 -9.33 -2.332 0.16554E+05 -6.627 4 H2,gas 8.58 0.73 -7.85 -4.484 0.13928E+05 -5.148 5 H2S,gas -5.38 -11.87 -6.50 -3.248 0.11529E+05 -3.796 6 S2,gas -6.70 -25.21 -18.51 -2.848 0.32855E+05 -15.811 7 CO,gas 3.75 -6.27 -10.02 -3.083 0.17785E+05 -7.321 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.922 9 O2,gas 50.71 -1.48 -52.19 -34.796 0.92643E+05 -49.495 10 SO2,gas 1.18 -14.09 -15.26 -4.070 0.27091E+05 -12.564 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56603E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38772E+04 22 analcite 3.18 0.27 -2.90 -0.322 0.51515E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77181E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57766E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36809E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34357E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83411E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19954E+04 66 diamond -2.94 -5.53 -2.59 -0.739 0.45913E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67535E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41098E+04 86 goethite 6.14 2.38 -3.76 -0.812 0.66664E+04 87 graphite -3.37 -5.53 -2.16 -0.618 0.38398E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65368E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22532E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74570E+04 107 magnesite 0.56 -2.23 -2.79 -0.930 0.49497E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30053E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57555E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58904E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85324E+04 143 pyrite -20.64 -21.71 -1.06 -0.250 0.18872E+04 144 pyrrhotite -4.24 -9.10 -4.86 -1.621 0.86320E+04 145 pyrrhotiteFe0.875 -5.92 -9.54 -3.62 -1.331 0.64226E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40934E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37112E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50719E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29303E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81350E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75046E+04 171 sulfur -8.90 -12.60 -3.70 -1.140 0.65741E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71527E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -9.10 -4.73 -1.576 0.83932E+04 196 akaganeite 7.38 2.38 -5.00 -1.081 0.88707E+04 198 arsenic -6.91 -11.29 -4.38 -1.131 0.77778E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74524E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.289 0.80247E+04 203 beidellite-K -1.84 -6.16 -4.33 -0.265 0.76773E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74311E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70861E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -27.87 -1.22 -0.306 0.21736E+04 211 covellite -19.11 -20.24 -1.13 -0.430 0.20016E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46752E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71681E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72605E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71421E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67503E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45738E+04 254 cerussite -2.68 -6.74 -4.05 -1.351 0.71935E+04 255 chalcopyrite -27.58 -29.34 -1.76 -0.328 0.31275E+04 257 copper,native -2.74 -7.63 -4.89 -1.702 0.86845E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79106E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -5.20 -4.42 -1.473 0.78433E+04 274 wurtzite -8.29 -10.05 -1.76 -0.588 0.31311E+04 276 an20ab80 1.85 -1.44 -3.30 -0.254 0.58496E+04 277 an25ab75 2.44 -1.17 -3.60 -0.277 0.63918E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69439E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 13 Loop limit = 70 Temperature = 114.75 C Pressure = 500.00 bar Mixer fraction = 1.0000000 Water: Moles liquid = 0.1111E+03 kg liquid = 0.2002E+01 Moles total = 0.1108E+03 kg total = 0.1997E+01 Activity = 0.9744 Stoichiometric ionic strength = .8705884E+00 Osmotic coef. = 0.9306 True ionic strength = .7228320E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.18376E-04 -4.7358 0.11496E-04 -4.9395 0.62560E+00 -0.2037 2 H2O 0.97445E+00 -0.0112 0.97445E+00 -0.0112 3 Cl- 0.70761E+00 -0.1502 0.43636E+00 -0.3602 0.61667E+00 -0.2099 4 SO4-- 0.89123E-04 -4.0500 0.10972E-04 -4.9597 0.12311E+00 -0.9097 5 HCO3- 0.13303E-01 -1.8760 0.82635E-02 -2.0828 0.62116E+00 -0.2068 6 HS- 0.18857E-06 -6.7245 0.11636E-06 -6.9342 0.61705E+00 -0.2097 7 H4SiO4 0.14022E-02 -2.8532 0.14022E-02 -2.8532 0.10000E+01 0.0000 8 Al+++ 0.45626E-11 -11.3408 0.38111E-13 -13.4189 0.83531E-02 -2.0782 9 Ca++ 0.86681E-03 -3.0621 0.10064E-03 -3.9972 0.11611E+00 -0.9351 10 Mg++ 0.72724E-04 -4.1383 0.82292E-05 -5.0846 0.11316E+00 -0.9463 11 Fe++ 0.68375E-06 -6.1651 0.77818E-07 -7.1089 0.11381E+00 -0.9438 12 K+ 0.22570E-01 -1.6465 0.13994E-01 -1.8541 0.62001E+00 -0.2076 13 Na+ 0.69707E+00 -0.1567 0.42746E+00 -0.3691 0.61322E+00 -0.2124 14 Mn++ 0.10319E-04 -4.9864 0.11797E-05 -5.9282 0.11433E+00 -0.9418 15 Zn++ 0.76923E-07 -7.1139 0.87546E-08 -8.0578 0.11381E+00 -0.9438 16 Cu+ 0.18866E-12 -12.7243 0.11566E-12 -12.9368 0.61306E+00 -0.2125 17 Pb++ 0.21513E-08 -8.6673 0.25446E-09 -9.5944 0.11828E+00 -0.9271 18 Ag+ 0.50751E-12 -12.2946 0.31393E-12 -12.5032 0.61856E+00 -0.2086 19 Au+ 0.46765E-23 -23.3301 0.29035E-23 -23.5371 0.62086E+00 -0.2070 20 Ba++ 0.15512E-05 -5.8093 0.18587E-06 -6.7308 0.11982E+00 -0.9215 21 F- 0.72756E-03 -3.1381 0.44774E-03 -3.3490 0.61540E+00 -0.2108 22 H2AsO3- 0.48118E-07 -7.3177 0.32992E-07 -7.4816 0.68565E+00 -0.1639 24 HSiO3- 0.33881E-06 -6.4700 0.20894E-06 -6.6800 0.61667E+00 -0.2099 25 Ca(HSiO3)+ 0.86975E-09 -9.0606 0.54000E-09 -9.2676 0.62086E+00 -0.2070 26 Mg(HSiO3)+ 0.82781E-10 -10.0821 0.51396E-10 -10.2891 0.62086E+00 -0.2070 27 NaHSiO3,aq 0.10722E-05 -5.9697 0.10722E-05 -5.9697 0.10000E+01 0.0000 31 AgCl,aq 0.83853E-10 -10.0765 0.83853E-10 -10.0765 0.10000E+01 0.0000 32 AgCl2- 0.23995E-08 -8.6199 0.14797E-08 -8.8298 0.61667E+00 -0.2099 33 AgCl3-2 0.75357E-09 -9.1229 0.91594E-10 -10.0381 0.12155E+00 -0.9153 34 AgCl4-3 0.36026E-10 -10.4434 0.31593E-12 -12.5004 0.87695E-02 -2.0570 38 Ag(HS),aq 0.30630E-08 -8.5139 0.30630E-08 -8.5139 0.10000E+01 0.0000 40 AlO+ 0.13097E-09 -9.8828 0.81313E-10 -10.0898 0.62086E+00 -0.2070 41 AlOH+2 0.26056E-10 -10.5841 0.29954E-11 -11.5235 0.11496E+00 -0.9395 42 HAlO2,aq 0.23173E-08 -8.6350 0.23173E-08 -8.6350 0.10000E+01 0.0000 43 AlO2- 0.11455E-08 -8.9410 0.70423E-09 -9.1523 0.61480E+00 -0.2113 44 AsO2- 0.24997E-07 -7.6021 0.15415E-07 -7.8121 0.61667E+00 -0.2099 45 HAsO2,aq 0.24653E-04 -4.6081 0.24653E-04 -4.6081 0.10000E+01 0.0000 46 H3AsO3,aq 0.40016E-04 -4.3978 0.40016E-04 -4.3978 0.10000E+01 0.0000 62 BaCO3,aq 0.67129E-10 -10.1731 0.67129E-10 -10.1731 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.22584E-06 -6.6462 0.14116E-06 -6.8503 0.62508E+00 -0.2041 64 BaCl+ 0.25234E-06 -6.5980 0.15667E-06 -6.8050 0.62086E+00 -0.2070 65 BaF+ 0.36291E-09 -9.4402 0.22532E-09 -9.6472 0.62086E+00 -0.2070 66 CH4,aq 0.94683E-10 -10.0237 0.85923E-10 -10.0659 0.90748E+00 -0.0422 71 CO,aq 0.20441E-10 -10.6895 0.20441E-10 -10.6895 0.10000E+01 0.0000 72 CO2,aq 0.16141E+00 -0.7921 0.14647E+00 -0.8342 0.90748E+00 -0.0422 73 CO3-2 0.82051E-06 -6.0859 0.99731E-07 -7.0012 0.12155E+00 -0.9153 74 CaCO3,aq 0.14960E-06 -6.8251 0.14960E-06 -6.8251 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.39954E-04 -4.3984 0.24806E-04 -4.6054 0.62086E+00 -0.2070 76 CaCl+ 0.13552E-03 -3.8680 0.84140E-04 -4.0750 0.62086E+00 -0.2070 77 CaCl2,aq 0.72810E-05 -5.1378 0.72810E-05 -5.1378 0.10000E+01 0.0000 78 CaF+ 0.12591E-05 -5.8999 0.78174E-06 -6.1069 0.62086E+00 -0.2070 79 CaOH+ 0.22655E-08 -8.6448 0.14066E-08 -8.8518 0.62086E+00 -0.2070 80 CaSO4,aq 0.37651E-06 -6.4242 0.37651E-06 -6.4242 0.10000E+01 0.0000 81 HCl,aq 0.12571E-05 -5.9006 0.12571E-05 -5.9006 0.10000E+01 0.0000 90 CuCl,aq 0.26291E-09 -9.5802 0.26291E-09 -9.5802 0.10000E+01 0.0000 91 CuCl2- 0.30207E-08 -8.5199 0.18628E-08 -8.7298 0.61667E+00 -0.2099 92 CuCl3-2 0.35169E-09 -9.4538 0.42746E-10 -10.3691 0.12155E+00 -0.9153 98 HF,aq 0.37546E-04 -4.4254 0.37546E-04 -4.4254 0.10000E+01 0.0000 99 HF2- 0.80138E-08 -8.0962 0.49419E-08 -8.3061 0.61667E+00 -0.2099 101 FeCl+ 0.96825E-07 -7.0140 0.60115E-07 -7.2210 0.62086E+00 -0.2070 104 FeF+ 0.30816E-08 -8.5112 0.19132E-08 -8.7182 0.62086E+00 -0.2070 107 FeOH+ 0.76449E-09 -9.1166 0.47464E-09 -9.3236 0.62086E+00 -0.2070 113 H2,aq 0.43441E-08 -8.3621 0.39421E-08 -8.4043 0.90748E+00 -0.0422 114 KCl,aq 0.12618E-03 -3.8990 0.12618E-03 -3.8990 0.10000E+01 0.0000 116 KOH,aq 0.11459E-08 -8.9408 0.11459E-08 -8.9408 0.10000E+01 0.0000 117 KSO4- 0.44707E-05 -5.3496 0.27569E-05 -5.5596 0.61667E+00 -0.2099 118 MgCO3,aq 0.26781E-08 -8.5722 0.26781E-08 -8.5722 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.33096E-05 -5.4802 0.20548E-05 -5.6872 0.62086E+00 -0.2070 120 MgCl+ 0.93806E-05 -5.0278 0.58241E-05 -5.2348 0.62086E+00 -0.2070 121 MgF+ 0.36609E-06 -6.4364 0.22729E-06 -6.6434 0.62086E+00 -0.2070 122 MgOH+ 0.91844E-09 -9.0370 0.57022E-09 -9.2440 0.62086E+00 -0.2070 124 MnF+ 0.15741E-07 -7.8030 0.97731E-08 -8.0100 0.62086E+00 -0.2070 126 MnOH+ 0.11688E-08 -8.9323 0.72566E-09 -9.1393 0.62086E+00 -0.2070 131 MnCl+ 0.68781E-05 -5.1625 0.42704E-05 -5.3695 0.62086E+00 -0.2070 132 MnSO4,aq 0.42915E-08 -8.3674 0.42915E-08 -8.3674 0.10000E+01 0.0000 133 NaCl,aq 0.63875E-01 -1.1947 0.63875E-01 -1.1947 0.10000E+01 0.0000 134 NaF,aq 0.46265E-04 -4.3347 0.46265E-04 -4.3347 0.10000E+01 0.0000 135 NaOH,aq 0.33673E-07 -7.4727 0.33673E-07 -7.4727 0.10000E+01 0.0000 137 OH- 0.18381E-06 -6.7356 0.11300E-06 -6.9469 0.61480E+00 -0.2113 140 PbCl+ 0.12344E-07 -7.9085 0.76640E-08 -8.1155 0.62086E+00 -0.2070 141 PbCl2,aq 0.20824E-07 -7.6814 0.20824E-07 -7.6814 0.10000E+01 0.0000 142 PbCl3- 0.71508E-08 -8.1456 0.44097E-08 -8.3556 0.61667E+00 -0.2099 143 PbCl4-2 0.40130E-08 -8.3965 0.48777E-09 -9.3118 0.12155E+00 -0.9153 144 PbF+ 0.27067E-10 -10.5676 0.16805E-10 -10.7746 0.62086E+00 -0.2070 148 Pb(HS)2,aq 0.12636E-10 -10.8984 0.12636E-10 -10.8984 0.10000E+01 0.0000 150 H2S,aq 0.34771E-05 -5.4588 0.31554E-05 -5.5009 0.90748E+00 -0.0422 159 HSO4- 0.23178E-06 -6.6349 0.14521E-06 -6.8380 0.62647E+00 -0.2031 173 ZnCl+ 0.10278E-05 -5.9881 0.63815E-06 -6.1951 0.62086E+00 -0.2070 174 ZnCl2,aq 0.15657E-06 -6.8053 0.15657E-06 -6.8053 0.10000E+01 0.0000 175 ZnCl3- 0.15400E-07 -7.8125 0.94966E-08 -8.0224 0.61667E+00 -0.2099 176 ZnF+ 0.21698E-09 -9.6636 0.13472E-09 -9.8706 0.62086E+00 -0.2070 178 ZnOH+ 0.17462E-07 -7.7579 0.10842E-07 -7.9649 0.62086E+00 -0.2070 Charge balance for all species = -.6473E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1837562E-04 0.1615300E+00 0.1544897E+03 0.0000 2 H2O 0.1000000E+01 0.5534682E+02 0.9461192E+06 0.0000 3 Cl- 0.7076060E+00 0.7717764E+00 0.2596308E+05 4.5793 4 SO4-- 0.8912274E-04 0.9420486E-04 0.8586869E+01 4.9192 5 HCO3- 0.1330333E-01 0.1747549E+00 0.1011797E+05 2.8566 6 HS- 0.1885742E-06 0.3669982E-05 0.1151691E+00 -1.9947 7 H4SiO4 0.1402179E-02 0.1403591E-02 0.1280104E+03 -2.8532 8 Al+++ 0.4562571E-11 0.3624343E-08 0.9279127E-04 1.3994 9 Ca++ 0.8668089E-03 0.1051354E-02 0.3998219E+02 5.8817 10 Mg++ 0.7272351E-04 0.8578355E-04 0.1978957E+01 4.7943 11 Fe++ 0.6837525E-06 0.7844261E-06 0.4156843E-01 2.7700 12 K+ 0.2257024E-01 0.2270089E-01 0.8422744E+03 3.0854 13 Na+ 0.6970663E+00 0.7609885E+00 0.1660065E+05 4.5704 14 Mn++ 0.1031861E-04 0.1721796E-04 0.8975655E+00 3.9507 15 Zn++ 0.7692280E-07 0.1294414E-05 0.8029036E-01 1.8212 16 Cu+ 0.1886634E-12 0.3635524E-08 0.2191926E-03 -7.9973 17 Pb++ 0.2151319E-08 0.4652342E-07 0.9146441E-02 0.2845 18 Ag+ 0.5075119E-12 0.6336580E-08 0.6485857E-03 -7.5637 19 Au+ 0.4676515E-23 0.1498838E-11 0.2801302E-06 -18.5976 20 Ba++ 0.1551161E-05 0.2029771E-05 0.2645183E+00 3.1481 21 F- 0.7275551E-03 0.8130270E-03 0.1465631E+02 1.5905 22 H2AsO3- 0.4811845E-07 0.6474252E-04 0.7675168E+01 -2.5421 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234466E+00 -.1144903E-04 0.0000000E+00 2 H2O 0.1108261E+03 0.1108261E+03 -.1628764E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886352E-03 0.4071909E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7348748E-05 0.6681563E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810541E-02 0.1200011E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.7257361E-08 0.2400022E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570730E-05 0.3257548E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2591926E-05 0.4876250E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.7279749E-08 0.1628774E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.9315819E-07 0.1471862E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1268833E-07 0.4144398E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.3001264E-11 0.1096967E-12 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1628000E-02 0.2400022E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.3388E-20 Mass of aqueous solution: 0.211027E+04 g Temperature = 114.75 C Pressure = 500.00 bar Mixer frac. = 1.0000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2072E-06 -6.684 0.5135E-04 -4.289 4.602 0.7211E-05 bornite 0.3258E-07 -7.487 0.1635E-04 -4.787 1.465 0.3216E-05 topaz 0.1200E-05 -5.921 0.2209E-03 -3.656 19.79 0.6183E-04 galena 0.1472E-05 -5.832 0.3521E-03 -3.453 31.56 0.4635E-04 sphalerite 0.4876E-05 -5.312 0.4751E-03 -3.323 42.58 0.1162E-03 gold,native 0.1097E-12 -12.960 0.2161E-10 -10.665 0.1936E-05 0.1121E-11 silver,native 0.9416E-13 -13.026 0.1016E-10 -10.993 0.9103E-06 0.9673E-12 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5381E+00 0.2067E+00 0.3842 -0.685 silver,native 0.4619E+00 0.9338E-01 0.2022 -1.030 Total fraction of mixing solution added: 1.0000000 Solid products produced: Mass = 0.001116 g Volume = 0.000235 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 114.7501 deg.C Sat. pressure: 37.3084 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6908E-01 0.8132 0.2096E+01 0.2577E+01 CO2,gas 0.9309E+00 0.9141 0.3175E+02 0.3473E+02 CH4,gas 0.6121E-08 1.0325 0.2358E-06 0.2284E-06 H2,gas 0.1872E-06 1.0193 0.7118E-05 0.6983E-05 H2S,gas 0.4866E-05 0.8805 0.1598E-03 0.1815E-03 S2,gas 0.4141E-17 1.0000 0.1545E-15 0.1545E-15 CO,gas 0.1281E-08 1.0000 0.4778E-07 0.4778E-07 SO3,gas 0.3206E-30 1.0000 0.1196E-28 0.1196E-28 O2,gas 0.8569E-51 1.0000 0.3197E-49 0.3197E-49 SO2,gas 0.7314E-14 1.0000 0.2729E-12 0.2729E-12 HF,gas 0.5298E-08 1.0000 0.1977E-06 0.1977E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.00 -27.00 0.00 0.000 -0.63059E-11 206 bornite -85.08 -85.08 0.00 0.000 0.00000E+00 226 topaz -16.63 -16.63 0.00 0.000 0.00000E+00 261 galena -11.59 -11.59 0.00 0.000 0.31530E-11 262 gold,native -17.55 -17.55 0.00 0.000 0.12612E-10 263 silver,native -6.17 -6.17 0.00 0.000 -0.50448E-10 273 sphalerite -10.05 -10.05 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 2.37 -0.01 -2.38 -2.378 0.42201E+04 0.321 2 CO2,gas -5.81 -7.01 -1.20 -0.399 0.21251E+04 1.502 3 CH4,gas 5.26 -4.07 -9.33 -2.332 0.16554E+05 -6.627 4 H2,gas 8.58 0.73 -7.85 -4.484 0.13928E+05 -5.148 5 H2S,gas -5.38 -11.87 -6.50 -3.248 0.11529E+05 -3.796 6 S2,gas -6.70 -25.21 -18.51 -2.848 0.32855E+05 -15.811 7 CO,gas 3.75 -6.27 -10.02 -3.083 0.17785E+05 -7.321 8 SO3,gas 16.79 -14.83 -31.62 -7.905 0.56127E+05 -28.922 9 O2,gas 50.71 -1.48 -52.19 -34.796 0.92643E+05 -49.495 10 SO2,gas 1.18 -14.09 -15.26 -4.070 0.27091E+05 -12.564 11 HF,gas 1.11 -8.29 -9.40 -4.702 0.16690E+05 -6.704 12 HCl,gas 2.94 -5.30 -8.24 -4.118 0.14619E+05 -8.236 17 albite-high 0.64 -2.54 -3.19 -0.245 0.56603E+04 18 albite -0.36 -2.54 -2.18 -0.168 0.38772E+04 22 analcite 3.18 0.27 -2.90 -0.322 0.51515E+04 23 andalusite 4.28 -0.07 -4.35 -0.435 0.77181E+04 26 anhydrite -5.26 -8.96 -3.70 -1.851 0.65701E+04 27 ankerite -2.14 -5.39 -3.25 -0.542 0.57766E+04 34 aragonite 0.93 -1.14 -2.07 -0.691 0.36809E+04 36 calcite 0.80 -1.14 -1.94 -0.645 0.34357E+04 53 coesite -2.24 -2.83 -0.59 -0.196 0.10441E+04 58 corundum 7.46 2.77 -4.70 -0.427 0.83411E+04 60 cristobalite -2.40 -2.83 -0.44 -0.145 0.77214E+03 65 diaspore 2.50 1.38 -1.12 -0.187 0.19954E+04 66 diamond -2.94 -5.53 -2.59 -0.739 0.45913E+04 69 dolomite,ordered 0.44 -3.37 -3.80 -0.634 0.67535E+04 83 gibbsite 3.68 1.37 -2.32 -0.331 0.41098E+04 86 goethite 6.14 2.38 -3.76 -0.812 0.66664E+04 87 graphite -3.37 -5.53 -2.16 -0.618 0.38398E+04 90 halite 1.61 -0.73 -2.34 -1.169 0.41489E+04 96 jadeite 3.97 0.29 -3.68 -0.368 0.65368E+04 99 kaolinite -1.65 -2.92 -1.27 -0.115 0.22532E+04 100 kyanite 4.14 -0.07 -4.20 -0.420 0.74570E+04 107 magnesite 0.56 -2.23 -2.79 -0.930 0.49497E+04 117 microcline -2.34 -4.03 -1.69 -0.130 0.30053E+04 121 muscovite 1.97 -1.28 -3.24 -0.191 0.57555E+04 122 paragonite 3.53 0.21 -3.32 -0.195 0.58904E+04 123 nepheline 7.92 3.12 -4.81 -0.687 0.85324E+04 143 pyrite -20.64 -21.71 -1.06 -0.250 0.18872E+04 144 pyrrhotite -4.24 -9.10 -4.86 -1.621 0.86320E+04 145 pyrrhotiteFe0.875 -5.92 -9.54 -3.62 -1.331 0.64226E+04 147 pyrophyllite -6.26 -8.57 -2.31 -0.144 0.40934E+04 148 quartz -2.82 -2.83 -0.01 -0.002 0.12769E+02 153 rhodochrosite -0.98 -3.07 -2.09 -0.697 0.37112E+04 155 sanidine -1.17 -4.03 -2.86 -0.220 0.50719E+04 157 siderite -2.60 -4.25 -1.65 -0.550 0.29303E+04 158 sillimanite 4.52 -0.07 -4.58 -0.458 0.81350E+04 165 stilbite -7.03 -11.26 -4.23 -0.201 0.75046E+04 171 sulfur -8.90 -12.60 -3.70 -1.140 0.65741E+04 172 sylvite 1.43 -2.21 -3.65 -1.823 0.64732E+04 180 topaz-H 3.95 -0.08 -4.03 -0.366 0.71527E+04 181 tridymite -2.45 -2.83 -0.38 -0.127 0.67479E+03 184 troilite-low -4.38 -9.10 -4.73 -1.576 0.83932E+04 196 akaganeite 7.38 2.38 -5.00 -1.081 0.88707E+04 198 arsenic -6.91 -11.29 -4.38 -1.131 0.77778E+04 201 beidellite-Ca -2.01 -6.21 -4.20 -0.260 0.74524E+04 202 beidellite-H -2.66 -7.18 -4.52 -0.289 0.80247E+04 203 beidellite-K -1.84 -6.16 -4.33 -0.265 0.76773E+04 204 beidellite-Mg -2.20 -6.39 -4.19 -0.259 0.74311E+04 205 beidellite-Na -1.68 -5.67 -3.99 -0.244 0.70861E+04 208 chalcedony -2.64 -2.83 -0.19 -0.062 0.33169E+03 209 chalcocite -26.64 -27.87 -1.22 -0.306 0.21736E+04 211 covellite -19.11 -20.24 -1.13 -0.430 0.20016E+04 212 dawsonite 1.56 -1.07 -2.63 -0.329 0.46752E+04 214 montmorillonite-Ca -2.44 -6.48 -4.04 -0.250 0.71681E+04 215 montmorillonite-K -2.34 -6.43 -4.09 -0.250 0.72605E+04 216 montmorillonite-Mg -2.63 -6.66 -4.02 -0.249 0.71421E+04 217 montmorillonite-Na -2.14 -5.94 -3.80 -0.233 0.67503E+04 230 gypsum -4.83 -8.98 -4.15 -1.038 0.73695E+04 246 acanthite -26.89 -27.00 -0.11 -0.027 0.18856E+03 252 barite -9.20 -11.69 -2.49 -1.247 0.44283E+04 253 boehmite 3.95 1.38 -2.58 -0.429 0.45738E+04 254 cerussite -2.68 -6.74 -4.05 -1.351 0.71935E+04 255 chalcopyrite -27.58 -29.34 -1.76 -0.328 0.31275E+04 257 copper,native -2.74 -7.63 -4.89 -1.702 0.86845E+04 258 dolomite,disordered 1.09 -3.37 -4.46 -0.743 0.79106E+04 260 fluorite -9.68 -10.70 -1.01 -0.338 0.17988E+04 270 silica-amorphous -1.94 -2.83 -0.89 -0.297 0.15818E+04 271 smithsonite -0.78 -5.20 -4.42 -1.473 0.78433E+04 274 wurtzite -8.29 -10.05 -1.76 -0.588 0.31311E+04 276 an20ab80 1.85 -1.44 -3.30 -0.254 0.58496E+04 277 an25ab75 2.44 -1.17 -3.60 -0.277 0.63918E+04 278 an30ab70 3.02 -0.89 -3.91 -0.301 0.69439E+04 Calculations done for 114.7501 Deg. C; 500.0000 bar Mixer fraction: 1.0000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 114.750 .87059E+00 2.229 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1126E+03 New heat: 2.154 New temperature: 110.568 New mixer fraction: 1.1000000 Resulting temperature: 110.568Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 110.57 C Pressure = 500.00 bar Mixer fraction = 1.1000000 Water: Moles liquid = 0.1167E+03 kg liquid = 0.2102E+01 Moles total = 0.1164E+03 kg total = 0.2097E+01 Activity = 0.9757 Stoichiometric ionic strength = .8290637E+00 Osmotic coef. = 0.9305 True ionic strength = .6923046E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.19001E-04 -4.7212 0.12023E-04 -4.9200 0.63274E+00 -0.1988 2 H2O 0.97565E+00 -0.0107 0.97565E+00 -0.0107 3 Cl- 0.67778E+00 -0.1689 0.42163E+00 -0.3751 0.62207E+00 -0.2062 4 SO4-- 0.85104E-04 -4.0701 0.11018E-04 -4.9579 0.12947E+00 -0.8878 5 HCO3- 0.12673E-01 -1.8971 0.79330E-02 -2.1006 0.62596E+00 -0.2035 6 HS- 0.16501E-06 -6.7825 0.10270E-06 -6.9884 0.62238E+00 -0.2059 7 H4SiO4 0.13356E-02 -2.8743 0.13356E-02 -2.8743 0.10000E+01 0.0000 8 Al+++ 0.59474E-11 -11.2257 0.55982E-13 -13.2520 0.94129E-02 -2.0263 9 Ca++ 0.83565E-03 -3.0780 0.10233E-03 -3.9900 0.12246E+00 -0.9120 10 Mg++ 0.69805E-04 -4.1561 0.83527E-05 -5.0782 0.11966E+00 -0.9221 11 Fe++ 0.65556E-06 -6.1834 0.78844E-07 -7.1032 0.12027E+00 -0.9198 12 K+ 0.21510E-01 -1.6674 0.13435E-01 -1.8718 0.62461E+00 -0.2044 13 Na+ 0.66773E+00 -0.1754 0.41299E+00 -0.3841 0.61851E+00 -0.2087 14 Mn++ 0.10254E-04 -4.9891 0.12383E-05 -5.9072 0.12076E+00 -0.9181 15 Zn++ 0.79995E-07 -7.0969 0.96210E-08 -8.0168 0.12027E+00 -0.9198 16 Cu+ 0.14372E-12 -12.8425 0.88872E-13 -13.0512 0.61837E+00 -0.2088 17 Pb++ 0.19277E-08 -8.7150 0.24012E-09 -9.6196 0.12457E+00 -0.9046 18 Ag+ 0.38092E-12 -12.4192 0.23742E-12 -12.6245 0.62328E+00 -0.2053 19 Au+ 0.28602E-23 -23.5436 0.17887E-23 -23.7475 0.62539E+00 -0.2038 20 Ba++ 0.15130E-05 -5.8202 0.19075E-06 -6.7195 0.12607E+00 -0.8994 21 F- 0.69696E-03 -3.1568 0.43361E-03 -3.3629 0.62215E+00 -0.2061 22 H2AsO3- 0.39141E-07 -7.4074 0.26901E-07 -7.5702 0.68728E+00 -0.1629 24 HSiO3- 0.29278E-06 -6.5335 0.18213E-06 -6.7396 0.62207E+00 -0.2062 25 Ca(HSiO3)+ 0.71539E-09 -9.1455 0.44740E-09 -9.3493 0.62539E+00 -0.2038 26 Mg(HSiO3)+ 0.69157E-10 -10.1602 0.43250E-10 -10.3640 0.62539E+00 -0.2038 27 NaHSiO3,aq 0.94203E-06 -6.0259 0.94203E-06 -6.0259 0.10000E+01 0.0000 31 AgCl,aq 0.62607E-10 -10.2034 0.62607E-10 -10.2034 0.10000E+01 0.0000 32 AgCl2- 0.17338E-08 -8.7610 0.10785E-08 -8.9672 0.62207E+00 -0.2062 33 AgCl3-2 0.52010E-09 -9.2839 0.66548E-10 -10.1769 0.12795E+00 -0.8930 34 AgCl4-3 0.23213E-10 -10.6343 0.22977E-12 -12.6387 0.98982E-02 -2.0044 38 Ag(HS),aq 0.28116E-08 -8.5510 0.28116E-08 -8.5510 0.10000E+01 0.0000 40 AlO+ 0.12582E-09 -9.9003 0.78685E-10 -10.1041 0.62539E+00 -0.2038 41 AlOH+2 0.28600E-10 -10.5436 0.34709E-11 -11.4596 0.12136E+00 -0.9159 42 HAlO2,aq 0.18953E-08 -8.7223 0.18953E-08 -8.7223 0.10000E+01 0.0000 43 AlO2- 0.79368E-09 -9.1004 0.49312E-09 -9.3071 0.62130E+00 -0.2067 44 AsO2- 0.21696E-07 -7.6636 0.13496E-07 -7.8698 0.62207E+00 -0.2062 45 HAsO2,aq 0.23932E-04 -4.6210 0.23932E-04 -4.6210 0.10000E+01 0.0000 46 H3AsO3,aq 0.37670E-04 -4.4240 0.37670E-04 -4.4240 0.10000E+01 0.0000 62 BaCO3,aq 0.57748E-10 -10.2385 0.57748E-10 -10.2385 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.19418E-06 -6.7118 0.12219E-06 -6.9129 0.62930E+00 -0.2011 64 BaCl+ 0.22569E-06 -6.6465 0.14114E-06 -6.8503 0.62539E+00 -0.2038 65 BaF+ 0.33025E-09 -9.4812 0.20653E-09 -9.6850 0.62539E+00 -0.2038 66 CH4,aq 0.80248E-10 -10.0956 0.72947E-10 -10.1370 0.90902E+00 -0.0414 71 CO,aq 0.14721E-10 -10.8321 0.14721E-10 -10.8321 0.10000E+01 0.0000 72 CO2,aq 0.15373E+00 -0.8132 0.13974E+00 -0.8547 0.90902E+00 -0.0414 73 CO3-2 0.72555E-06 -6.1393 0.92835E-07 -7.0323 0.12795E+00 -0.8930 74 CaCO3,aq 0.12795E-06 -6.8929 0.12795E-06 -6.8929 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.35942E-04 -4.4444 0.22478E-04 -4.6482 0.62539E+00 -0.2038 76 CaCl+ 0.12176E-03 -3.9145 0.76150E-04 -4.1183 0.62539E+00 -0.2038 77 CaCl2,aq 0.63714E-05 -5.1958 0.63714E-05 -5.1958 0.10000E+01 0.0000 78 CaF+ 0.11321E-05 -5.9461 0.70803E-06 -6.1500 0.62539E+00 -0.2038 79 CaOH+ 0.16990E-08 -8.7698 0.10625E-08 -8.9737 0.62539E+00 -0.2038 80 CaSO4,aq 0.36090E-06 -6.4426 0.36090E-06 -6.4426 0.10000E+01 0.0000 81 HCl,aq 0.12350E-05 -5.9083 0.12350E-05 -5.9083 0.10000E+01 0.0000 90 CuCl,aq 0.19905E-09 -9.7010 0.19905E-09 -9.7010 0.10000E+01 0.0000 91 CuCl2- 0.21940E-08 -8.6588 0.13648E-08 -8.8649 0.62207E+00 -0.2062 92 CuCl3-2 0.24493E-09 -9.6110 0.31339E-10 -10.5039 0.12795E+00 -0.8930 98 HF,aq 0.34723E-04 -4.4594 0.34723E-04 -4.4594 0.10000E+01 0.0000 99 HF2- 0.70855E-08 -8.1496 0.44077E-08 -8.3558 0.62207E+00 -0.2062 101 FeCl+ 0.87931E-07 -7.0559 0.54991E-07 -7.2597 0.62539E+00 -0.2038 104 FeF+ 0.28353E-08 -8.5474 0.17732E-08 -8.7512 0.62539E+00 -0.2038 107 FeOH+ 0.61960E-09 -9.2079 0.38749E-09 -9.4117 0.62539E+00 -0.2038 113 H2,aq 0.33642E-08 -8.4731 0.30582E-08 -8.5145 0.90902E+00 -0.0414 114 KCl,aq 0.10693E-03 -3.9709 0.10693E-03 -3.9709 0.10000E+01 0.0000 116 KOH,aq 0.88725E-09 -9.0520 0.88725E-09 -9.0520 0.10000E+01 0.0000 117 KSO4- 0.40455E-05 -5.3930 0.25165E-05 -5.5992 0.62207E+00 -0.2062 118 MgCO3,aq 0.23518E-08 -8.6286 0.23518E-08 -8.6286 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.29732E-05 -5.5268 0.18594E-05 -5.7306 0.62539E+00 -0.2038 120 MgCl+ 0.85904E-05 -5.0660 0.53723E-05 -5.2698 0.62539E+00 -0.2038 121 MgF+ 0.33202E-06 -6.4788 0.20765E-06 -6.6827 0.62539E+00 -0.2038 122 MgOH+ 0.70740E-09 -9.1503 0.44240E-09 -9.3542 0.62539E+00 -0.2038 124 MnF+ 0.14872E-07 -7.8276 0.93010E-08 -8.0315 0.62539E+00 -0.2038 126 MnOH+ 0.96121E-09 -9.0172 0.60113E-09 -9.2210 0.62539E+00 -0.2038 131 MnCl+ 0.61247E-05 -5.2129 0.38303E-05 -5.4168 0.62539E+00 -0.2038 132 MnSO4,aq 0.41946E-08 -8.3773 0.41946E-08 -8.3773 0.10000E+01 0.0000 133 NaCl,aq 0.57023E-01 -1.2439 0.57023E-01 -1.2439 0.10000E+01 0.0000 134 NaF,aq 0.41175E-04 -4.3854 0.41175E-04 -4.3854 0.10000E+01 0.0000 135 NaOH,aq 0.26746E-07 -7.5727 0.26746E-07 -7.5727 0.10000E+01 0.0000 137 OH- 0.15197E-06 -6.8183 0.94417E-07 -7.0250 0.62130E+00 -0.2067 140 PbCl+ 0.10493E-07 -7.9791 0.65625E-08 -8.1829 0.62539E+00 -0.2038 141 PbCl2,aq 0.16552E-07 -7.7811 0.16552E-07 -7.7811 0.10000E+01 0.0000 142 PbCl3- 0.53528E-08 -8.2714 0.33298E-08 -8.4776 0.62207E+00 -0.2062 143 PbCl4-2 0.28212E-08 -8.5496 0.36098E-09 -9.4425 0.12795E+00 -0.8930 144 PbF+ 0.23646E-10 -10.6262 0.14788E-10 -10.8301 0.62539E+00 -0.2038 148 Pb(HS)2,aq 0.10407E-10 -10.9827 0.10407E-10 -10.9827 0.10000E+01 0.0000 150 H2S,aq 0.32110E-05 -5.4934 0.29189E-05 -5.5348 0.90902E+00 -0.0414 159 HSO4- 0.21078E-06 -6.6762 0.13296E-06 -6.8763 0.63080E+00 -0.2001 173 ZnCl+ 0.88727E-06 -6.0519 0.55489E-06 -6.2558 0.62539E+00 -0.2038 174 ZnCl2,aq 0.13108E-06 -6.8825 0.13108E-06 -6.8825 0.10000E+01 0.0000 175 ZnCl3- 0.12637E-07 -7.8984 0.78609E-08 -8.1045 0.62207E+00 -0.2062 176 ZnF+ 0.21538E-09 -9.6668 0.13470E-09 -9.8706 0.62539E+00 -0.2038 178 ZnOH+ 0.14247E-07 -7.8463 0.89098E-08 -8.0501 0.62539E+00 -0.2038 Charge balance for all species = -.6165E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1900097E-04 0.1538470E+00 0.1475002E+03 0.0000 2 H2O 0.1000000E+01 0.5535450E+02 0.9485570E+06 0.0000 3 Cl- 0.6777846E+00 0.7350670E+00 0.2478843E+05 4.5449 4 SO4-- 0.8510357E-04 0.8972400E-04 0.8198369E+01 4.8821 5 HCO3- 0.1267344E-01 0.1664427E+00 0.9660198E+04 2.8194 6 HS- 0.1650103E-06 0.3379813E-05 0.1063218E+00 -2.0684 7 H4SiO4 0.1335593E-02 0.1336829E-02 0.1222187E+03 -2.8743 8 Al+++ 0.5947355E-11 0.2849315E-08 0.7312663E-04 1.5081 9 Ca++ 0.8356455E-03 0.1001346E-02 0.3817326E+02 5.8500 10 Mg++ 0.6980451E-04 0.8170327E-04 0.1889423E+01 4.7618 11 Fe++ 0.6555627E-06 0.7469501E-06 0.3967898E-01 2.7368 12 K+ 0.2151015E-01 0.2162113E-01 0.8041671E+03 3.0483 13 Na+ 0.6677267E+00 0.7247922E+00 0.1584958E+05 4.5359 14 Mn++ 0.1025426E-04 0.1639899E-04 0.8569567E+00 3.9328 15 Zn++ 0.7999535E-07 0.1125448E-05 0.6997983E-01 1.8232 16 Cu+ 0.1437194E-12 0.2638131E-08 0.1594456E-03 -8.1312 17 Pb++ 0.1927677E-08 0.3718170E-07 0.7327690E-02 0.2204 18 Ag+ 0.3809203E-12 0.5151868E-08 0.5286089E-03 -7.7045 19 Au+ 0.2860188E-23 0.1260273E-11 0.2361170E-06 -18.8275 20 Ba++ 0.1512970E-05 0.1933225E-05 0.2525507E+00 3.1205 21 F- 0.6969597E-03 0.7743549E-03 0.1399320E+02 1.5571 22 H2AsO3- 0.3914122E-07 0.6166305E-04 0.7327918E+01 -2.6502 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234469E+00 -.1169427E-04 0.0000000E+00 2 H2O 0.1163769E+03 0.1163769E+03 -.1646065E-07 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4115163E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7105697E-05 0.6924614E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2810540E-02 0.1200644E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.5990381E-08 0.2401289E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570383E-05 0.3292215E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2366134E-05 0.5102042E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.5546390E-08 0.1646107E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.7817056E-07 0.1486850E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1083125E-07 0.4162968E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.2649590E-11 0.4613707E-12 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627999E-02 0.2401289E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1271E-20 Mass of aqueous solution: 0.221027E+04 g Temperature = 110.57 C Pressure = 500.00 bar Mixer frac. = 1.1000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2081E-06 -6.682 0.5158E-04 -4.288 4.517 0.7243E-05 bornite 0.3292E-07 -7.483 0.1652E-04 -4.782 1.447 0.3250E-05 topaz 0.1201E-05 -5.921 0.2210E-03 -3.656 19.35 0.6186E-04 galena 0.1487E-05 -5.828 0.3557E-03 -3.449 31.15 0.4682E-04 gold,native 0.4614E-12 -12.336 0.9088E-10 -10.042 0.7958E-05 0.4713E-11 silver,native 0.3847E-12 -12.415 0.4149E-10 -10.382 0.3634E-05 0.3951E-11 sphalerite 0.5102E-05 -5.292 0.4971E-03 -3.304 43.53 0.1216E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5453E+00 0.2140E+00 0.3924 -0.670 silver,native 0.4547E+00 0.8665E-01 0.1906 -1.062 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.1000000 Solid products produced: Mass = 0.001142 g Volume = 0.000241 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 110.5683 deg.C Sat. pressure: 34.5105 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6444E-01 0.8248 0.1834E+01 0.2224E+01 CO2,gas 0.9356E+00 0.9168 0.2960E+02 0.3229E+02 CH4,gas 0.5712E-08 1.0294 0.2029E-06 0.1971E-06 H2,gas 0.1610E-06 1.0181 0.5655E-05 0.5555E-05 H2S,gas 0.4735E-05 0.8857 0.1447E-03 0.1634E-03 S2,gas 0.3260E-17 1.0000 0.1125E-15 0.1125E-15 CO,gas 0.1021E-08 1.0000 0.3525E-07 0.3525E-07 SO3,gas 0.1599E-30 1.0000 0.5519E-29 0.5519E-29 O2,gas 0.2176E-51 1.0000 0.7511E-50 0.7511E-50 SO2,gas 0.5386E-14 1.0000 0.1859E-12 0.1859E-12 HF,gas 0.4549E-08 1.0000 0.1570E-06 0.1570E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 197 argentite -27.32 -27.32 0.00 0.000 0.62380E-11 206 bornite -85.91 -85.91 0.00 0.000 0.00000E+00 226 topaz -16.42 -16.42 0.00 0.000 0.62380E-11 261 galena -11.69 -11.69 0.00 0.000 0.00000E+00 262 gold,native -17.80 -17.80 0.00 0.000 -0.12476E-10 263 silver,native -6.29 -6.29 0.00 0.000 0.15595E-11 273 sphalerite -10.09 -10.09 0.00 0.000 0.00000E+00 148 quartz -2.85 -2.85 0.00 0.000 -0.20775E+01 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 2.42 -0.01 -2.44 -2.436 0.42764E+04 0.263 2 CO2,gas -5.78 -7.01 -1.23 -0.409 0.21556E+04 1.471 3 CH4,gas 5.25 -4.14 -9.39 -2.348 0.16490E+05 -6.693 4 H2,gas 8.66 0.71 -7.95 -4.541 0.13953E+05 -5.248 5 H2S,gas -5.37 -11.91 -6.54 -3.269 0.11480E+05 -3.839 6 S2,gas -6.59 -25.24 -18.65 -2.869 0.32742E+05 -15.949 7 CO,gas 3.86 -6.29 -10.15 -3.124 0.17825E+05 -7.453 8 SO3,gas 17.17 -14.79 -31.96 -7.989 0.56111E+05 -29.258 9 O2,gas 51.38 -1.44 -52.82 -35.216 0.92749E+05 -50.124 10 SO2,gas 1.36 -14.06 -15.43 -4.115 0.27092E+05 -12.731 11 HF,gas 1.22 -8.28 -9.50 -4.752 0.16686E+05 -6.804 12 HCl,gas 3.06 -5.30 -8.36 -4.178 0.14673E+05 -8.357 17 albite-high 0.78 -2.54 -3.31 -0.255 0.58186E+04 18 albite -0.25 -2.54 -2.29 -0.176 0.40189E+04 22 analcite 3.32 0.31 -3.02 -0.335 0.52961E+04 23 andalusite 4.62 0.13 -4.49 -0.449 0.78783E+04 26 anhydrite -5.18 -8.95 -3.76 -1.882 0.66097E+04 27 ankerite -2.04 -5.45 -3.42 -0.569 0.59984E+04 34 aragonite 0.99 -1.17 -2.16 -0.720 0.37924E+04 36 calcite 0.85 -1.17 -2.02 -0.674 0.35499E+04 53 coesite -2.27 -2.85 -0.59 -0.195 0.10278E+04 58 corundum 7.83 2.98 -4.85 -0.441 0.85161E+04 60 cristobalite -2.42 -2.85 -0.44 -0.145 0.76407E+03 65 diaspore 2.65 1.49 -1.17 -0.195 0.20507E+04 66 diamond -3.00 -5.57 -2.57 -0.734 0.45107E+04 69 dolomite,ordered 0.56 -3.43 -3.99 -0.665 0.70072E+04 83 gibbsite 3.83 1.48 -2.36 -0.337 0.41378E+04 86 goethite 6.24 2.36 -3.88 -0.840 0.68189E+04 87 graphite -3.42 -5.57 -2.14 -0.612 0.37632E+04 90 halite 1.62 -0.76 -2.38 -1.188 0.41705E+04 96 jadeite 4.11 0.32 -3.79 -0.379 0.66613E+04 99 kaolinite -1.43 -2.74 -1.31 -0.119 0.23040E+04 100 kyanite 4.46 0.13 -4.33 -0.433 0.76080E+04 107 magnesite 0.64 -2.26 -2.90 -0.967 0.50912E+04 117 microcline -2.26 -4.02 -1.76 -0.136 0.30960E+04 121 muscovite 2.35 -1.05 -3.40 -0.200 0.59690E+04 122 paragonite 3.94 0.44 -3.50 -0.206 0.61463E+04 123 nepheline 8.13 3.17 -4.96 -0.708 0.87014E+04 143 pyrite -20.76 -21.79 -1.03 -0.243 0.18154E+04 144 pyrrhotite -4.21 -9.17 -4.97 -1.655 0.87180E+04 145 pyrrhotiteFe0.875 -5.91 -9.60 -3.69 -1.358 0.64815E+04 147 pyrophyllite -6.07 -8.44 -2.36 -0.148 0.41520E+04 153 rhodochrosite -0.94 -3.09 -2.15 -0.717 0.37750E+04 155 sanidine -1.08 -4.02 -2.94 -0.226 0.51624E+04 157 siderite -2.56 -4.28 -1.73 -0.576 0.30353E+04 158 sillimanite 4.86 0.13 -4.73 -0.473 0.82981E+04 165 stilbite -6.92 -11.22 -4.30 -0.205 0.75521E+04 171 sulfur -8.94 -12.62 -3.68 -1.132 0.64618E+04 172 sylvite 1.43 -2.25 -3.67 -1.836 0.64484E+04 180 topaz-H 4.24 0.12 -4.12 -0.375 0.72412E+04 181 tridymite -2.47 -2.85 -0.38 -0.126 0.66396E+03 184 troilite-low -4.35 -9.17 -4.83 -1.609 0.84738E+04 198 arsenic -7.00 -11.39 -4.39 -1.133 0.77096E+04 201 beidellite-Ca -1.72 -6.04 -4.32 -0.267 0.75816E+04 202 beidellite-H -2.38 -7.01 -4.62 -0.295 0.81170E+04 203 beidellite-K -1.57 -6.00 -4.43 -0.272 0.77855E+04 204 beidellite-Mg -1.91 -6.22 -4.31 -0.267 0.75666E+04 205 beidellite-Na -1.40 -5.51 -4.11 -0.251 0.72091E+04 208 chalcedony -2.67 -2.85 -0.18 -0.060 0.31693E+03 209 chalcocite -26.94 -28.17 -1.23 -0.308 0.21607E+04 211 covellite -19.30 -20.40 -1.10 -0.418 0.19265E+04 212 dawsonite 1.67 -1.00 -2.67 -0.333 0.46806E+04 214 montmorillonite-Ca -2.23 -6.40 -4.16 -0.258 0.73126E+04 215 montmorillonite-K -2.15 -6.36 -4.21 -0.258 0.73876E+04 216 montmorillonite-Mg -2.43 -6.58 -4.15 -0.257 0.72924E+04 217 montmorillonite-Na -1.94 -5.87 -3.92 -0.240 0.68889E+04 230 gypsum -4.79 -8.97 -4.18 -1.045 0.73408E+04 246 acanthite -27.22 -27.32 -0.10 -0.025 0.17801E+03 252 barite -9.19 -11.68 -2.49 -1.245 0.43736E+04 253 boehmite 4.13 1.49 -2.65 -0.441 0.46450E+04 254 cerussite -2.69 -6.80 -4.11 -1.372 0.72247E+04 255 chalcopyrite -27.78 -29.57 -1.79 -0.332 0.31377E+04 257 copper,native -2.81 -7.78 -4.97 -1.727 0.87199E+04 258 dolomite,disordered 1.23 -3.43 -4.66 -0.776 0.81755E+04 260 fluorite -9.66 -10.72 -1.05 -0.351 0.18480E+04 270 silica-amorphous -1.96 -2.85 -0.90 -0.299 0.15752E+04 271 smithsonite -0.72 -5.20 -4.48 -1.492 0.78577E+04 274 wurtzite -8.30 -10.09 -1.78 -0.595 0.31317E+04 276 an20ab80 2.03 -1.41 -3.44 -0.265 0.60399E+04 277 an25ab75 2.63 -1.12 -3.76 -0.289 0.65937E+04 278 an30ab70 3.24 -0.84 -4.08 -0.314 0.71576E+04 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 6 Loop limit = 70 Temperature = 110.57 C Pressure = 500.00 bar Mixer fraction = 1.1000000 Water: Moles liquid = 0.1167E+03 kg liquid = 0.2102E+01 Moles total = 0.1164E+03 kg total = 0.2097E+01 Activity = 0.9757 Stoichiometric ionic strength = .8290636E+00 Osmotic coef. = 0.9305 True ionic strength = .6923045E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.19001E-04 -4.7212 0.12023E-04 -4.9200 0.63274E+00 -0.1988 2 H2O 0.97565E+00 -0.0107 0.97565E+00 -0.0107 3 Cl- 0.67778E+00 -0.1689 0.42163E+00 -0.3751 0.62207E+00 -0.2062 4 SO4-- 0.85104E-04 -4.0701 0.11018E-04 -4.9579 0.12947E+00 -0.8878 5 HCO3- 0.12673E-01 -1.8971 0.79330E-02 -2.1006 0.62596E+00 -0.2035 6 HS- 0.16501E-06 -6.7825 0.10270E-06 -6.9884 0.62238E+00 -0.2059 7 H4SiO4 0.13320E-02 -2.8755 0.13320E-02 -2.8755 0.10000E+01 0.0000 8 Al+++ 0.59555E-11 -11.2251 0.56058E-13 -13.2514 0.94129E-02 -2.0263 9 Ca++ 0.83565E-03 -3.0780 0.10233E-03 -3.9900 0.12246E+00 -0.9120 10 Mg++ 0.69805E-04 -4.1561 0.83527E-05 -5.0782 0.11966E+00 -0.9221 11 Fe++ 0.65556E-06 -6.1834 0.78844E-07 -7.1032 0.12027E+00 -0.9198 12 K+ 0.21510E-01 -1.6674 0.13435E-01 -1.8718 0.62461E+00 -0.2044 13 Na+ 0.66773E+00 -0.1754 0.41299E+00 -0.3841 0.61851E+00 -0.2087 14 Mn++ 0.10254E-04 -4.9891 0.12383E-05 -5.9072 0.12076E+00 -0.9181 15 Zn++ 0.79995E-07 -7.0969 0.96210E-08 -8.0168 0.12027E+00 -0.9198 16 Cu+ 0.14372E-12 -12.8425 0.88872E-13 -13.0512 0.61837E+00 -0.2088 17 Pb++ 0.19277E-08 -8.7150 0.24012E-09 -9.6196 0.12457E+00 -0.9046 18 Ag+ 0.38092E-12 -12.4192 0.23742E-12 -12.6245 0.62328E+00 -0.2053 19 Au+ 0.28602E-23 -23.5436 0.17887E-23 -23.7475 0.62539E+00 -0.2038 20 Ba++ 0.15130E-05 -5.8202 0.19075E-06 -6.7195 0.12607E+00 -0.8994 21 F- 0.69696E-03 -3.1568 0.43361E-03 -3.3629 0.62215E+00 -0.2061 22 H2AsO3- 0.39141E-07 -7.4074 0.26901E-07 -7.5702 0.68728E+00 -0.1629 24 HSiO3- 0.29199E-06 -6.5346 0.18163E-06 -6.7408 0.62207E+00 -0.2062 25 Ca(HSiO3)+ 0.71344E-09 -9.1466 0.44618E-09 -9.3505 0.62539E+00 -0.2038 26 Mg(HSiO3)+ 0.68969E-10 -10.1613 0.43133E-10 -10.3652 0.62539E+00 -0.2038 27 NaHSiO3,aq 0.93946E-06 -6.0271 0.93946E-06 -6.0271 0.10000E+01 0.0000 31 AgCl,aq 0.62607E-10 -10.2034 0.62607E-10 -10.2034 0.10000E+01 0.0000 32 AgCl2- 0.17338E-08 -8.7610 0.10785E-08 -8.9672 0.62207E+00 -0.2062 33 AgCl3-2 0.52010E-09 -9.2839 0.66548E-10 -10.1769 0.12795E+00 -0.8930 34 AgCl4-3 0.23213E-10 -10.6343 0.22977E-12 -12.6387 0.98982E-02 -2.0044 38 Ag(HS),aq 0.28116E-08 -8.5510 0.28116E-08 -8.5510 0.10000E+01 0.0000 40 AlO+ 0.12599E-09 -9.8997 0.78792E-10 -10.1035 0.62539E+00 -0.2038 41 AlOH+2 0.28639E-10 -10.5430 0.34757E-11 -11.4590 0.12136E+00 -0.9159 42 HAlO2,aq 0.18979E-08 -8.7217 0.18979E-08 -8.7217 0.10000E+01 0.0000 43 AlO2- 0.79476E-09 -9.0998 0.49379E-09 -9.3065 0.62130E+00 -0.2067 44 AsO2- 0.21696E-07 -7.6636 0.13496E-07 -7.8698 0.62207E+00 -0.2062 45 HAsO2,aq 0.23932E-04 -4.6210 0.23932E-04 -4.6210 0.10000E+01 0.0000 46 H3AsO3,aq 0.37670E-04 -4.4240 0.37670E-04 -4.4240 0.10000E+01 0.0000 62 BaCO3,aq 0.57748E-10 -10.2385 0.57748E-10 -10.2385 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.19418E-06 -6.7118 0.12219E-06 -6.9129 0.62930E+00 -0.2011 64 BaCl+ 0.22569E-06 -6.6465 0.14114E-06 -6.8503 0.62539E+00 -0.2038 65 BaF+ 0.33025E-09 -9.4812 0.20653E-09 -9.6850 0.62539E+00 -0.2038 66 CH4,aq 0.80248E-10 -10.0956 0.72947E-10 -10.1370 0.90902E+00 -0.0414 71 CO,aq 0.14721E-10 -10.8321 0.14721E-10 -10.8321 0.10000E+01 0.0000 72 CO2,aq 0.15373E+00 -0.8132 0.13974E+00 -0.8547 0.90902E+00 -0.0414 73 CO3-2 0.72555E-06 -6.1393 0.92835E-07 -7.0323 0.12795E+00 -0.8930 74 CaCO3,aq 0.12795E-06 -6.8929 0.12795E-06 -6.8929 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.35942E-04 -4.4444 0.22478E-04 -4.6482 0.62539E+00 -0.2038 76 CaCl+ 0.12176E-03 -3.9145 0.76150E-04 -4.1183 0.62539E+00 -0.2038 77 CaCl2,aq 0.63714E-05 -5.1958 0.63714E-05 -5.1958 0.10000E+01 0.0000 78 CaF+ 0.11321E-05 -5.9461 0.70803E-06 -6.1500 0.62539E+00 -0.2038 79 CaOH+ 0.16990E-08 -8.7698 0.10625E-08 -8.9737 0.62539E+00 -0.2038 80 CaSO4,aq 0.36090E-06 -6.4426 0.36090E-06 -6.4426 0.10000E+01 0.0000 81 HCl,aq 0.12350E-05 -5.9083 0.12350E-05 -5.9083 0.10000E+01 0.0000 90 CuCl,aq 0.19905E-09 -9.7010 0.19905E-09 -9.7010 0.10000E+01 0.0000 91 CuCl2- 0.21940E-08 -8.6588 0.13648E-08 -8.8649 0.62207E+00 -0.2062 92 CuCl3-2 0.24493E-09 -9.6110 0.31339E-10 -10.5039 0.12795E+00 -0.8930 98 HF,aq 0.34723E-04 -4.4594 0.34723E-04 -4.4594 0.10000E+01 0.0000 99 HF2- 0.70855E-08 -8.1496 0.44076E-08 -8.3558 0.62207E+00 -0.2062 101 FeCl+ 0.87931E-07 -7.0559 0.54991E-07 -7.2597 0.62539E+00 -0.2038 104 FeF+ 0.28353E-08 -8.5474 0.17732E-08 -8.7512 0.62539E+00 -0.2038 107 FeOH+ 0.61960E-09 -9.2079 0.38749E-09 -9.4117 0.62539E+00 -0.2038 113 H2,aq 0.33642E-08 -8.4731 0.30582E-08 -8.5145 0.90902E+00 -0.0414 114 KCl,aq 0.10693E-03 -3.9709 0.10693E-03 -3.9709 0.10000E+01 0.0000 116 KOH,aq 0.88725E-09 -9.0520 0.88725E-09 -9.0520 0.10000E+01 0.0000 117 KSO4- 0.40455E-05 -5.3930 0.25165E-05 -5.5992 0.62207E+00 -0.2062 118 MgCO3,aq 0.23518E-08 -8.6286 0.23518E-08 -8.6286 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.29732E-05 -5.5268 0.18594E-05 -5.7306 0.62539E+00 -0.2038 120 MgCl+ 0.85904E-05 -5.0660 0.53723E-05 -5.2698 0.62539E+00 -0.2038 121 MgF+ 0.33202E-06 -6.4788 0.20765E-06 -6.6827 0.62539E+00 -0.2038 122 MgOH+ 0.70740E-09 -9.1503 0.44240E-09 -9.3542 0.62539E+00 -0.2038 124 MnF+ 0.14872E-07 -7.8276 0.93010E-08 -8.0315 0.62539E+00 -0.2038 126 MnOH+ 0.96122E-09 -9.0172 0.60113E-09 -9.2210 0.62539E+00 -0.2038 131 MnCl+ 0.61247E-05 -5.2129 0.38303E-05 -5.4168 0.62539E+00 -0.2038 132 MnSO4,aq 0.41946E-08 -8.3773 0.41946E-08 -8.3773 0.10000E+01 0.0000 133 NaCl,aq 0.57023E-01 -1.2439 0.57023E-01 -1.2439 0.10000E+01 0.0000 134 NaF,aq 0.41175E-04 -4.3854 0.41175E-04 -4.3854 0.10000E+01 0.0000 135 NaOH,aq 0.26746E-07 -7.5727 0.26746E-07 -7.5727 0.10000E+01 0.0000 137 OH- 0.15197E-06 -6.8183 0.94417E-07 -7.0250 0.62130E+00 -0.2067 140 PbCl+ 0.10493E-07 -7.9791 0.65625E-08 -8.1829 0.62539E+00 -0.2038 141 PbCl2,aq 0.16552E-07 -7.7811 0.16552E-07 -7.7811 0.10000E+01 0.0000 142 PbCl3- 0.53528E-08 -8.2714 0.33298E-08 -8.4776 0.62207E+00 -0.2062 143 PbCl4-2 0.28212E-08 -8.5496 0.36098E-09 -9.4425 0.12795E+00 -0.8930 144 PbF+ 0.23646E-10 -10.6262 0.14788E-10 -10.8301 0.62539E+00 -0.2038 148 Pb(HS)2,aq 0.10407E-10 -10.9827 0.10407E-10 -10.9827 0.10000E+01 0.0000 150 H2S,aq 0.32110E-05 -5.4934 0.29189E-05 -5.5348 0.90902E+00 -0.0414 159 HSO4- 0.21078E-06 -6.6762 0.13296E-06 -6.8763 0.63080E+00 -0.2001 173 ZnCl+ 0.88727E-06 -6.0519 0.55489E-06 -6.2558 0.62539E+00 -0.2038 174 ZnCl2,aq 0.13108E-06 -6.8825 0.13108E-06 -6.8825 0.10000E+01 0.0000 175 ZnCl3- 0.12637E-07 -7.8984 0.78609E-08 -8.1045 0.62207E+00 -0.2062 176 ZnF+ 0.21538E-09 -9.6668 0.13470E-09 -9.8706 0.62539E+00 -0.2038 178 ZnOH+ 0.14247E-07 -7.8463 0.89098E-08 -8.0501 0.62539E+00 -0.2038 Charge balance for all species = -.6165E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1900096E-04 0.1538469E+00 0.1475002E+03 0.0000 2 H2O 0.1000000E+01 0.5535450E+02 0.9485573E+06 0.0000 3 Cl- 0.6777846E+00 0.7350669E+00 0.2478843E+05 4.5449 4 SO4-- 0.8510356E-04 0.8972399E-04 0.8198371E+01 4.8821 5 HCO3- 0.1267344E-01 0.1664427E+00 0.9660200E+04 2.8194 6 HS- 0.1650103E-06 0.3379812E-05 0.1063218E+00 -2.0684 7 H4SiO4 0.1331959E-02 0.1333192E-02 0.1218863E+03 -2.8755 8 Al+++ 0.5955457E-11 0.2853200E-08 0.7322637E-04 1.5086 9 Ca++ 0.8356453E-03 0.1001346E-02 0.3817327E+02 5.8500 10 Mg++ 0.6980450E-04 0.8170326E-04 0.1889423E+01 4.7618 11 Fe++ 0.6555626E-06 0.7469500E-06 0.3967899E-01 2.7368 12 K+ 0.2151015E-01 0.2162112E-01 0.8041673E+03 3.0483 13 Na+ 0.6677266E+00 0.7247921E+00 0.1584958E+05 4.5359 14 Mn++ 0.1025426E-04 0.1639898E-04 0.8569569E+00 3.9328 15 Zn++ 0.7999531E-07 0.1125447E-05 0.6997982E-01 1.8232 16 Cu+ 0.1437194E-12 0.2638130E-08 0.1594456E-03 -8.1312 17 Pb++ 0.1927676E-08 0.3718168E-07 0.7327688E-02 0.2204 18 Ag+ 0.3809202E-12 0.5151867E-08 0.5286089E-03 -7.7045 19 Au+ 0.2860186E-23 0.1260273E-11 0.2361169E-06 -18.8275 20 Ba++ 0.1512970E-05 0.1933225E-05 0.2525507E+00 3.1205 21 F- 0.6969596E-03 0.7743548E-03 0.1399320E+02 1.5571 22 H2AsO3- 0.3914123E-07 0.6166305E-04 0.7327920E+01 -2.6502 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234469E+00 -.1169425E-04 0.0000000E+00 2 H2O 0.1163769E+03 0.1163769E+03 -.1530924E-04 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4115163E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.7105696E-05 0.6924615E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2802894E-02 0.8847031E-05 0.0000000E+00 8 Al+++ 0.2407279E-05 0.5998550E-08 0.2401280E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570383E-05 0.3292215E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2366133E-05 0.5102043E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.5546388E-08 0.1646107E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.7817053E-07 0.1486850E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.1083125E-07 0.4162969E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.2649589E-11 0.4613716E-12 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627999E-02 0.2401280E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8470E-21 Mass of aqueous solution: 0.221027E+04 g Temperature = 110.57 C Pressure = 500.00 bar Mixer frac. = 1.1000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) argentite 0.2081E-06 -6.682 0.5158E-04 -4.288 3.221 0.7243E-05 bornite 0.3292E-07 -7.483 0.1652E-04 -4.782 1.032 0.3250E-05 topaz 0.1201E-05 -5.921 0.2210E-03 -3.656 13.80 0.6186E-04 galena 0.1487E-05 -5.828 0.3557E-03 -3.449 22.22 0.4682E-04 gold,native 0.4614E-12 -12.336 0.9088E-10 -10.042 0.5675E-05 0.4713E-11 silver,native 0.3847E-12 -12.415 0.4149E-10 -10.382 0.2591E-05 0.3951E-11 sphalerite 0.5102E-05 -5.292 0.4971E-03 -3.304 31.04 0.1216E-03 quartz 0.7646E-05 -5.117 0.4594E-03 -3.338 28.69 0.1735E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5453E+00 0.2140E+00 0.3924 -0.670 silver,native 0.4547E+00 0.8665E-01 0.1906 -1.062 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 quartz 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.1000000 Solid products produced: Mass = 0.001601 g Volume = 0.000414 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 110.5683 deg.C Sat. pressure: 34.5105 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6444E-01 0.8248 0.1834E+01 0.2224E+01 CO2,gas 0.9356E+00 0.9168 0.2960E+02 0.3229E+02 CH4,gas 0.5712E-08 1.0294 0.2029E-06 0.1971E-06 H2,gas 0.1610E-06 1.0181 0.5655E-05 0.5555E-05 H2S,gas 0.4735E-05 0.8857 0.1447E-03 0.1634E-03 S2,gas 0.3260E-17 1.0000 0.1125E-15 0.1125E-15 CO,gas 0.1021E-08 1.0000 0.3525E-07 0.3525E-07 SO3,gas 0.1599E-30 1.0000 0.5519E-29 0.5519E-29 O2,gas 0.2176E-51 1.0000 0.7511E-50 0.7511E-50 SO2,gas 0.5386E-14 1.0000 0.1859E-12 0.1859E-12 HF,gas 0.4549E-08 1.0000 0.1570E-06 0.1570E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -2.85 -2.85 0.00 0.000 0.00000E+00 197 argentite -27.32 -27.32 0.00 0.000 0.62380E-11 206 bornite -85.91 -85.91 0.00 0.000 0.00000E+00 226 topaz -16.42 -16.42 0.00 0.000 0.00000E+00 261 galena -11.69 -11.69 0.00 0.000 0.62380E-11 262 gold,native -17.80 -17.80 0.00 0.000 -0.62380E-11 263 silver,native -6.29 -6.29 0.00 0.000 0.00000E+00 273 sphalerite -10.09 -10.09 0.00 0.000 -0.31190E-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 2.42 -0.01 -2.44 -2.436 0.42764E+04 0.263 2 CO2,gas -5.78 -7.01 -1.23 -0.409 0.21556E+04 1.471 3 CH4,gas 5.25 -4.14 -9.39 -2.348 0.16490E+05 -6.693 4 H2,gas 8.66 0.71 -7.95 -4.541 0.13953E+05 -5.248 5 H2S,gas -5.37 -11.91 -6.54 -3.269 0.11480E+05 -3.839 6 S2,gas -6.59 -25.24 -18.65 -2.869 0.32742E+05 -15.949 7 CO,gas 3.86 -6.29 -10.15 -3.124 0.17825E+05 -7.453 8 SO3,gas 17.17 -14.79 -31.96 -7.989 0.56111E+05 -29.258 9 O2,gas 51.38 -1.44 -52.82 -35.216 0.92749E+05 -50.124 10 SO2,gas 1.36 -14.06 -15.43 -4.115 0.27092E+05 -12.731 11 HF,gas 1.22 -8.28 -9.50 -4.752 0.16686E+05 -6.804 12 HCl,gas 3.06 -5.30 -8.36 -4.178 0.14673E+05 -8.357 17 albite-high 0.78 -2.54 -3.32 -0.255 0.58238E+04 18 albite -0.25 -2.54 -2.29 -0.176 0.40241E+04 22 analcite 3.32 0.30 -3.02 -0.335 0.52993E+04 23 andalusite 4.62 0.13 -4.49 -0.449 0.78783E+04 26 anhydrite -5.18 -8.95 -3.76 -1.882 0.66097E+04 27 ankerite -2.04 -5.45 -3.42 -0.569 0.59984E+04 34 aragonite 0.99 -1.17 -2.16 -0.720 0.37924E+04 36 calcite 0.85 -1.17 -2.02 -0.674 0.35499E+04 53 coesite -2.27 -2.85 -0.59 -0.196 0.10299E+04 58 corundum 7.83 2.99 -4.85 -0.441 0.85140E+04 60 cristobalite -2.42 -2.85 -0.44 -0.145 0.76614E+03 65 diaspore 2.65 1.49 -1.17 -0.195 0.20496E+04 66 diamond -3.00 -5.57 -2.57 -0.734 0.45107E+04 69 dolomite,ordered 0.56 -3.43 -3.99 -0.665 0.70072E+04 83 gibbsite 3.83 1.48 -2.36 -0.337 0.41367E+04 86 goethite 6.24 2.36 -3.88 -0.840 0.68189E+04 87 graphite -3.42 -5.57 -2.14 -0.612 0.37632E+04 90 halite 1.62 -0.76 -2.38 -1.188 0.41705E+04 96 jadeite 4.11 0.31 -3.80 -0.380 0.66644E+04 99 kaolinite -1.43 -2.74 -1.31 -0.119 0.23061E+04 100 kyanite 4.46 0.13 -4.33 -0.433 0.76080E+04 107 magnesite 0.64 -2.26 -2.90 -0.967 0.50912E+04 117 microcline -2.26 -4.03 -1.77 -0.136 0.31012E+04 121 muscovite 2.35 -1.05 -3.40 -0.200 0.59721E+04 122 paragonite 3.94 0.44 -3.50 -0.206 0.61494E+04 123 nepheline 8.13 3.17 -4.96 -0.708 0.87025E+04 143 pyrite -20.76 -21.79 -1.03 -0.243 0.18154E+04 144 pyrrhotite -4.21 -9.17 -4.97 -1.655 0.87180E+04 145 pyrrhotiteFe0.875 -5.91 -9.60 -3.69 -1.358 0.64815E+04 147 pyrophyllite -6.07 -8.44 -2.37 -0.148 0.41582E+04 153 rhodochrosite -0.94 -3.09 -2.15 -0.717 0.37750E+04 155 sanidine -1.08 -4.03 -2.94 -0.226 0.51676E+04 157 siderite -2.56 -4.28 -1.73 -0.576 0.30353E+04 158 sillimanite 4.86 0.13 -4.73 -0.473 0.82981E+04 165 stilbite -6.92 -11.23 -4.31 -0.205 0.75646E+04 171 sulfur -8.94 -12.62 -3.68 -1.132 0.64618E+04 172 sylvite 1.43 -2.25 -3.67 -1.836 0.64484E+04 180 topaz-H 4.24 0.12 -4.12 -0.375 0.72412E+04 181 tridymite -2.47 -2.85 -0.38 -0.126 0.66603E+03 184 troilite-low -4.35 -9.17 -4.83 -1.609 0.84738E+04 198 arsenic -7.00 -11.39 -4.39 -1.133 0.77096E+04 201 beidellite-Ca -1.72 -6.04 -4.32 -0.267 0.75868E+04 202 beidellite-H -2.38 -7.01 -4.63 -0.295 0.81222E+04 203 beidellite-K -1.57 -6.00 -4.44 -0.272 0.77907E+04 204 beidellite-Mg -1.91 -6.22 -4.31 -0.267 0.75718E+04 205 beidellite-Na -1.40 -5.51 -4.11 -0.252 0.72143E+04 208 chalcedony -2.67 -2.85 -0.18 -0.061 0.31901E+03 209 chalcocite -26.94 -28.17 -1.23 -0.308 0.21607E+04 211 covellite -19.30 -20.40 -1.10 -0.418 0.19265E+04 212 dawsonite 1.67 -1.00 -2.67 -0.333 0.46795E+04 214 montmorillonite-Ca -2.23 -6.40 -4.17 -0.258 0.73192E+04 215 montmorillonite-K -2.15 -6.36 -4.21 -0.258 0.73942E+04 216 montmorillonite-Mg -2.43 -6.58 -4.16 -0.257 0.72989E+04 217 montmorillonite-Na -1.94 -5.87 -3.93 -0.240 0.68955E+04 230 gypsum -4.79 -8.97 -4.18 -1.045 0.73408E+04 246 acanthite -27.22 -27.32 -0.10 -0.025 0.17801E+03 252 barite -9.19 -11.68 -2.49 -1.245 0.43736E+04 253 boehmite 4.13 1.49 -2.64 -0.441 0.46440E+04 254 cerussite -2.69 -6.80 -4.11 -1.372 0.72247E+04 255 chalcopyrite -27.78 -29.57 -1.79 -0.332 0.31377E+04 257 copper,native -2.81 -7.78 -4.97 -1.727 0.87199E+04 258 dolomite,disordered 1.23 -3.43 -4.66 -0.776 0.81755E+04 260 fluorite -9.66 -10.72 -1.05 -0.351 0.18480E+04 270 silica-amorphous -1.96 -2.85 -0.90 -0.299 0.15773E+04 271 smithsonite -0.72 -5.20 -4.48 -1.492 0.78577E+04 274 wurtzite -8.30 -10.09 -1.78 -0.595 0.31317E+04 276 an20ab80 2.03 -1.41 -3.44 -0.265 0.60444E+04 277 an25ab75 2.63 -1.13 -3.76 -0.289 0.65982E+04 278 an30ab70 3.24 -0.84 -4.08 -0.314 0.71619E+04 Calculations done for 110.5683 Deg. C; 500.0000 bar Mixer fraction: 1.1000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 110.568 .82906E+00 2.154 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1181E+03 New heat: 2.087 New temperature: 106.758 New mixer fraction: 1.2000000 Resulting temperature: 106.758Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 106.76 C Pressure = 500.00 bar Mixer fraction = 1.2000000 Water: Moles liquid = 0.1223E+03 kg liquid = 0.2202E+01 Moles total = 0.1219E+03 kg total = 0.2197E+01 Activity = 0.9768 Stoichiometric ionic strength = .7913192E+00 Osmotic coef. = 0.9302 True ionic strength = .6641489E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.19544E-04 -4.7090 0.12492E-04 -4.9034 0.63918E+00 -0.1944 2 H2O 0.97675E+00 -0.0102 0.97675E+00 -0.0102 3 Cl- 0.65027E+00 -0.1869 0.40762E+00 -0.3897 0.62685E+00 -0.2028 4 SO4-- 0.81430E-04 -4.0892 0.11032E-04 -4.9574 0.13547E+00 -0.8681 5 HCO3- 0.12100E-01 -1.9172 0.76261E-02 -2.1177 0.63023E+00 -0.2005 6 HS- 0.14582E-06 -6.8362 0.91445E-07 -7.0388 0.62710E+00 -0.2027 7 H4SiO4 0.12500E-02 -2.9031 0.12500E-02 -2.9031 0.10000E+01 0.0000 8 Al+++ 0.76637E-11 -11.1156 0.80335E-13 -13.0951 0.10483E-01 -1.9795 9 Ca++ 0.80629E-03 -3.0935 0.10358E-03 -3.9847 0.12847E+00 -0.8912 10 Mg++ 0.67104E-04 -4.1733 0.84422E-05 -5.0735 0.12581E+00 -0.9003 11 Fe++ 0.62956E-06 -6.2010 0.79564E-07 -7.0993 0.12638E+00 -0.8983 12 K+ 0.20544E-01 -1.6873 0.12916E-01 -1.8889 0.62871E+00 -0.2015 13 Na+ 0.64066E+00 -0.1934 0.39926E+00 -0.3987 0.62320E+00 -0.2054 14 Mn++ 0.10160E-04 -4.9931 0.12887E-05 -5.8898 0.12684E+00 -0.8967 15 Zn++ 0.82642E-07 -7.0828 0.10444E-07 -7.9811 0.12638E+00 -0.8983 16 Cu+ 0.11126E-12 -12.9536 0.69327E-13 -13.1591 0.62309E+00 -0.2055 17 Pb++ 0.17322E-08 -8.7614 0.22607E-09 -9.6458 0.13051E+00 -0.8844 18 Ag+ 0.29087E-12 -12.5363 0.18252E-12 -12.7387 0.62749E+00 -0.2024 19 Au+ 0.17996E-23 -23.7448 0.11327E-23 -23.9459 0.62944E+00 -0.2010 20 Ba++ 0.14742E-05 -5.8315 0.19457E-06 -6.7109 0.13198E+00 -0.8795 21 F- 0.66881E-03 -3.1747 0.42006E-03 -3.3767 0.62807E+00 -0.2020 22 H2AsO3- 0.32362E-07 -7.4900 0.22290E-07 -7.6519 0.68877E+00 -0.1619 24 HSiO3- 0.25063E-06 -6.6010 0.15711E-06 -6.8038 0.62685E+00 -0.2028 25 Ca(HSiO3)+ 0.58436E-09 -9.2333 0.36782E-09 -9.4344 0.62944E+00 -0.2010 26 Mg(HSiO3)+ 0.57317E-10 -10.2417 0.36078E-10 -10.4428 0.62944E+00 -0.2010 27 NaHSiO3,aq 0.81823E-06 -6.0871 0.81823E-06 -6.0871 0.10000E+01 0.0000 31 AgCl,aq 0.47541E-10 -10.3229 0.47541E-10 -10.3229 0.10000E+01 0.0000 32 AgCl2- 0.12770E-08 -8.8938 0.80051E-09 -9.0966 0.62685E+00 -0.2028 33 AgCl3-2 0.36734E-09 -9.4349 0.49224E-10 -10.3078 0.13400E+00 -0.8729 34 AgCl4-3 0.15410E-10 -10.8122 0.17007E-12 -12.7694 0.11036E-01 -1.9572 38 Ag(HS),aq 0.25919E-08 -8.5864 0.25919E-08 -8.5864 0.10000E+01 0.0000 40 AlO+ 0.12235E-09 -9.9124 0.77012E-10 -10.1134 0.62944E+00 -0.2010 41 AlOH+2 0.31480E-10 -10.5020 0.40110E-11 -11.3967 0.12741E+00 -0.8948 42 HAlO2,aq 0.15885E-08 -8.7990 0.15885E-08 -8.7990 0.10000E+01 0.0000 43 AlO2- 0.57309E-09 -9.2418 0.35934E-09 -9.4445 0.62702E+00 -0.2027 44 AsO2- 0.19025E-07 -7.7207 0.11926E-07 -7.9235 0.62685E+00 -0.2028 45 HAsO2,aq 0.23238E-04 -4.6338 0.23238E-04 -4.6338 0.10000E+01 0.0000 46 H3AsO3,aq 0.35574E-04 -4.4489 0.35574E-04 -4.4489 0.10000E+01 0.0000 62 BaCO3,aq 0.50058E-10 -10.3005 0.50058E-10 -10.3005 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.16821E-06 -6.7742 0.10649E-06 -6.9727 0.63308E+00 -0.1985 64 BaCl+ 0.20272E-06 -6.6931 0.12760E-06 -6.8942 0.62944E+00 -0.2010 65 BaF+ 0.30138E-09 -9.5209 0.18970E-09 -9.7219 0.62944E+00 -0.2010 66 CH4,aq 0.68960E-10 -10.1614 0.62795E-10 -10.2021 0.91060E+00 -0.0407 71 CO,aq 0.10847E-10 -10.9647 0.10847E-10 -10.9647 0.10000E+01 0.0000 72 CO2,aq 0.14675E+00 -0.8334 0.13363E+00 -0.8741 0.91060E+00 -0.0407 73 CO3-2 0.64753E-06 -6.1887 0.86770E-07 -7.0616 0.13400E+00 -0.8729 74 CaCO3,aq 0.11042E-06 -6.9569 0.11042E-06 -6.9569 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.32520E-04 -4.4879 0.20469E-04 -4.6889 0.62944E+00 -0.2010 76 CaCl+ 0.10998E-03 -3.9587 0.69223E-04 -4.1597 0.62944E+00 -0.2010 77 CaCl2,aq 0.56146E-05 -5.2507 0.56146E-05 -5.2507 0.10000E+01 0.0000 78 CaF+ 0.10234E-05 -5.9900 0.64416E-06 -6.1910 0.62944E+00 -0.2010 79 CaOH+ 0.12992E-08 -8.8863 0.81779E-09 -9.0874 0.62944E+00 -0.2010 80 CaSO4,aq 0.34561E-06 -6.4614 0.34561E-06 -6.4614 0.10000E+01 0.0000 81 HCl,aq 0.12120E-05 -5.9165 0.12120E-05 -5.9165 0.10000E+01 0.0000 90 CuCl,aq 0.15304E-09 -9.8152 0.15304E-09 -9.8152 0.10000E+01 0.0000 91 CuCl2- 0.16208E-08 -8.7903 0.10160E-08 -8.9931 0.62685E+00 -0.2028 92 CuCl3-2 0.17397E-09 -9.7595 0.23312E-10 -10.6324 0.13400E+00 -0.8729 98 HF,aq 0.32178E-04 -4.4924 0.32178E-04 -4.4924 0.10000E+01 0.0000 99 HF2- 0.62829E-08 -8.2018 0.39384E-08 -8.4047 0.62685E+00 -0.2028 101 FeCl+ 0.80229E-07 -7.0957 0.50499E-07 -7.2967 0.62944E+00 -0.2010 104 FeF+ 0.26177E-08 -8.5821 0.16477E-08 -8.7831 0.62944E+00 -0.2010 107 FeOH+ 0.50971E-09 -9.2927 0.32083E-09 -9.4937 0.62944E+00 -0.2010 113 H2,aq 0.26565E-08 -8.5757 0.24190E-08 -8.6164 0.91060E+00 -0.0407 114 KCl,aq 0.91456E-04 -4.0388 0.91456E-04 -4.0388 0.10000E+01 0.0000 116 KOH,aq 0.69907E-09 -9.1555 0.69907E-09 -9.1555 0.10000E+01 0.0000 117 KSO4- 0.36789E-05 -5.4343 0.23061E-05 -5.6371 0.62685E+00 -0.2028 118 MgCO3,aq 0.20797E-08 -8.6820 0.20797E-08 -8.6820 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.26869E-05 -5.5708 0.16912E-05 -5.7718 0.62944E+00 -0.2010 120 MgCl+ 0.78972E-05 -5.1025 0.49708E-05 -5.3036 0.62944E+00 -0.2010 121 MgF+ 0.30256E-06 -6.5192 0.19044E-06 -6.7202 0.62944E+00 -0.2010 122 MgOH+ 0.55512E-09 -9.2556 0.34941E-09 -9.4567 0.62944E+00 -0.2010 124 MnF+ 0.14047E-07 -7.8524 0.88416E-08 -8.0535 0.62944E+00 -0.2010 126 MnOH+ 0.79956E-09 -9.0971 0.50327E-09 -9.2982 0.62944E+00 -0.2010 131 MnCl+ 0.54753E-05 -5.2616 0.34463E-05 -5.4626 0.62944E+00 -0.2010 132 MnSO4,aq 0.40822E-08 -8.3891 0.40822E-08 -8.3891 0.10000E+01 0.0000 133 NaCl,aq 0.51189E-01 -1.2908 0.51189E-01 -1.2908 0.10000E+01 0.0000 134 NaF,aq 0.36848E-04 -4.4336 0.36848E-04 -4.4336 0.10000E+01 0.0000 135 NaOH,aq 0.21579E-07 -7.6660 0.21579E-07 -7.6660 0.10000E+01 0.0000 137 OH- 0.12751E-06 -6.8945 0.79950E-07 -7.0972 0.62702E+00 -0.2027 140 PbCl+ 0.89708E-08 -8.0472 0.56466E-08 -8.2482 0.62944E+00 -0.2010 141 PbCl2,aq 0.13282E-07 -7.8767 0.13282E-07 -7.8767 0.10000E+01 0.0000 142 PbCl3- 0.40595E-08 -8.3915 0.25447E-08 -8.5944 0.62685E+00 -0.2028 143 PbCl4-2 0.20174E-08 -8.6952 0.27033E-09 -9.5681 0.13400E+00 -0.8729 144 PbF+ 0.20731E-10 -10.6834 0.13049E-10 -10.8844 0.62944E+00 -0.2010 150 H2S,aq 0.29822E-05 -5.5255 0.27156E-05 -5.5661 0.91060E+00 -0.0407 159 HSO4- 0.19234E-06 -6.7159 0.12207E-06 -6.9134 0.63467E+00 -0.1975 173 ZnCl+ 0.76991E-06 -6.1136 0.48461E-06 -6.3146 0.62944E+00 -0.2010 174 ZnCl2,aq 0.11054E-06 -6.9565 0.11054E-06 -6.9565 0.10000E+01 0.0000 175 ZnCl3- 0.10463E-07 -7.9803 0.65588E-08 -8.1832 0.62685E+00 -0.2028 176 ZnF+ 0.21284E-09 -9.6719 0.13397E-09 -9.8730 0.62944E+00 -0.2010 178 ZnOH+ 0.11757E-07 -7.9297 0.74001E-08 -8.1308 0.62944E+00 -0.2010 Charge balance for all species = -.5885E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.1954422E-04 0.1468615E+00 0.1411160E+03 0.0000 2 H2O 0.1000000E+01 0.5536148E+02 0.9507859E+06 0.0000 3 Cl- 0.6502725E+00 0.7016906E+00 0.2371550E+05 4.5136 4 SO4-- 0.8142972E-04 0.8564998E-04 0.7843513E+01 4.8494 5 HCO3- 0.1210049E-01 0.1588852E+00 0.9242070E+04 2.7857 6 HS- 0.1458211E-06 0.3131380E-05 0.9872562E-01 -2.1355 7 H4SiO4 0.1249973E-02 0.1251043E-02 0.1146301E+03 -2.9031 8 Al+++ 0.7663652E-11 0.2323081E-08 0.5975359E-04 1.6150 9 Ca++ 0.8062864E-03 0.9558790E-03 0.3652099E+02 5.8220 10 Mg++ 0.6710410E-04 0.7799345E-04 0.1807642E+01 4.7332 11 Fe++ 0.6295629E-06 0.7129200E-06 0.3795546E-01 2.7074 12 K+ 0.2054426E-01 0.2063940E-01 0.7693599E+03 3.0145 13 Na+ 0.6406552E+00 0.6918823E+00 0.1516355E+05 4.5046 14 Mn++ 0.1016017E-04 0.1565437E-04 0.8198646E+00 3.9169 15 Zn++ 0.8264185E-07 0.9855302E-06 0.6141606E-01 1.8256 16 Cu+ 0.1112643E-12 0.1947905E-08 0.1179909E-03 -8.2557 17 Pb++ 0.1732182E-08 0.3009157E-07 0.5943567E-02 0.1610 18 Ag+ 0.2908694E-12 0.4299606E-08 0.4421432E-03 -7.8353 19 Au+ 0.1799577E-23 0.1069168E-11 0.2007580E-06 -19.0425 20 Ba++ 0.1474168E-05 0.1845445E-05 0.2416194E+00 3.0958 21 F- 0.6688127E-03 0.7391942E-03 0.1338752E+02 1.5267 22 H2AsO3- 0.3236172E-07 0.5886318E-04 0.7010740E+01 -2.7485 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234471E+00 -.1190493E-04 0.0000000E+00 2 H2O 0.1219278E+03 0.1219279E+03 -.1105153E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4146505E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6896538E-05 0.7133772E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2755290E-02 0.5645045E-04 0.0000000E+00 8 Al+++ 0.2407279E-05 0.5116342E-08 0.2402163E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1570132E-05 0.3317341E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2170527E-05 0.5297649E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.4290056E-08 0.1658671E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.6627353E-07 0.1498747E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.9469433E-08 0.4176587E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.2354730E-11 0.7562306E-12 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627998E-02 0.2402163E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.0000E+00 Mass of aqueous solution: 0.231026E+04 g Temperature = 106.76 C Pressure = 500.00 bar Mixer frac. = 1.2000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.5525E-04 -4.258 0.3319E-02 -2.479 74.03 0.1254E-02 argentite 0.2088E-06 -6.680 0.5175E-04 -4.286 1.154 0.7267E-05 bornite 0.3317E-07 -7.479 0.1665E-04 -4.779 0.3713 0.3275E-05 topaz 0.1201E-05 -5.920 0.2211E-03 -3.656 4.930 0.6188E-04 galena 0.1499E-05 -5.824 0.3586E-03 -3.445 7.998 0.4719E-04 gold,native 0.7562E-12 -12.121 0.1490E-09 -9.827 0.3322E-05 0.7725E-11 silver,native 0.6142E-12 -12.212 0.6626E-10 -10.179 0.1478E-05 0.6310E-11 sphalerite 0.5298E-05 -5.276 0.5161E-03 -3.287 11.51 0.1262E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5518E+00 0.2206E+00 0.3999 -0.656 silver,native 0.4482E+00 0.8088E-01 0.1805 -1.092 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.2000000 Solid products produced: Mass = 0.004484 g Volume = 0.001499 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 106.7583 deg.C Sat. pressure: 32.0046 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.6054E-01 0.8355 0.1619E+01 0.1938E+01 CO2,gas 0.9395E+00 0.9195 0.2765E+02 0.3007E+02 CH4,gas 0.5369E-08 1.0268 0.1764E-06 0.1718E-06 H2,gas 0.1403E-06 1.0169 0.4567E-05 0.4491E-05 H2S,gas 0.4622E-05 0.8906 0.1318E-03 0.1479E-03 S2,gas 0.2606E-17 1.0000 0.8341E-16 0.8341E-16 CO,gas 0.8277E-09 1.0000 0.2649E-07 0.2649E-07 SO3,gas 0.8343E-31 1.0000 0.2670E-29 0.2670E-29 O2,gas 0.6070E-52 1.0000 0.1943E-50 0.1943E-50 SO2,gas 0.4044E-14 1.0000 0.1294E-12 0.1294E-12 HF,gas 0.3942E-08 1.0000 0.1262E-06 0.1262E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -2.88 -2.88 0.00 0.000 0.00000E+00 197 argentite -27.61 -27.61 0.00 0.000 0.00000E+00 206 bornite -86.69 -86.69 0.00 0.000 0.00000E+00 226 topaz -16.23 -16.23 0.00 0.000 0.00000E+00 261 galena -11.78 -11.78 0.00 0.000 0.30880E-11 262 gold,native -18.04 -18.04 0.00 0.000 0.61760E-11 263 silver,native -6.40 -6.40 0.00 0.000 0.15440E-11 273 sphalerite -10.12 -10.12 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 2.48 -0.01 -2.49 -2.490 0.43282E+04 0.209 2 CO2,gas -5.75 -7.01 -1.26 -0.419 0.21857E+04 1.442 3 CH4,gas 5.24 -4.21 -9.45 -2.363 0.16432E+05 -6.753 4 H2,gas 8.73 0.70 -8.04 -4.594 0.13976E+05 -5.340 5 H2S,gas -5.36 -11.94 -6.58 -3.290 0.11437E+05 -3.880 6 S2,gas -6.50 -25.27 -18.78 -2.889 0.32643E+05 -16.079 7 CO,gas 3.97 -6.31 -10.28 -3.162 0.17864E+05 -7.577 8 SO3,gas 17.52 -14.75 -32.27 -8.068 0.56102E+05 -29.573 9 O2,gas 52.00 -1.41 -53.41 -35.607 0.92849E+05 -50.712 10 SO2,gas 1.54 -14.05 -15.59 -4.157 0.27096E+05 -12.888 11 HF,gas 1.32 -8.28 -9.60 -4.799 0.16685E+05 -6.899 12 HCl,gas 3.18 -5.29 -8.47 -4.235 0.14725E+05 -8.470 17 albite-high 0.90 -2.55 -3.45 -0.265 0.59990E+04 18 albite -0.14 -2.55 -2.41 -0.185 0.41841E+04 22 analcite 3.46 0.32 -3.13 -0.348 0.54488E+04 23 andalusite 4.93 0.32 -4.61 -0.461 0.80196E+04 26 anhydrite -5.12 -8.94 -3.82 -1.912 0.66471E+04 27 ankerite -1.95 -5.51 -3.57 -0.594 0.62000E+04 34 aragonite 1.04 -1.20 -2.24 -0.747 0.38939E+04 36 calcite 0.90 -1.20 -2.10 -0.701 0.36538E+04 53 coesite -2.29 -2.88 -0.59 -0.197 0.10286E+04 58 corundum 8.18 3.20 -4.98 -0.453 0.86551E+04 60 cristobalite -2.44 -2.88 -0.44 -0.148 0.77241E+03 65 diaspore 2.80 1.59 -1.20 -0.200 0.20910E+04 66 diamond -3.05 -5.60 -2.55 -0.729 0.44377E+04 69 dolomite,ordered 0.68 -3.49 -4.16 -0.694 0.72382E+04 83 gibbsite 3.97 1.58 -2.39 -0.341 0.41538E+04 86 goethite 6.34 2.34 -4.00 -0.865 0.69559E+04 87 graphite -3.48 -5.60 -2.12 -0.607 0.36938E+04 90 halite 1.62 -0.79 -2.41 -1.206 0.41919E+04 96 jadeite 4.24 0.33 -3.91 -0.391 0.67953E+04 99 kaolinite -1.23 -2.59 -1.36 -0.124 0.23619E+04 100 kyanite 4.77 0.32 -4.45 -0.445 0.77409E+04 107 magnesite 0.72 -2.29 -3.00 -1.001 0.52202E+04 117 microcline -2.19 -4.04 -1.85 -0.142 0.32142E+04 121 muscovite 2.70 -0.85 -3.55 -0.209 0.61788E+04 122 paragonite 4.32 0.64 -3.68 -0.216 0.63955E+04 143 pyrite -20.87 -21.87 -1.01 -0.237 0.17491E+04 145 pyrrhotiteFe0.875 -5.90 -9.66 -3.76 -1.382 0.65335E+04 147 pyrophyllite -5.90 -8.34 -2.44 -0.153 0.42476E+04 153 rhodochrosite -0.90 -3.10 -2.21 -0.735 0.38346E+04 155 sanidine -1.00 -4.04 -3.04 -0.234 0.52803E+04 157 siderite -2.51 -4.31 -1.80 -0.600 0.31308E+04 158 sillimanite 5.17 0.32 -4.86 -0.486 0.84420E+04 165 stilbite -6.82 -11.24 -4.42 -0.210 0.76837E+04 171 sulfur -8.98 -12.64 -3.66 -1.126 0.63607E+04 172 sylvite 1.42 -2.28 -3.70 -1.848 0.64269E+04 180 topaz-H 4.52 0.31 -4.21 -0.383 0.73173E+04 181 tridymite -2.50 -2.88 -0.39 -0.128 0.66969E+03 184 troilite-low -4.32 -9.23 -4.92 -1.639 0.85454E+04 198 arsenic -7.08 -11.48 -4.40 -1.135 0.76470E+04 201 beidellite-Ca -1.46 -5.90 -4.45 -0.275 0.77326E+04 202 beidellite-H -2.13 -6.86 -4.74 -0.302 0.82351E+04 203 beidellite-K -1.31 -5.87 -4.55 -0.279 0.79176E+04 204 beidellite-Mg -1.64 -6.08 -4.44 -0.275 0.77235E+04 205 beidellite-Na -1.15 -5.38 -4.23 -0.259 0.73548E+04 208 chalcedony -2.70 -2.88 -0.18 -0.061 0.31910E+03 209 chalcocite -27.22 -28.45 -1.24 -0.309 0.21481E+04 211 covellite -19.48 -20.55 -1.07 -0.407 0.18590E+04 212 dawsonite 1.77 -0.92 -2.69 -0.336 0.46786E+04 214 montmorillonite-Ca -2.04 -6.35 -4.31 -0.266 0.74889E+04 215 montmorillonite-K -1.98 -6.32 -4.34 -0.266 0.75479E+04 216 montmorillonite-Mg -2.23 -6.53 -4.30 -0.266 0.74740E+04 217 montmorillonite-Na -1.76 -5.83 -4.06 -0.249 0.70600E+04 230 gypsum -4.75 -8.96 -4.21 -1.052 0.73165E+04 246 acanthite -27.52 -27.61 -0.10 -0.024 0.16852E+03 252 barite -9.18 -11.67 -2.49 -1.244 0.43255E+04 253 boehmite 4.30 1.59 -2.70 -0.451 0.46999E+04 254 cerussite -2.69 -6.86 -4.17 -1.391 0.72550E+04 255 chalcopyrite -27.97 -29.78 -1.81 -0.337 0.31459E+04 258 dolomite,disordered 1.35 -3.49 -4.84 -0.807 0.84169E+04 260 fluorite -9.65 -10.74 -1.09 -0.363 0.18955E+04 270 silica-amorphous -1.97 -2.88 -0.91 -0.304 0.15852E+04 271 smithsonite -0.67 -5.20 -4.53 -1.510 0.78728E+04 274 wurtzite -8.31 -10.12 -1.80 -0.601 0.31322E+04 276 an20ab80 2.20 -1.39 -3.59 -0.276 0.62439E+04 277 an25ab75 2.82 -1.10 -3.92 -0.301 0.68070E+04 278 an30ab70 3.44 -0.81 -4.25 -0.327 0.73803E+04 Calculations done for 106.7583 Deg. C; 500.0000 bar Mixer fraction: 1.2000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 106.758 .79132E+00 2.087 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1237E+03 New heat: 2.025 New temperature: 103.272 New mixer fraction: 1.3000000 Resulting temperature: 103.272Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 103.27 C Pressure = 500.00 bar Mixer fraction = 1.3000000 Water: Moles liquid = 0.1278E+03 kg liquid = 0.2302E+01 Moles total = 0.1275E+03 kg total = 0.2297E+01 Activity = 0.9778 Stoichiometric ionic strength = .7568620E+00 Osmotic coef. = 0.9299 True ionic strength = .6381092E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20015E-04 -4.6986 0.12910E-04 -4.8891 0.64502E+00 -0.1904 2 H2O 0.97776E+00 -0.0098 0.97776E+00 -0.0098 3 Cl- 0.62482E+00 -0.2042 0.39435E+00 -0.4041 0.63113E+00 -0.1999 4 SO4-- 0.78059E-04 -4.1076 0.11019E-04 -4.9579 0.14116E+00 -0.8503 5 HCO3- 0.11577E-01 -1.9364 0.73408E-02 -2.1343 0.63408E+00 -0.1979 6 HS- 0.13001E-06 -6.8860 0.82083E-07 -7.0857 0.63134E+00 -0.1997 7 H4SiO4 0.11778E-02 -2.9289 0.11778E-02 -2.9289 0.10000E+01 0.0000 8 Al+++ 0.96672E-11 -11.0147 0.11172E-12 -12.9519 0.11557E-01 -1.9372 9 Ca++ 0.77864E-03 -3.1087 0.10446E-03 -3.9810 0.13416E+00 -0.8724 10 Mg++ 0.64599E-04 -4.1898 0.85034E-05 -5.0704 0.13163E+00 -0.8806 11 Fe++ 0.60551E-06 -6.2179 0.80028E-07 -7.0968 0.13217E+00 -0.8789 12 K+ 0.19661E-01 -1.7064 0.12434E-01 -1.9054 0.63242E+00 -0.1990 13 Na+ 0.61561E+00 -0.2107 0.38625E+00 -0.4131 0.62743E+00 -0.2024 14 Mn++ 0.10043E-04 -4.9981 0.13317E-05 -5.8756 0.13260E+00 -0.8774 15 Zn++ 0.84901E-07 -7.0711 0.11221E-07 -7.9500 0.13217E+00 -0.8789 16 Cu+ 0.87437E-13 -13.0583 0.54851E-13 -13.2608 0.62733E+00 -0.2025 17 Pb++ 0.15614E-08 -8.8065 0.21257E-09 -9.6725 0.13614E+00 -0.8660 18 Ag+ 0.22567E-12 -12.6465 0.14247E-12 -12.8463 0.63129E+00 -0.1998 19 Au+ 0.11627E-23 -23.9345 0.73608E-24 -24.1331 0.63310E+00 -0.1985 20 Ba++ 0.14354E-05 -5.8430 0.19749E-06 -6.7045 0.13759E+00 -0.8614 21 F- 0.64283E-03 -3.1919 0.40711E-03 -3.3903 0.63332E+00 -0.1984 22 H2AsO3- 0.27142E-07 -7.5664 0.18733E-07 -7.7274 0.69017E+00 -0.1610 24 HSiO3- 0.21757E-06 -6.6624 0.13732E-06 -6.8623 0.63113E+00 -0.1999 25 Ca(HSiO3)+ 0.48515E-09 -9.3141 0.30715E-09 -9.5126 0.63310E+00 -0.1985 26 Mg(HSiO3)+ 0.48238E-10 -10.3166 0.30539E-10 -10.5151 0.63310E+00 -0.1985 27 NaHSiO3,aq 0.71942E-06 -6.1430 0.71942E-06 -6.1430 0.10000E+01 0.0000 31 AgCl,aq 0.36671E-10 -10.4357 0.36671E-10 -10.4357 0.10000E+01 0.0000 32 AgCl2- 0.95722E-09 -9.0190 0.60413E-09 -9.2189 0.63113E+00 -0.1999 33 AgCl3-2 0.26490E-09 -9.5769 0.37013E-10 -10.4316 0.13973E+00 -0.8547 34 AgCl4-3 0.10504E-10 -10.9786 0.12791E-12 -12.8931 0.12177E-01 -1.9144 38 Ag(HS),aq 0.23992E-08 -8.6199 0.23992E-08 -8.6199 0.10000E+01 0.0000 40 AlO+ 0.11898E-09 -9.9245 0.75323E-10 -10.1231 0.63310E+00 -0.1985 41 AlOH+2 0.34353E-10 -10.4640 0.45740E-11 -11.3397 0.13315E+00 -0.8757 42 HAlO2,aq 0.13461E-08 -8.8709 0.13461E-08 -8.8709 0.10000E+01 0.0000 43 AlO2- 0.42445E-09 -9.3722 0.26830E-09 -9.5714 0.63210E+00 -0.1992 44 AsO2- 0.16835E-07 -7.7738 0.10625E-07 -7.9737 0.63113E+00 -0.1999 45 HAsO2,aq 0.22572E-04 -4.6464 0.22572E-04 -4.6464 0.10000E+01 0.0000 46 H3AsO3,aq 0.33690E-04 -4.4725 0.33690E-04 -4.4725 0.10000E+01 0.0000 62 BaCO3,aq 0.43704E-10 -10.3595 0.43704E-10 -10.3595 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.14673E-06 -6.8335 0.93395E-07 -7.0297 0.63651E+00 -0.1962 64 BaCl+ 0.18285E-06 -6.7379 0.11576E-06 -6.9364 0.63310E+00 -0.1985 65 BaF+ 0.27583E-09 -9.5594 0.17463E-09 -9.7579 0.63310E+00 -0.1985 66 CH4,aq 0.59988E-10 -10.2219 0.54720E-10 -10.2619 0.91219E+00 -0.0399 72 CO2,aq 0.14037E+00 -0.8527 0.12805E+00 -0.8926 0.91219E+00 -0.0399 73 CO3-2 0.58261E-06 -6.2346 0.81406E-07 -7.0893 0.13973E+00 -0.8547 74 CaCO3,aq 0.96084E-07 -7.0173 0.96084E-07 -7.0173 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.29578E-04 -4.5290 0.18726E-04 -4.7276 0.63310E+00 -0.1985 76 CaCl+ 0.99810E-04 -4.0008 0.63190E-04 -4.1994 0.63310E+00 -0.1985 77 CaCl2,aq 0.49792E-05 -5.3028 0.49792E-05 -5.3028 0.10000E+01 0.0000 78 CaF+ 0.92962E-06 -6.0317 0.58854E-06 -6.2302 0.63310E+00 -0.1985 79 CaOH+ 0.10112E-08 -8.9951 0.64022E-09 -9.1937 0.63310E+00 -0.1985 80 CaSO4,aq 0.33082E-06 -6.4804 0.33082E-06 -6.4804 0.10000E+01 0.0000 81 HCl,aq 0.11884E-05 -5.9250 0.11884E-05 -5.9250 0.10000E+01 0.0000 90 CuCl,aq 0.11937E-09 -9.9231 0.11937E-09 -9.9231 0.10000E+01 0.0000 91 CuCl2- 0.12164E-08 -8.9149 0.76773E-09 -9.1148 0.63113E+00 -0.1999 92 CuCl3-2 0.12582E-09 -9.9002 0.17581E-10 -10.7550 0.13973E+00 -0.8547 98 HF,aq 0.29883E-04 -4.5246 0.29883E-04 -4.5246 0.10000E+01 0.0000 99 HF2- 0.55887E-08 -8.2527 0.35272E-08 -8.4526 0.63113E+00 -0.1999 101 FeCl+ 0.73515E-07 -7.1336 0.46543E-07 -7.3322 0.63310E+00 -0.1985 104 FeF+ 0.24244E-08 -8.6154 0.15349E-08 -8.8139 0.63310E+00 -0.1985 107 FeOH+ 0.42496E-09 -9.3717 0.26904E-09 -9.5702 0.63310E+00 -0.1985 113 H2,aq 0.21345E-08 -8.6707 0.19471E-08 -8.7106 0.91219E+00 -0.0399 114 KCl,aq 0.78883E-04 -4.1030 0.78883E-04 -4.1030 0.10000E+01 0.0000 116 KOH,aq 0.55957E-09 -9.2521 0.55957E-09 -9.2521 0.10000E+01 0.0000 117 KSO4- 0.33609E-05 -5.4735 0.21212E-05 -5.6734 0.63113E+00 -0.1999 118 MgCO3,aq 0.18511E-08 -8.7326 0.18511E-08 -8.7326 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.24410E-05 -5.6124 0.15454E-05 -5.8110 0.63310E+00 -0.1985 120 MgCl+ 0.72862E-05 -5.1375 0.46129E-05 -5.3360 0.63310E+00 -0.1985 121 MgF+ 0.27691E-06 -6.5577 0.17531E-06 -6.7562 0.63310E+00 -0.1985 122 MgOH+ 0.44296E-09 -9.3536 0.28044E-09 -9.5522 0.63310E+00 -0.1985 124 MnF+ 0.13267E-07 -7.8772 0.83996E-08 -8.0757 0.63310E+00 -0.1985 126 MnOH+ 0.67211E-09 -9.1726 0.42551E-09 -9.3711 0.63310E+00 -0.1985 131 MnCl+ 0.49137E-05 -5.3086 0.31108E-05 -5.5071 0.63310E+00 -0.1985 132 MnSO4,aq 0.39599E-08 -8.4023 0.39599E-08 -8.4023 0.10000E+01 0.0000 133 NaCl,aq 0.46188E-01 -1.3355 0.46188E-01 -1.3355 0.10000E+01 0.0000 134 NaF,aq 0.33146E-04 -4.4796 0.33146E-04 -4.4796 0.10000E+01 0.0000 135 NaOH,aq 0.17658E-07 -7.7531 0.17658E-07 -7.7531 0.10000E+01 0.0000 137 OH- 0.10840E-06 -6.9650 0.68519E-07 -7.1642 0.63210E+00 -0.1992 140 PbCl+ 0.77131E-08 -8.1128 0.48832E-08 -8.3113 0.63310E+00 -0.1985 141 PbCl2,aq 0.10757E-07 -7.9683 0.10757E-07 -7.9683 0.10000E+01 0.0000 142 PbCl3- 0.31170E-08 -8.5063 0.19673E-08 -8.7061 0.63113E+00 -0.1999 143 PbCl4-2 0.14657E-08 -8.8339 0.20480E-09 -9.6887 0.13973E+00 -0.8547 144 PbF+ 0.18246E-10 -10.7388 0.11551E-10 -10.9374 0.63310E+00 -0.1985 150 H2S,aq 0.27840E-05 -5.5553 0.25396E-05 -5.5952 0.91219E+00 -0.0399 159 HSO4- 0.17611E-06 -6.7542 0.11239E-06 -6.9493 0.63817E+00 -0.1951 173 ZnCl+ 0.67156E-06 -6.1729 0.42516E-06 -6.3714 0.63310E+00 -0.1985 174 ZnCl2,aq 0.93878E-07 -7.0274 0.93878E-07 -7.0274 0.10000E+01 0.0000 175 ZnCl3- 0.87358E-08 -8.0587 0.55135E-08 -8.2586 0.63113E+00 -0.1999 176 ZnF+ 0.20958E-09 -9.6787 0.13268E-09 -9.8772 0.63310E+00 -0.1985 178 ZnOH+ 0.98055E-08 -8.0085 0.62079E-08 -8.2071 0.63310E+00 -0.1985 Charge balance for all species = -.5630E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2001538E-04 0.1404828E+00 0.1352614E+03 0.0000 2 H2O 0.1000000E+01 0.5536785E+02 0.9528294E+06 0.0000 3 Cl- 0.6248220E+00 0.6712136E+00 0.2273158E+05 4.4849 4 SO4-- 0.7805864E-04 0.8192988E-04 0.7518100E+01 4.8203 5 HCO3- 0.1157709E-01 0.1519842E+00 0.8858634E+04 2.7548 6 HS- 0.1300133E-06 0.2917060E-05 0.9215560E-01 -2.1967 7 H4SiO4 0.1177788E-02 0.1178726E-02 0.1082235E+03 -2.9289 8 Al+++ 0.9667188E-11 0.1933535E-08 0.4983495E-04 1.7153 9 Ca++ 0.7786365E-03 0.9143617E-03 0.3500580E+02 5.7971 10 Mg++ 0.6459943E-04 0.7460591E-04 0.1732646E+01 4.7077 11 Fe++ 0.6055094E-06 0.6818750E-06 0.3637647E-01 2.6814 12 K+ 0.1966071E-01 0.1974295E-01 0.7374406E+03 2.9837 13 Na+ 0.6156091E+00 0.6618313E+00 0.1453445E+05 4.4759 14 Mn++ 0.1004289E-04 0.1497445E-04 0.7858500E+00 3.9025 15 Zn++ 0.8490130E-07 0.8690896E-06 0.5426990E-01 1.8282 16 Cu+ 0.8743709E-13 0.1461717E-08 0.8872103E-04 -8.3717 17 Pb++ 0.1561392E-08 0.2463966E-07 0.4876627E-02 0.1056 18 Ag+ 0.2256729E-12 0.3668859E-08 0.3780487E-03 -7.9572 19 Au+ 0.1162659E-23 0.9148685E-12 0.1721346E-06 -19.2440 20 Ba++ 0.1435394E-05 0.1765291E-05 0.2315950E+00 3.0737 21 F- 0.6428252E-03 0.7070880E-03 0.1283209E+02 1.4988 22 H2AsO3- 0.2714185E-07 0.5630654E-04 0.6719877E+01 -2.8383 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234472E+00 -.1208638E-04 0.0000000E+00 2 H2O 0.1274786E+03 0.1274788E+03 -.1933062E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4169567E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6716229E-05 0.7314081E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2713895E-02 0.9784615E-04 0.0000000E+00 8 Al+++ 0.2407279E-05 0.4451764E-08 0.2402827E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569947E-05 0.3335833E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.2000989E-05 0.5467187E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.3365453E-08 0.1667917E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.5673029E-07 0.1508290E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.8447170E-08 0.4186809E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.2106390E-11 0.1004570E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627997E-02 0.2402827E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.241026E+04 g Temperature = 103.27 C Pressure = 500.00 bar Mixer frac. = 1.3000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.9664E-04 -4.015 0.5806E-02 -2.236 83.07 0.2193E-02 argentite 0.2093E-06 -6.679 0.5187E-04 -4.285 0.7422 0.7285E-05 bornite 0.3336E-07 -7.477 0.1674E-04 -4.776 0.2395 0.3293E-05 topaz 0.1201E-05 -5.920 0.2211E-03 -3.655 3.163 0.6190E-04 galena 0.1508E-05 -5.822 0.3609E-03 -3.443 5.163 0.4749E-04 gold,native 0.1005E-11 -11.998 0.1979E-09 -9.704 0.2831E-05 0.1026E-10 silver,native 0.7969E-12 -12.099 0.8596E-10 -10.066 0.1230E-05 0.8186E-11 sphalerite 0.5467E-05 -5.262 0.5327E-03 -3.274 7.621 0.1303E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5576E+00 0.2267E+00 0.4065 -0.645 silver,native 0.4424E+00 0.7589E-01 0.1716 -1.120 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.3000000 Solid products produced: Mass = 0.006990 g Volume = 0.002443 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 103.2724 deg.C Sat. pressure: 29.7584 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.5725E-01 0.8453 0.1440E+01 0.1704E+01 CO2,gas 0.9427E+00 0.9222 0.2587E+02 0.2805E+02 CH4,gas 0.5080E-08 1.0245 0.1549E-06 0.1512E-06 H2,gas 0.1238E-06 1.0159 0.3744E-05 0.3685E-05 H2S,gas 0.4526E-05 0.8953 0.1206E-03 0.1347E-03 S2,gas 0.2113E-17 1.0000 0.6289E-16 0.6289E-16 CO,gas 0.6808E-09 1.0000 0.2026E-07 0.2026E-07 SO3,gas 0.4535E-31 1.0000 0.1350E-29 0.1350E-29 O2,gas 0.1843E-52 1.0000 0.5486E-51 0.5486E-51 SO2,gas 0.3091E-14 1.0000 0.9197E-13 0.9197E-13 HF,gas 0.3446E-08 1.0000 0.1025E-06 0.1025E-06 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -2.91 -2.91 0.00 0.000 0.00000E+00 197 argentite -27.89 -27.89 0.00 0.000 -0.61194E-11 206 bornite -87.42 -87.42 0.00 0.000 0.00000E+00 226 topaz -16.06 -16.06 0.00 0.000 0.00000E+00 261 galena -11.87 -11.87 0.00 0.000 0.30597E-11 262 gold,native -18.26 -18.26 0.00 0.000 0.00000E+00 263 silver,native -6.50 -6.50 0.00 0.000 -0.30597E-11 273 sphalerite -10.15 -10.15 0.00 0.000 -0.30597E-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 2.53 -0.01 -2.54 -2.541 0.43760E+04 0.158 2 CO2,gas -5.73 -7.01 -1.29 -0.429 0.22153E+04 1.413 3 CH4,gas 5.24 -4.27 -9.51 -2.377 0.16379E+05 -6.810 4 H2,gas 8.81 0.68 -8.13 -4.643 0.13996E+05 -5.427 5 H2S,gas -5.36 -11.97 -6.62 -3.309 0.11399E+05 -3.919 6 S2,gas -6.41 -25.31 -18.90 -2.908 0.32555E+05 -16.201 7 CO,gas 4.07 -6.32 -10.39 -3.198 0.17900E+05 -7.693 8 SO3,gas 17.84 -14.73 -32.57 -8.142 0.56098E+05 -29.870 9 O2,gas 52.58 -1.38 -53.96 -35.973 0.92943E+05 -51.261 10 SO2,gas 1.70 -14.04 -15.74 -4.196 0.27103E+05 -13.036 11 HF,gas 1.41 -8.28 -9.69 -4.844 0.16687E+05 -6.989 12 HCl,gas 3.28 -5.29 -8.58 -4.289 0.14775E+05 -8.578 17 albite-high 1.02 -2.56 -3.57 -0.275 0.61570E+04 18 albite -0.04 -2.56 -2.51 -0.193 0.43279E+04 22 analcite 3.58 0.34 -3.24 -0.360 0.55834E+04 23 andalusite 5.22 0.49 -4.73 -0.473 0.81447E+04 26 anhydrite -5.06 -8.94 -3.88 -1.940 0.66826E+04 27 ankerite -1.86 -5.57 -3.71 -0.618 0.63842E+04 34 aragonite 1.09 -1.23 -2.31 -0.772 0.39866E+04 36 calcite 0.95 -1.23 -2.18 -0.725 0.37488E+04 53 coesite -2.31 -2.91 -0.60 -0.199 0.10274E+04 60 cristobalite -2.46 -2.91 -0.45 -0.151 0.77822E+03 65 diaspore 2.93 1.70 -1.23 -0.206 0.21270E+04 66 diamond -3.09 -5.63 -2.54 -0.725 0.43715E+04 69 dolomite,ordered 0.78 -3.54 -4.33 -0.721 0.74497E+04 83 gibbsite 4.11 1.69 -2.42 -0.346 0.41678E+04 86 goethite 6.43 2.32 -4.11 -0.889 0.70798E+04 87 graphite -3.52 -5.63 -2.11 -0.602 0.36309E+04 90 halite 1.63 -0.82 -2.45 -1.223 0.42131E+04 96 jadeite 4.37 0.35 -4.01 -0.401 0.69125E+04 99 kaolinite -1.04 -2.44 -1.40 -0.127 0.24093E+04 100 kyanite 5.05 0.49 -4.56 -0.456 0.78582E+04 107 magnesite 0.78 -2.32 -3.10 -1.033 0.53384E+04 117 microcline -2.12 -4.05 -1.92 -0.148 0.33144E+04 121 muscovite 3.04 -0.66 -3.69 -0.217 0.63608E+04 122 paragonite 4.68 0.84 -3.84 -0.226 0.66141E+04 143 pyrite -20.97 -21.95 -0.98 -0.231 0.16876E+04 145 pyrrhotiteFe0.875 -5.89 -9.71 -3.82 -1.405 0.65798E+04 147 pyrophyllite -5.73 -8.25 -2.51 -0.157 0.43254E+04 153 rhodochrosite -0.86 -3.12 -2.26 -0.753 0.38904E+04 155 sanidine -0.92 -4.05 -3.12 -0.240 0.53805E+04 157 siderite -2.47 -4.34 -1.87 -0.623 0.32179E+04 158 sillimanite 5.47 0.49 -4.98 -0.498 0.85693E+04 165 stilbite -6.72 -11.25 -4.52 -0.215 0.77880E+04 171 sulfur -9.02 -12.66 -3.64 -1.120 0.62692E+04 172 sylvite 1.41 -2.31 -3.72 -1.860 0.64081E+04 180 topaz-H 4.77 0.48 -4.29 -0.390 0.73829E+04 181 tridymite -2.52 -2.91 -0.39 -0.130 0.67303E+03 184 troilite-low -4.30 -9.29 -5.00 -1.666 0.86092E+04 198 arsenic -7.16 -11.57 -4.41 -1.137 0.75894E+04 201 beidellite-Ca -1.21 -5.77 -4.56 -0.282 0.78609E+04 202 beidellite-H -1.89 -6.73 -4.84 -0.309 0.83337E+04 203 beidellite-K -1.08 -5.74 -4.66 -0.285 0.80285E+04 204 beidellite-Mg -1.39 -5.95 -4.56 -0.282 0.78572E+04 205 beidellite-Na -0.91 -5.25 -4.34 -0.266 0.74785E+04 208 chalcedony -2.72 -2.91 -0.19 -0.062 0.31920E+03 209 chalcocite -27.48 -28.72 -1.24 -0.310 0.21359E+04 211 covellite -19.64 -20.69 -1.04 -0.398 0.17980E+04 212 dawsonite 1.86 -0.85 -2.72 -0.340 0.46787E+04 214 montmorillonite-Ca -1.87 -6.30 -4.44 -0.274 0.76400E+04 215 montmorillonite-K -1.81 -6.27 -4.46 -0.273 0.76842E+04 216 montmorillonite-Mg -2.05 -6.48 -4.43 -0.274 0.76299E+04 217 montmorillonite-Na -1.60 -5.78 -4.18 -0.256 0.72064E+04 230 gypsum -4.72 -8.96 -4.24 -1.059 0.72960E+04 246 acanthite -27.80 -27.89 -0.09 -0.023 0.15993E+03 252 barite -9.18 -11.66 -2.49 -1.243 0.42830E+04 253 boehmite 4.45 1.70 -2.76 -0.460 0.47492E+04 254 cerussite -2.69 -6.92 -4.23 -1.410 0.72843E+04 255 chalcopyrite -28.15 -29.98 -1.83 -0.340 0.31523E+04 260 fluorite -9.63 -10.76 -1.13 -0.376 0.19414E+04 270 silica-amorphous -1.98 -2.91 -0.92 -0.308 0.15927E+04 271 smithsonite -0.62 -5.20 -4.58 -1.527 0.78882E+04 274 wurtzite -8.33 -10.15 -1.82 -0.606 0.31327E+04 276 an20ab80 2.36 -1.37 -3.73 -0.287 0.64232E+04 277 an25ab75 2.99 -1.07 -4.06 -0.312 0.69948E+04 278 an30ab70 3.62 -0.78 -4.40 -0.338 0.75766E+04 Calculations done for 103.2724 Deg. C; 500.0000 bar Mixer fraction: 1.3000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 103.272 .75686E+00 2.025 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1292E+03 New heat: 1.968 New temperature: 100.071 New mixer fraction: 1.4000000 Resulting temperature: 100.071Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 100.07 C Pressure = 500.00 bar Mixer fraction = 1.4000000 Water: Moles liquid = 0.1334E+03 kg liquid = 0.2402E+01 Moles total = 0.1330E+03 kg total = 0.2397E+01 Activity = 0.9787 Stoichiometric ionic strength = .7252804E+00 Osmotic coef. = 0.9295 True ionic strength = .6139640E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20423E-04 -4.6899 0.13282E-04 -4.8767 0.65034E+00 -0.1869 2 H2O 0.97868E+00 -0.0094 0.97868E+00 -0.0094 3 Cl- 0.60122E+00 -0.2210 0.38178E+00 -0.4182 0.63501E+00 -0.1972 4 SO4-- 0.74954E-04 -4.1252 0.10984E-04 -4.9592 0.14655E+00 -0.8340 5 HCO3- 0.11097E-01 -1.9548 0.70753E-02 -2.1503 0.63758E+00 -0.1955 6 HS- 0.11685E-06 -6.9324 0.74221E-07 -7.1295 0.63518E+00 -0.1971 7 H4SiO4 0.11139E-02 -2.9532 0.11139E-02 -2.9532 0.10000E+01 0.0000 8 Al+++ 0.11980E-10 -10.9215 0.15134E-12 -12.8200 0.12632E-01 -1.8985 9 Ca++ 0.75259E-03 -3.1234 0.10504E-03 -3.9787 0.13957E+00 -0.8552 10 Mg++ 0.62271E-04 -4.2057 0.85409E-05 -5.0685 0.13716E+00 -0.8628 11 Fe++ 0.58319E-06 -6.2342 0.80281E-07 -7.0954 0.13766E+00 -0.8612 12 K+ 0.18849E-01 -1.7247 0.11985E-01 -1.9214 0.63582E+00 -0.1967 13 Na+ 0.59238E+00 -0.2274 0.37395E+00 -0.4272 0.63126E+00 -0.1998 14 Mn++ 0.99079E-05 -5.0040 0.13680E-05 -5.8639 0.13807E+00 -0.8599 15 Zn++ 0.86813E-07 -7.0614 0.11951E-07 -7.9226 0.13766E+00 -0.8612 16 Cu+ 0.69672E-13 -13.1569 0.43975E-13 -13.3568 0.63117E+00 -0.1999 17 Pb++ 0.14121E-08 -8.8501 0.19980E-09 -9.6994 0.14149E+00 -0.8493 18 Ag+ 0.17769E-12 -12.7503 0.11279E-12 -12.9477 0.63476E+00 -0.1974 19 Au+ 0.76993E-24 -24.1135 0.49002E-24 -24.3098 0.63645E+00 -0.1962 20 Ba++ 0.13971E-05 -5.8548 0.19965E-06 -6.6997 0.14291E+00 -0.8450 21 F- 0.61875E-03 -3.2085 0.39477E-03 -3.4037 0.63800E+00 -0.1952 22 H2AsO3- 0.23053E-07 -7.6373 0.15942E-07 -7.7975 0.69151E+00 -0.1602 24 HSiO3- 0.19079E-06 -6.7195 0.12115E-06 -6.9167 0.63501E+00 -0.1972 25 Ca(HSiO3)+ 0.40774E-09 -9.3896 0.25950E-09 -9.5859 0.63645E+00 -0.1962 26 Mg(HSiO3)+ 0.41059E-10 -10.3866 0.26132E-10 -10.5828 0.63645E+00 -0.1962 27 NaHSiO3,aq 0.63793E-06 -6.1952 0.63793E-06 -6.1952 0.10000E+01 0.0000 31 AgCl,aq 0.28700E-10 -10.5421 0.28700E-10 -10.5421 0.10000E+01 0.0000 32 AgCl2- 0.72911E-09 -9.1372 0.46300E-09 -9.3344 0.63501E+00 -0.1972 33 AgCl3-2 0.19466E-09 -9.7107 0.28256E-10 -10.5489 0.14515E+00 -0.8382 38 Ag(HS),aq 0.22298E-08 -8.6517 0.22298E-08 -8.6517 0.10000E+01 0.0000 40 AlO+ 0.11585E-09 -9.9361 0.73735E-10 -10.1323 0.63645E+00 -0.1962 41 AlOH+2 0.37247E-10 -10.4289 0.51622E-11 -11.2872 0.13859E+00 -0.8583 42 HAlO2,aq 0.11537E-08 -8.9379 0.11537E-08 -8.9379 0.10000E+01 0.0000 43 AlO2- 0.32192E-09 -9.4923 0.20495E-09 -9.6883 0.63665E+00 -0.1961 44 AsO2- 0.15017E-07 -7.8234 0.95361E-08 -8.0206 0.63501E+00 -0.1972 45 HAsO2,aq 0.21935E-04 -4.6589 0.21935E-04 -4.6589 0.10000E+01 0.0000 46 H3AsO3,aq 0.31990E-04 -4.4950 0.31990E-04 -4.4950 0.10000E+01 0.0000 62 BaCO3,aq 0.38413E-10 -10.4155 0.38413E-10 -10.4155 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.12883E-06 -6.8900 0.82410E-07 -7.0840 0.63966E+00 -0.1941 64 BaCl+ 0.16559E-06 -6.7810 0.10539E-06 -6.9772 0.63645E+00 -0.1962 65 BaF+ 0.25318E-09 -9.5966 0.16114E-09 -9.7928 0.63645E+00 -0.1962 66 CH4,aq 0.52750E-10 -10.2778 0.48202E-10 -10.3169 0.91379E+00 -0.0392 72 CO2,aq 0.13453E+00 -0.8712 0.12293E+00 -0.9103 0.91379E+00 -0.0392 73 CO3-2 0.52797E-06 -6.2774 0.76638E-07 -7.1156 0.14515E+00 -0.8382 74 CaCO3,aq 0.84241E-07 -7.0745 0.84241E-07 -7.0745 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.27030E-04 -4.5682 0.17203E-04 -4.7644 0.63645E+00 -0.1962 76 CaCl+ 0.90987E-04 -4.0410 0.57908E-04 -4.2373 0.63645E+00 -0.1962 77 CaCl2,aq 0.44412E-05 -5.3525 0.44412E-05 -5.3525 0.10000E+01 0.0000 78 CaF+ 0.84822E-06 -6.0715 0.53985E-06 -6.2677 0.63645E+00 -0.1962 79 CaOH+ 0.79979E-09 -9.0970 0.50902E-09 -9.2933 0.63645E+00 -0.1962 80 CaSO4,aq 0.31664E-06 -6.4994 0.31664E-06 -6.4994 0.10000E+01 0.0000 81 HCl,aq 0.11647E-05 -5.9338 0.11647E-05 -5.9338 0.10000E+01 0.0000 90 CuCl,aq 0.94371E-10 -10.0252 0.94371E-10 -10.0252 0.10000E+01 0.0000 91 CuCl2- 0.92653E-09 -9.0331 0.58836E-09 -9.2304 0.63501E+00 -0.1972 92 CuCl3-2 0.92542E-10 -10.0337 0.13433E-10 -10.8718 0.14515E+00 -0.8382 98 HF,aq 0.27815E-04 -4.5557 0.27815E-04 -4.5557 0.10000E+01 0.0000 99 HF2- 0.49875E-08 -8.3021 0.31671E-08 -8.4993 0.63501E+00 -0.1972 101 FeCl+ 0.67629E-07 -7.1699 0.43043E-07 -7.3661 0.63645E+00 -0.1962 104 FeF+ 0.22521E-08 -8.6474 0.14333E-08 -8.8437 0.63645E+00 -0.1962 107 FeOH+ 0.35858E-09 -9.4454 0.22822E-09 -9.6416 0.63645E+00 -0.1962 113 H2,aq 0.17421E-08 -8.7589 0.15919E-08 -8.7981 0.91379E+00 -0.0392 114 KCl,aq 0.68570E-04 -4.1639 0.68570E-04 -4.1639 0.10000E+01 0.0000 116 KOH,aq 0.45437E-09 -9.3426 0.45437E-09 -9.3426 0.10000E+01 0.0000 117 KSO4- 0.30833E-05 -5.5110 0.19579E-05 -5.7082 0.63501E+00 -0.1972 118 MgCO3,aq 0.16576E-08 -8.7805 0.16576E-08 -8.7805 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.22284E-05 -5.6520 0.14183E-05 -5.8482 0.63645E+00 -0.1962 120 MgCl+ 0.67449E-05 -5.1710 0.42928E-05 -5.3673 0.63645E+00 -0.1962 121 MgF+ 0.25444E-06 -6.5944 0.16194E-06 -6.7907 0.63645E+00 -0.1962 122 MgOH+ 0.35883E-09 -9.4451 0.22837E-09 -9.6414 0.63645E+00 -0.1962 124 MnF+ 0.12535E-07 -7.9019 0.79778E-08 -8.0981 0.63645E+00 -0.1962 126 MnOH+ 0.57047E-09 -9.2438 0.36308E-09 -9.4400 0.63645E+00 -0.1962 131 MnCl+ 0.44263E-05 -5.3540 0.28171E-05 -5.5502 0.63645E+00 -0.1962 132 MnSO4,aq 0.38319E-08 -8.4166 0.38319E-08 -8.4166 0.10000E+01 0.0000 133 NaCl,aq 0.41874E-01 -1.3781 0.41874E-01 -1.3781 0.10000E+01 0.0000 134 NaF,aq 0.29958E-04 -4.5235 0.29958E-04 -4.5235 0.10000E+01 0.0000 135 NaOH,aq 0.14636E-07 -7.8346 0.14636E-07 -7.8346 0.10000E+01 0.0000 137 OH- 0.93241E-07 -7.0304 0.59362E-07 -7.2265 0.63665E+00 -0.1961 140 PbCl+ 0.66695E-08 -8.1759 0.42448E-08 -8.3721 0.63645E+00 -0.1962 141 PbCl2,aq 0.87893E-08 -8.0560 0.87893E-08 -8.0560 0.10000E+01 0.0000 142 PbCl3- 0.24216E-08 -8.6159 0.15377E-08 -8.8131 0.63501E+00 -0.1972 143 PbCl4-2 0.10808E-08 -8.9662 0.15688E-09 -9.8044 0.14515E+00 -0.8382 144 PbF+ 0.16122E-10 -10.7926 0.10261E-10 -10.9888 0.63645E+00 -0.1962 150 H2S,aq 0.26112E-05 -5.5832 0.23861E-05 -5.6223 0.91379E+00 -0.0392 159 HSO4- 0.16179E-06 -6.7910 0.10377E-06 -6.9839 0.64137E+00 -0.1929 173 ZnCl+ 0.58879E-06 -6.2300 0.37473E-06 -6.4263 0.63645E+00 -0.1962 174 ZnCl2,aq 0.80262E-07 -7.0955 0.80262E-07 -7.0955 0.10000E+01 0.0000 175 ZnCl3- 0.73505E-08 -8.1337 0.46677E-08 -8.3309 0.63501E+00 -0.1972 176 ZnF+ 0.20578E-09 -9.6866 0.13097E-09 -9.8828 0.63645E+00 -0.1962 178 ZnOH+ 0.82597E-08 -8.0830 0.52569E-08 -8.2793 0.63645E+00 -0.1962 Charge balance for all species = -.5395E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2042334E-04 0.1346352E+00 0.1298733E+03 0.0000 2 H2O 0.1000000E+01 0.5537370E+02 0.9547098E+06 0.0000 3 Cl- 0.6012181E+00 0.6432739E+00 0.2182606E+05 4.4585 4 SO4-- 0.7495442E-04 0.7851949E-04 0.7218611E+01 4.7942 5 HCO3- 0.1109711E-01 0.1456578E+00 0.8505745E+04 2.7265 6 HS- 0.1168505E-06 0.2730798E-05 0.8643237E-01 -2.2527 7 H4SiO4 0.1113896E-02 0.1114725E-02 0.1025385E+03 -2.9532 8 Al+++ 0.1198036E-10 0.1640670E-08 0.4236563E-04 1.8102 9 Ca++ 0.7525929E-03 0.8763008E-03 0.3361133E+02 5.7748 10 Mg++ 0.6227058E-04 0.7150039E-04 0.1663625E+01 4.6850 11 Fe++ 0.5831935E-06 0.6534340E-06 0.3492432E-01 2.6581 12 K+ 0.1884949E-01 0.1892114E-01 0.7080643E+03 2.9554 13 Na+ 0.5923776E+00 0.6342822E+00 0.1395546E+05 4.4495 14 Mn++ 0.9907885E-05 0.1435113E-04 0.7545452E+00 3.8896 15 Zn++ 0.8681337E-07 0.7716798E-06 0.4827719E-01 1.8309 16 Cu+ 0.6967169E-13 0.1113512E-08 0.6771242E-04 -8.4801 17 Pb++ 0.1412104E-08 0.2039580E-07 0.4044231E-02 0.0541 18 Ag+ 0.1776873E-12 0.3189836E-08 0.3293028E-03 -8.0710 19 Au+ 0.7699316E-24 0.7892564E-12 0.1487777E-06 -19.4331 20 Ba++ 0.1397098E-05 0.1691809E-05 0.2223693E+00 3.0537 21 F- 0.6187540E-03 0.6776548E-03 0.1232091E+02 1.4731 22 H2AsO3- 0.2305328E-07 0.5396274E-04 0.6452187E+01 -2.9207 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234474E+00 -.1224303E-04 0.0000000E+00 2 H2O 0.1330294E+03 0.1330297E+03 -.2650682E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4186781E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6560464E-05 0.7469847E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2678014E-02 0.1337274E-03 0.0000000E+00 8 Al+++ 0.2407279E-05 0.3941542E-08 0.2403337E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569809E-05 0.3349641E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.1853882E-05 0.5614294E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.2675098E-08 0.1674820E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.4899883E-07 0.1516022E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.7663256E-08 0.4194648E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.1896108E-11 0.1214853E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627997E-02 0.2403337E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.8470E-21 Mass of aqueous solution: 0.251026E+04 g Temperature = 100.07 C Pressure = 500.00 bar Mixer frac. = 1.4000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.1325E-03 -3.878 0.7962E-02 -2.099 86.91 0.3007E-02 argentite 0.2097E-06 -6.678 0.5197E-04 -4.284 0.5673 0.7298E-05 bornite 0.3350E-07 -7.475 0.1681E-04 -4.774 0.1835 0.3307E-05 topaz 0.1202E-05 -5.920 0.2212E-03 -3.655 2.414 0.6191E-04 galena 0.1516E-05 -5.819 0.3627E-03 -3.440 3.959 0.4774E-04 gold,native 0.1215E-11 -11.915 0.2393E-09 -9.621 0.2612E-05 0.1241E-10 silver,native 0.9433E-12 -12.025 0.1018E-09 -9.992 0.1111E-05 0.9690E-11 sphalerite 0.5614E-05 -5.251 0.5470E-03 -3.262 5.970 0.1338E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5629E+00 0.2323E+00 0.4126 -0.634 silver,native 0.4371E+00 0.7153E-01 0.1637 -1.145 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.4000000 Solid products produced: Mass = 0.009162 g Volume = 0.003261 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 100.0710 deg.C Sat. pressure: 27.7418 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.5444E-01 0.8543 0.1290E+01 0.1510E+01 CO2,gas 0.9456E+00 0.9249 0.2426E+02 0.2623E+02 CH4,gas 0.4833E-08 1.0225 0.1371E-06 0.1341E-06 H2,gas 0.1105E-06 1.0149 0.3110E-05 0.3064E-05 H2S,gas 0.4443E-05 0.8997 0.1109E-03 0.1233E-03 S2,gas 0.1737E-17 1.0000 0.4818E-16 0.4818E-16 CO,gas 0.5674E-09 1.0000 0.1574E-07 0.1574E-07 SO3,gas 0.2560E-31 1.0000 0.7102E-30 0.7102E-30 O2,gas 0.6050E-53 1.0000 0.1678E-51 0.1678E-51 SO2,gas 0.2402E-14 1.0000 0.6662E-13 0.6662E-13 HF,gas 0.3036E-08 1.0000 0.8423E-07 0.8423E-07 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -2.93 -2.93 0.00 0.000 0.00000E+00 197 argentite -28.15 -28.15 0.00 0.000 0.00000E+00 206 bornite -88.10 -88.10 0.00 0.000 -0.24269E-10 226 topaz -15.89 -15.89 0.00 0.000 0.60673E-11 261 galena -11.95 -11.95 0.00 0.000 -0.60673E-11 262 gold,native -18.47 -18.47 0.00 0.000 0.00000E+00 263 silver,native -6.59 -6.59 0.00 0.000 0.00000E+00 273 sphalerite -10.18 -10.18 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 2.58 -0.01 -2.59 -2.588 0.44202E+04 0.111 2 CO2,gas -5.70 -7.02 -1.31 -0.438 0.22442E+04 1.385 3 CH4,gas 5.23 -4.33 -9.56 -2.390 0.16330E+05 -6.863 4 H2,gas 8.87 0.67 -8.21 -4.689 0.14015E+05 -5.507 5 H2S,gas -5.35 -12.01 -6.65 -3.327 0.11364E+05 -3.955 6 S2,gas -6.33 -25.35 -19.02 -2.926 0.32476E+05 -16.317 7 CO,gas 4.16 -6.34 -10.50 -3.231 0.17935E+05 -7.803 8 SO3,gas 18.14 -14.70 -32.85 -8.212 0.56097E+05 -30.149 9 O2,gas 53.12 -1.35 -54.47 -36.316 0.93031E+05 -51.775 10 SO2,gas 1.85 -14.03 -15.88 -4.233 0.27112E+05 -13.176 11 HF,gas 1.49 -8.28 -9.77 -4.887 0.16691E+05 -7.075 12 HCl,gas 3.38 -5.29 -8.68 -4.340 0.14823E+05 -8.680 17 albite-high 1.13 -2.56 -3.69 -0.284 0.62999E+04 18 albite 0.05 -2.56 -2.61 -0.201 0.44578E+04 22 analcite 3.70 0.36 -3.34 -0.371 0.57051E+04 23 andalusite 5.49 0.66 -4.83 -0.483 0.82557E+04 26 anhydrite -5.01 -8.94 -3.93 -1.966 0.67162E+04 27 ankerite -1.78 -5.62 -3.84 -0.640 0.65534E+04 34 aragonite 1.13 -1.25 -2.38 -0.795 0.40717E+04 36 calcite 0.99 -1.25 -2.25 -0.749 0.38361E+04 53 coesite -2.33 -2.93 -0.60 -0.200 0.10262E+04 60 cristobalite -2.48 -2.93 -0.46 -0.153 0.78361E+03 65 diaspore 3.06 1.79 -1.26 -0.211 0.21583E+04 66 diamond -3.14 -5.66 -2.52 -0.721 0.43112E+04 69 dolomite,ordered 0.88 -3.59 -4.48 -0.746 0.76441E+04 83 gibbsite 4.23 1.78 -2.45 -0.350 0.41793E+04 86 goethite 6.52 2.31 -4.21 -0.911 0.71922E+04 87 graphite -3.57 -5.66 -2.09 -0.598 0.35735E+04 90 halite 1.63 -0.85 -2.48 -1.240 0.42341E+04 96 jadeite 4.48 0.37 -4.11 -0.411 0.70179E+04 99 kaolinite -0.86 -2.30 -1.43 -0.130 0.24497E+04 100 kyanite 5.32 0.66 -4.66 -0.466 0.79622E+04 107 magnesite 0.85 -2.34 -3.19 -1.063 0.54472E+04 117 microcline -2.06 -4.06 -1.99 -0.153 0.34039E+04 121 muscovite 3.35 -0.47 -3.82 -0.225 0.65216E+04 122 paragonite 5.01 1.02 -3.99 -0.235 0.68091E+04 143 pyrite -21.07 -22.02 -0.95 -0.225 0.16306E+04 145 pyrrhotiteFe0.875 -5.89 -9.76 -3.88 -1.426 0.66211E+04 147 pyrophyllite -5.58 -8.15 -2.57 -0.161 0.43933E+04 153 rhodochrosite -0.83 -3.14 -2.31 -0.770 0.39428E+04 155 sanidine -0.85 -4.06 -3.20 -0.246 0.54699E+04 157 siderite -2.44 -4.37 -1.93 -0.644 0.32979E+04 165 stilbite -6.63 -11.25 -4.61 -0.220 0.78796E+04 171 sulfur -9.05 -12.67 -3.62 -1.115 0.61861E+04 172 sylvite 1.40 -2.34 -3.74 -1.871 0.63918E+04 180 topaz-H 5.00 0.65 -4.36 -0.396 0.74397E+04 181 tridymite -2.54 -2.93 -0.40 -0.132 0.67609E+03 198 arsenic -7.23 -11.65 -4.41 -1.139 0.75362E+04 201 beidellite-Ca -0.97 -5.64 -4.67 -0.289 0.79742E+04 202 beidellite-H -1.66 -6.60 -4.93 -0.315 0.84201E+04 203 beidellite-K -0.86 -5.62 -4.76 -0.291 0.81260E+04 204 beidellite-Mg -1.15 -5.82 -4.67 -0.289 0.79755E+04 205 beidellite-Na -0.68 -5.13 -4.44 -0.272 0.75878E+04 208 chalcedony -2.75 -2.93 -0.19 -0.062 0.31930E+03 209 chalcocite -27.72 -28.97 -1.24 -0.311 0.21242E+04 211 covellite -19.80 -20.82 -1.02 -0.389 0.17426E+04 212 dawsonite 1.95 -0.79 -2.74 -0.343 0.46794E+04 214 montmorillonite-Ca -1.70 -6.25 -4.55 -0.282 0.77750E+04 215 montmorillonite-K -1.66 -6.23 -4.57 -0.280 0.78055E+04 216 montmorillonite-Mg -1.88 -6.43 -4.55 -0.281 0.77695E+04 217 montmorillonite-Na -1.44 -5.74 -4.30 -0.263 0.73373E+04 230 gypsum -4.69 -8.96 -4.26 -1.065 0.72786E+04 246 acanthite -28.06 -28.15 -0.09 -0.022 0.15214E+03 252 barite -9.17 -11.66 -2.49 -1.243 0.42454E+04 253 boehmite 4.60 1.79 -2.81 -0.468 0.47926E+04 254 cerussite -2.69 -6.97 -4.28 -1.427 0.73127E+04 255 chalcopyrite -28.32 -30.17 -1.85 -0.344 0.31574E+04 260 fluorite -9.62 -10.79 -1.16 -0.388 0.19857E+04 270 silica-amorphous -2.00 -2.93 -0.94 -0.312 0.15997E+04 271 smithsonite -0.57 -5.20 -4.63 -1.543 0.79038E+04 274 wurtzite -8.34 -10.18 -1.83 -0.612 0.31332E+04 276 an20ab80 2.50 -1.35 -3.86 -0.297 0.65850E+04 277 an25ab75 3.15 -1.05 -4.19 -0.323 0.71642E+04 278 an30ab70 3.79 -0.75 -4.54 -0.349 0.77536E+04 Calculations done for 100.0710 Deg. C; 500.0000 bar Mixer fraction: 1.4000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 100.071 .72528E+00 1.968 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1348E+03 New heat: 1.916 New temperature: 97.121 New mixer fraction: 1.5000000 Resulting temperature: 97.121Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 97.12 C Pressure = 500.00 bar Mixer fraction = 1.5000000 Water: Moles liquid = 0.1389E+03 kg liquid = 0.2502E+01 Moles total = 0.1386E+03 kg total = 0.2497E+01 Activity = 0.9795 Stoichiometric ionic strength = .6962290E+00 Osmotic coef. = 0.9292 True ionic strength = .5915470E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.20831E-04 -4.6813 0.13649E-04 -4.8649 0.65521E+00 -0.1836 2 H2O 0.97953E+00 -0.0090 0.97953E+00 -0.0090 3 Cl- 0.57930E+00 -0.2371 0.36975E+00 -0.4321 0.63828E+00 -0.1950 4 SO4-- 0.72090E-04 -4.1421 0.10929E-04 -4.9614 0.15160E+00 -0.8193 5 HCO3- 0.10656E-01 -1.9724 0.68251E-02 -2.1659 0.64052E+00 -0.1935 6 HS- 0.10588E-06 -6.9752 0.67592E-07 -7.1701 0.63841E+00 -0.1949 7 H4SiO4 0.10587E-02 -2.9752 0.10587E-02 -2.9752 0.10000E+01 0.0000 8 Al+++ 0.14681E-10 -10.8333 0.20110E-12 -12.6966 0.13698E-01 -1.8633 9 Ca++ 0.72817E-03 -3.1378 0.10532E-03 -3.9775 0.14464E+00 -0.8397 10 Mg++ 0.60112E-04 -4.2210 0.85564E-05 -5.0677 0.14234E+00 -0.8467 11 Fe++ 0.56252E-06 -6.2499 0.80335E-07 -7.0951 0.14281E+00 -0.8452 12 K+ 0.18102E-01 -1.7423 0.11561E-01 -1.9370 0.63867E+00 -0.1947 13 Na+ 0.57080E+00 -0.2435 0.36217E+00 -0.4411 0.63450E+00 -0.1976 14 Mn++ 0.97626E-05 -5.0104 0.13980E-05 -5.8545 0.14320E+00 -0.8440 15 Zn++ 0.88777E-07 -7.0517 0.12678E-07 -7.8969 0.14281E+00 -0.8452 16 Cu+ 0.56565E-13 -13.2475 0.35886E-13 -13.4451 0.63442E+00 -0.1976 17 Pb++ 0.12892E-08 -8.8897 0.18889E-09 -9.7238 0.14652E+00 -0.8341 18 Ag+ 0.14261E-12 -12.8459 0.90939E-13 -13.0412 0.63768E+00 -0.1954 19 Au+ 0.52639E-24 -24.2787 0.33650E-24 -24.4730 0.63926E+00 -0.1943 20 Ba++ 0.13597E-05 -5.8665 0.20110E-06 -6.6966 0.14790E+00 -0.8300 21 F- 0.59637E-03 -3.2245 0.38284E-03 -3.4170 0.64194E+00 -0.1925 22 H2AsO3- 0.19770E-07 -7.7040 0.13691E-07 -7.8636 0.69250E+00 -0.1596 24 HSiO3- 0.16890E-06 -6.7724 0.10781E-06 -6.9674 0.63828E+00 -0.1950 25 Ca(HSiO3)+ 0.34613E-09 -9.4608 0.22127E-09 -9.6551 0.63926E+00 -0.1943 26 Mg(HSiO3)+ 0.35278E-10 -10.4525 0.22552E-10 -10.6468 0.63926E+00 -0.1943 27 NaHSiO3,aq 0.56908E-06 -6.2448 0.56908E-06 -6.2448 0.10000E+01 0.0000 31 AgCl,aq 0.22850E-10 -10.6411 0.22850E-10 -10.6411 0.10000E+01 0.0000 32 AgCl2- 0.56510E-09 -9.2479 0.36069E-09 -9.4429 0.63828E+00 -0.1950 33 AgCl3-2 0.14566E-09 -9.8367 0.21884E-10 -10.6599 0.15024E+00 -0.8232 38 Ag(HS),aq 0.20846E-08 -8.6810 0.20846E-08 -8.6810 0.10000E+01 0.0000 40 AlO+ 0.11334E-09 -9.9456 0.72456E-10 -10.1399 0.63926E+00 -0.1943 41 AlOH+2 0.40272E-10 -10.3950 0.57871E-11 -11.2375 0.14370E+00 -0.8425 42 HAlO2,aq 0.10016E-08 -8.9993 0.10016E-08 -8.9993 0.10000E+01 0.0000 43 AlO2- 0.24946E-09 -9.6030 0.15977E-09 -9.7965 0.64048E+00 -0.1935 44 AsO2- 0.13489E-07 -7.8700 0.86098E-08 -8.0650 0.63828E+00 -0.1950 45 HAsO2,aq 0.21334E-04 -4.6709 0.21334E-04 -4.6709 0.10000E+01 0.0000 46 H3AsO3,aq 0.30439E-04 -4.5166 0.30439E-04 -4.5166 0.10000E+01 0.0000 62 BaCO3,aq 0.33931E-10 -10.4694 0.33931E-10 -10.4694 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.11378E-06 -6.9439 0.73082E-07 -7.1362 0.64229E+00 -0.1923 64 BaCl+ 0.15043E-06 -6.8227 0.96163E-07 -7.0170 0.63926E+00 -0.1943 65 BaF+ 0.23287E-09 -9.6329 0.14887E-09 -9.8272 0.63926E+00 -0.1943 66 CH4,aq 0.46823E-10 -10.3295 0.42860E-10 -10.3679 0.91536E+00 -0.0384 72 CO2,aq 0.12915E+00 -0.8889 0.11822E+00 -0.9273 0.91536E+00 -0.0384 73 CO3-2 0.48111E-06 -6.3178 0.72283E-07 -7.1410 0.15024E+00 -0.8232 74 CaCO3,aq 0.74271E-07 -7.1292 0.74271E-07 -7.1292 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.24769E-04 -4.6061 0.15834E-04 -4.8004 0.63926E+00 -0.1943 76 CaCl+ 0.83214E-04 -4.0798 0.53195E-04 -4.2741 0.63926E+00 -0.1943 77 CaCl2,aq 0.39713E-05 -5.4011 0.39713E-05 -5.4011 0.10000E+01 0.0000 78 CaF+ 0.77641E-06 -6.1099 0.49633E-06 -6.3042 0.63926E+00 -0.1943 79 CaOH+ 0.64202E-09 -9.1925 0.41041E-09 -9.3868 0.63926E+00 -0.1943 80 CaSO4,aq 0.30301E-06 -6.5185 0.30301E-06 -6.5185 0.10000E+01 0.0000 81 HCl,aq 0.11421E-05 -5.9423 0.11421E-05 -5.9423 0.10000E+01 0.0000 90 CuCl,aq 0.75898E-10 -10.1198 0.75898E-10 -10.1198 0.10000E+01 0.0000 91 CuCl2- 0.71863E-09 -9.1435 0.45868E-09 -9.3385 0.63828E+00 -0.1950 92 CuCl3-2 0.69357E-10 -10.1589 0.10420E-10 -10.9821 0.15024E+00 -0.8232 98 HF,aq 0.25993E-04 -4.5851 0.25993E-04 -4.5851 0.10000E+01 0.0000 99 HF2- 0.44791E-08 -8.3488 0.28589E-08 -8.5438 0.63828E+00 -0.1950 101 FeCl+ 0.62357E-07 -7.2051 0.39862E-07 -7.3994 0.63926E+00 -0.1943 104 FeF+ 0.20948E-08 -8.6789 0.13391E-08 -8.8732 0.63926E+00 -0.1943 107 FeOH+ 0.30567E-09 -9.5147 0.19540E-09 -9.7091 0.63926E+00 -0.1943 113 H2,aq 0.14434E-08 -8.8406 0.13212E-08 -8.8790 0.91536E+00 -0.0384 114 KCl,aq 0.60017E-04 -4.2217 0.60017E-04 -4.2217 0.10000E+01 0.0000 116 KOH,aq 0.37371E-09 -9.4275 0.37371E-09 -9.4275 0.10000E+01 0.0000 117 KSO4- 0.28360E-05 -5.5473 0.18101E-05 -5.7423 0.63828E+00 -0.1950 118 MgCO3,aq 0.14901E-08 -8.8268 0.14901E-08 -8.8268 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.20408E-05 -5.6902 0.13046E-05 -5.8845 0.63926E+00 -0.1943 120 MgCl+ 0.62544E-05 -5.2038 0.39982E-05 -5.3981 0.63926E+00 -0.1943 121 MgF+ 0.23428E-06 -6.6303 0.14976E-06 -6.8246 0.63926E+00 -0.1943 122 MgOH+ 0.29446E-09 -9.5310 0.18824E-09 -9.7253 0.63926E+00 -0.1943 124 MnF+ 0.11834E-07 -7.9269 0.75647E-08 -8.1212 0.63926E+00 -0.1943 126 MnOH+ 0.48848E-09 -9.3112 0.31226E-09 -9.5055 0.63926E+00 -0.1943 131 MnCl+ 0.39990E-05 -5.3980 0.25564E-05 -5.5924 0.63926E+00 -0.1943 132 MnSO4,aq 0.36996E-08 -8.4318 0.36996E-08 -8.4318 0.10000E+01 0.0000 133 NaCl,aq 0.38104E-01 -1.4190 0.38104E-01 -1.4190 0.10000E+01 0.0000 134 NaF,aq 0.27177E-04 -4.5658 0.27177E-04 -4.5658 0.10000E+01 0.0000 135 NaOH,aq 0.12271E-07 -7.9111 0.12271E-07 -7.9111 0.10000E+01 0.0000 137 OH- 0.81101E-07 -7.0910 0.51943E-07 -7.2845 0.64048E+00 -0.1935 140 PbCl+ 0.58294E-08 -8.2344 0.37265E-08 -8.4287 0.63926E+00 -0.1943 141 PbCl2,aq 0.72713E-08 -8.1384 0.72713E-08 -8.1384 0.10000E+01 0.0000 142 PbCl3- 0.19094E-08 -8.7191 0.12188E-08 -8.9141 0.63828E+00 -0.1950 143 PbCl4-2 0.81038E-09 -9.0913 0.12175E-09 -9.9145 0.15024E+00 -0.8232 144 PbF+ 0.14370E-10 -10.8425 0.91861E-11 -11.0369 0.63926E+00 -0.1943 150 H2S,aq 0.24623E-05 -5.6087 0.22539E-05 -5.6471 0.91536E+00 -0.0384 159 HSO4- 0.14941E-06 -6.8256 0.96229E-07 -7.0167 0.64404E+00 -0.1911 173 ZnCl+ 0.52108E-06 -6.2831 0.33310E-06 -6.4774 0.63926E+00 -0.1943 174 ZnCl2,aq 0.69216E-07 -7.1598 0.69216E-07 -7.1598 0.10000E+01 0.0000 175 ZnCl3- 0.62359E-08 -8.2051 0.39802E-08 -8.4001 0.63828E+00 -0.1950 176 ZnF+ 0.20220E-09 -9.6942 0.12925E-09 -9.8886 0.63926E+00 -0.1943 178 ZnOH+ 0.70534E-08 -8.1516 0.45089E-08 -8.3459 0.63926E+00 -0.1943 Charge balance for all species = -.5180E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2083130E-04 0.1292550E+00 0.1248979E+03 0.0000 2 H2O 0.1000000E+01 0.5537907E+02 0.9564459E+06 0.0000 3 Cl- 0.5792998E+00 0.6175674E+00 0.2098991E+05 4.4328 4 SO4-- 0.7209001E-04 0.7538168E-04 0.6942068E+01 4.7684 5 HCO3- 0.1065550E-01 0.1398370E+00 0.8179893E+04 2.6990 6 HS- 0.1058767E-06 0.2570660E-05 0.8150390E-01 -2.3052 7 H4SiO4 0.1058673E-02 0.1059411E-02 0.9761816E+02 -2.9752 8 Al+++ 0.1468057E-10 0.1419342E-08 0.3671355E-04 1.8981 9 Ca++ 0.7281731E-03 0.8412820E-03 0.3232369E+02 5.7523 10 Mg++ 0.6011177E-04 0.6864309E-04 0.1599892E+01 4.6621 11 Fe++ 0.5625222E-06 0.6272805E-06 0.3358419E-01 2.6347 12 K+ 0.1810216E-01 0.1816501E-01 0.6809385E+03 2.9279 13 Na+ 0.5708032E+00 0.6089350E+00 0.1342083E+05 4.4238 14 Mn++ 0.9762583E-05 0.1377763E-04 0.7256388E+00 3.8753 15 Zn++ 0.8877651E-07 0.6925622E-06 0.4340207E-01 1.8329 16 Cu+ 0.5656474E-13 0.8639386E-09 0.5262636E-04 -8.5802 17 Pb++ 0.1289217E-08 0.1712954E-07 0.3402419E-02 0.0060 18 Ag+ 0.1426081E-12 0.2823605E-08 0.2919966E-03 -8.1763 19 Au+ 0.5263876E-24 0.6884618E-12 0.1300010E-06 -19.6081 20 Ba++ 0.1359722E-05 0.1624201E-05 0.2138504E+00 3.0332 21 F- 0.5963703E-03 0.6505742E-03 0.1184890E+02 1.4479 22 H2AsO3- 0.1977045E-07 0.5180628E-04 0.6205006E+01 -2.9987 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234475E+00 -.1237135E-04 0.0000000E+00 2 H2O 0.1385802E+03 0.1385805E+03 -.3189572E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4199575E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6432818E-05 0.7597492E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2651069E-02 0.1606720E-03 0.0000000E+00 8 Al+++ 0.2407279E-05 0.3551760E-08 0.2403727E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569706E-05 0.3359904E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.1733067E-05 0.5735109E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.2161919E-08 0.1679952E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.4286496E-07 0.1522156E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.7065787E-08 0.4200623E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.1722806E-11 0.1388154E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627996E-02 0.2403727E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.4235E-21 Mass of aqueous solution: 0.261026E+04 g Temperature = 97.12 C Pressure = 500.00 bar Mixer frac. = 1.5000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.1595E-03 -3.797 0.9581E-02 -2.019 88.76 0.3618E-02 argentite 0.2100E-06 -6.678 0.5205E-04 -4.284 0.4822 0.7309E-05 bornite 0.3360E-07 -7.474 0.1686E-04 -4.773 0.1562 0.3317E-05 topaz 0.1202E-05 -5.920 0.2212E-03 -3.655 2.049 0.6192E-04 galena 0.1522E-05 -5.818 0.3642E-03 -3.439 3.374 0.4793E-04 gold,native 0.1388E-11 -11.858 0.2734E-09 -9.563 0.2533E-05 0.1418E-10 silver,native 0.1057E-11 -11.976 0.1140E-09 -9.943 0.1056E-05 0.1086E-10 sphalerite 0.5735E-05 -5.241 0.5588E-03 -3.253 5.177 0.1367E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5677E+00 0.2374E+00 0.4181 -0.625 silver,native 0.4323E+00 0.6771E-01 0.1566 -1.169 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.5000000 Solid products produced: Mass = 0.010794 g Volume = 0.003875 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 97.1206 deg.C Sat. pressure: 25.9934 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.5203E-01 0.8623 0.1166E+01 0.1353E+01 CO2,gas 0.9480E+00 0.9273 0.2285E+02 0.2464E+02 CH4,gas 0.4617E-08 1.0208 0.1225E-06 0.1200E-06 H2,gas 0.9944E-07 1.0141 0.2621E-05 0.2585E-05 H2S,gas 0.4373E-05 0.9037 0.1027E-03 0.1137E-03 S2,gas 0.1450E-17 1.0000 0.3770E-16 0.3770E-16 CO,gas 0.4793E-09 1.0000 0.1246E-07 0.1246E-07 SO3,gas 0.1509E-31 1.0000 0.3924E-30 0.3924E-30 O2,gas 0.2159E-53 1.0000 0.5613E-52 0.5613E-52 SO2,gas 0.1902E-14 1.0000 0.4944E-13 0.4944E-13 HF,gas 0.2699E-08 1.0000 0.7015E-07 0.7015E-07 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -2.96 -2.96 0.00 0.000 0.00000E+00 197 argentite -28.39 -28.39 0.00 0.000 0.60194E-11 206 bornite -88.73 -88.73 0.00 0.000 0.00000E+00 226 topaz -15.74 -15.74 0.00 0.000 0.00000E+00 261 galena -12.03 -12.03 0.00 0.000 0.00000E+00 262 gold,native -18.66 -18.66 0.00 0.000 -0.60194E-11 263 silver,native -6.68 -6.68 0.00 0.000 -0.15048E-11 273 sphalerite -10.20 -10.20 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 2.62 -0.01 -2.63 -2.632 0.44597E+04 0.067 2 CO2,gas -5.68 -7.02 -1.34 -0.447 0.22706E+04 1.359 3 CH4,gas 5.23 -4.38 -9.61 -2.403 0.16284E+05 -6.912 4 H2,gas 8.94 0.66 -8.28 -4.732 0.14030E+05 -5.582 5 H2S,gas -5.35 -12.04 -6.69 -3.344 0.11330E+05 -3.988 6 S2,gas -6.26 -25.38 -19.12 -2.942 0.32399E+05 -16.424 7 CO,gas 4.25 -6.36 -10.60 -3.263 0.17965E+05 -7.905 8 SO3,gas 18.42 -14.68 -33.11 -8.276 0.56090E+05 -30.406 9 O2,gas 53.62 -1.33 -54.95 -36.633 0.93101E+05 -52.251 10 SO2,gas 1.99 -14.02 -16.00 -4.268 0.27117E+05 -13.306 11 HF,gas 1.57 -8.28 -9.85 -4.926 0.16694E+05 -7.154 12 HCl,gas 3.48 -5.30 -8.77 -4.387 0.14866E+05 -8.774 17 albite-high 1.23 -2.57 -3.80 -0.292 0.64309E+04 18 albite 0.13 -2.57 -2.70 -0.208 0.45767E+04 22 analcite 3.81 0.38 -3.43 -0.381 0.58166E+04 23 andalusite 5.74 0.81 -4.93 -0.493 0.83544E+04 26 anhydrite -4.96 -8.94 -3.98 -1.992 0.67488E+04 27 ankerite -1.71 -5.67 -3.96 -0.660 0.67134E+04 34 aragonite 1.17 -1.28 -2.45 -0.817 0.41519E+04 36 calcite 1.03 -1.28 -2.31 -0.771 0.39184E+04 53 coesite -2.35 -2.96 -0.61 -0.202 0.10251E+04 60 cristobalite -2.49 -2.96 -0.47 -0.155 0.78835E+03 65 diaspore 3.17 1.88 -1.29 -0.215 0.21859E+04 66 diamond -3.18 -5.69 -2.51 -0.718 0.42560E+04 69 dolomite,ordered 0.97 -3.65 -4.62 -0.770 0.78271E+04 83 gibbsite 4.34 1.87 -2.47 -0.353 0.41885E+04 86 goethite 6.60 2.29 -4.31 -0.931 0.72965E+04 87 graphite -3.62 -5.69 -2.08 -0.594 0.35210E+04 90 halite 1.64 -0.87 -2.51 -1.256 0.42558E+04 96 jadeite 4.59 0.39 -4.20 -0.420 0.71145E+04 99 kaolinite -0.70 -2.16 -1.47 -0.133 0.24844E+04 100 kyanite 5.57 0.81 -4.75 -0.475 0.80545E+04 107 magnesite 0.91 -2.37 -3.28 -1.092 0.55490E+04 117 microcline -2.01 -4.06 -2.06 -0.158 0.34863E+04 121 muscovite 3.63 -0.30 -3.93 -0.231 0.66670E+04 122 paragonite 5.32 1.19 -4.12 -0.243 0.69856E+04 143 pyrite -21.16 -22.09 -0.93 -0.220 0.15806E+04 145 pyrrhotiteFe0.875 -5.88 -9.81 -3.93 -1.446 0.66600E+04 147 pyrophyllite -5.44 -8.07 -2.63 -0.164 0.44530E+04 153 rhodochrosite -0.80 -3.16 -2.36 -0.786 0.39942E+04 155 sanidine -0.79 -4.06 -3.28 -0.252 0.55521E+04 157 siderite -2.40 -4.40 -1.99 -0.664 0.33738E+04 165 stilbite -6.55 -11.25 -4.70 -0.224 0.79634E+04 171 sulfur -9.08 -12.69 -3.61 -1.110 0.61096E+04 172 sylvite 1.40 -2.37 -3.76 -1.882 0.63790E+04 180 topaz-H 5.22 0.80 -4.42 -0.402 0.74889E+04 181 tridymite -2.56 -2.96 -0.40 -0.134 0.67899E+03 198 arsenic -7.30 -11.72 -4.42 -1.141 0.74880E+04 201 beidellite-Ca -0.76 -5.52 -4.77 -0.295 0.80750E+04 203 beidellite-K -0.66 -5.51 -4.85 -0.297 0.82129E+04 204 beidellite-Mg -0.93 -5.70 -4.77 -0.295 0.80810E+04 205 beidellite-Na -0.48 -5.01 -4.54 -0.278 0.76854E+04 208 chalcedony -2.77 -2.96 -0.19 -0.063 0.31948E+03 209 chalcocite -27.95 -29.20 -1.24 -0.311 0.21091E+04 211 covellite -19.94 -20.94 -1.00 -0.380 0.16915E+04 212 dawsonite 2.04 -0.73 -2.76 -0.345 0.46816E+04 214 montmorillonite-Ca -1.55 -6.21 -4.66 -0.288 0.78971E+04 215 montmorillonite-K -1.52 -6.19 -4.67 -0.286 0.79155E+04 216 montmorillonite-Mg -1.73 -6.39 -4.66 -0.288 0.78958E+04 217 montmorillonite-Na -1.30 -5.70 -4.40 -0.269 0.74557E+04 230 gypsum -4.67 -8.96 -4.29 -1.072 0.72650E+04 246 acanthite -28.30 -28.39 -0.09 -0.021 0.14494E+03 252 barite -9.17 -11.66 -2.49 -1.244 0.42141E+04 253 boehmite 4.73 1.88 -2.85 -0.475 0.48310E+04 254 cerussite -2.69 -7.02 -4.33 -1.444 0.73391E+04 255 chalcopyrite -28.48 -30.34 -1.87 -0.347 0.31635E+04 260 fluorite -9.61 -10.81 -1.20 -0.400 0.20306E+04 270 silica-amorphous -2.01 -2.96 -0.95 -0.316 0.16059E+04 271 smithsonite -0.52 -5.20 -4.67 -1.558 0.79183E+04 274 wurtzite -8.35 -10.20 -1.85 -0.616 0.31333E+04 276 an20ab80 2.64 -1.33 -3.97 -0.306 0.67329E+04 277 an25ab75 3.29 -1.03 -4.32 -0.332 0.73190E+04 278 an30ab70 3.95 -0.72 -4.67 -0.359 0.79151E+04 Calculations done for 97.1206 Deg. C; 500.0000 bar Mixer fraction: 1.5000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 97.121 .69623E+00 1.916 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1403E+03 New heat: 1.867 New temperature: 94.391 New mixer fraction: 1.6000000 Resulting temperature: 94.391Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 94.39 C Pressure = 500.00 bar Mixer fraction = 1.6000000 Water: Moles liquid = 0.1445E+03 kg liquid = 0.2602E+01 Moles total = 0.1441E+03 kg total = 0.2597E+01 Activity = 0.9803 Stoichiometric ionic strength = .6694153E+00 Osmotic coef. = 0.9288 True ionic strength = .5706518E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21176E-04 -4.6742 0.13969E-04 -4.8548 0.65969E+00 -0.1807 2 H2O 0.98032E+00 -0.0086 0.98032E+00 -0.0086 3 Cl- 0.55887E+00 -0.2527 0.35843E+00 -0.4456 0.64136E+00 -0.1929 4 SO4-- 0.69435E-04 -4.1584 0.10862E-04 -4.9641 0.15643E+00 -0.8057 5 HCO3- 0.10248E-01 -1.9894 0.65926E-02 -2.1809 0.64333E+00 -0.1916 6 HS- 0.96522E-07 -7.0154 0.61915E-07 -7.2082 0.64146E+00 -0.1928 7 H4SiO4 0.10089E-02 -2.9962 0.10089E-02 -2.9962 0.10000E+01 0.0000 8 Al+++ 0.17713E-10 -10.7517 0.26148E-12 -12.5826 0.14762E-01 -1.8309 9 Ca++ 0.70510E-03 -3.1517 0.10541E-03 -3.9771 0.14949E+00 -0.8254 10 Mg++ 0.58091E-04 -4.2359 0.85566E-05 -5.0677 0.14730E+00 -0.8318 11 Fe++ 0.54322E-06 -6.2650 0.80254E-07 -7.0955 0.14774E+00 -0.8305 12 K+ 0.17411E-01 -1.7592 0.11168E-01 -1.9520 0.64140E+00 -0.1929 13 Na+ 0.55069E+00 -0.2591 0.35110E+00 -0.4546 0.63756E+00 -0.1955 14 Mn++ 0.96067E-05 -5.0174 0.14228E-05 -5.8468 0.14811E+00 -0.8294 15 Zn++ 0.90373E-07 -7.0440 0.13352E-07 -7.8745 0.14774E+00 -0.8305 16 Cu+ 0.46388E-13 -13.3336 0.29572E-13 -13.5291 0.63750E+00 -0.1955 17 Pb++ 0.11789E-08 -8.9285 0.17839E-09 -9.7486 0.15132E+00 -0.8201 18 Ag+ 0.11570E-12 -12.9367 0.74104E-13 -13.1302 0.64048E+00 -0.1935 19 Au+ 0.36656E-24 -24.4358 0.23532E-24 -24.6283 0.64195E+00 -0.1925 20 Ba++ 0.13233E-05 -5.8783 0.20204E-06 -6.6946 0.15268E+00 -0.8162 21 F- 0.57553E-03 -3.2399 0.37156E-03 -3.4300 0.64560E+00 -0.1900 22 H2AsO3- 0.17132E-07 -7.7662 0.11883E-07 -7.9251 0.69358E+00 -0.1589 24 HSiO3- 0.15072E-06 -6.8218 0.96668E-07 -7.0147 0.64136E+00 -0.1929 25 Ca(HSiO3)+ 0.29686E-09 -9.5275 0.19057E-09 -9.7200 0.64195E+00 -0.1925 26 Mg(HSiO3)+ 0.30599E-10 -10.5143 0.19643E-10 -10.7068 0.64195E+00 -0.1925 27 NaHSiO3,aq 0.51143E-06 -6.2912 0.51143E-06 -6.2912 0.10000E+01 0.0000 31 AgCl,aq 0.18399E-10 -10.7352 0.18399E-10 -10.7352 0.10000E+01 0.0000 32 AgCl2- 0.44360E-09 -9.3530 0.28451E-09 -9.5459 0.64136E+00 -0.1929 33 AgCl3-2 0.11067E-09 -9.9560 0.17166E-10 -10.7653 0.15511E+00 -0.8094 38 Ag(HS),aq 0.19544E-08 -8.7090 0.19544E-08 -8.7090 0.10000E+01 0.0000 40 AlO+ 0.11093E-09 -9.9550 0.71209E-10 -10.1475 0.64195E+00 -0.1925 41 AlOH+2 0.43281E-10 -10.3637 0.64310E-11 -11.1917 0.14859E+00 -0.8280 42 HAlO2,aq 0.87713E-09 -9.0569 0.87713E-09 -9.0569 0.10000E+01 0.0000 43 AlO2- 0.19697E-09 -9.7056 0.12685E-09 -9.8967 0.64403E+00 -0.1911 44 AsO2- 0.12196E-07 -7.9138 0.78218E-08 -8.1067 0.64136E+00 -0.1929 45 HAsO2,aq 0.20758E-04 -4.6828 0.20758E-04 -4.6828 0.10000E+01 0.0000 46 H3AsO3,aq 0.29028E-04 -4.5372 0.29028E-04 -4.5372 0.10000E+01 0.0000 62 BaCO3,aq 0.30160E-10 -10.5206 0.30160E-10 -10.5206 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.10107E-06 -6.9954 0.65171E-07 -7.1859 0.64483E+00 -0.1906 64 BaCl+ 0.13719E-06 -6.8627 0.88067E-07 -7.0552 0.64195E+00 -0.1925 65 BaF+ 0.21483E-09 -9.6679 0.13791E-09 -9.8604 0.64195E+00 -0.1925 66 CH4,aq 0.41918E-10 -10.3776 0.38435E-10 -10.4153 0.91691E+00 -0.0377 72 CO2,aq 0.12419E+00 -0.9059 0.11387E+00 -0.9436 0.91691E+00 -0.0377 73 CO3-2 0.44101E-06 -6.3556 0.68403E-07 -7.1649 0.15511E+00 -0.8094 74 CaCO3,aq 0.65930E-07 -7.1809 0.65930E-07 -7.1809 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.22797E-04 -4.6421 0.14635E-04 -4.8346 0.64195E+00 -0.1925 76 CaCl+ 0.76414E-04 -4.1168 0.49054E-04 -4.3093 0.64195E+00 -0.1925 77 CaCl2,aq 0.35713E-05 -5.4472 0.35713E-05 -5.4472 0.10000E+01 0.0000 78 CaF+ 0.71358E-06 -6.1466 0.45808E-06 -6.3391 0.64195E+00 -0.1925 79 CaOH+ 0.52215E-09 -9.2822 0.33520E-09 -9.4747 0.64195E+00 -0.1925 80 CaSO4,aq 0.29013E-06 -6.5374 0.29013E-06 -6.5374 0.10000E+01 0.0000 81 HCl,aq 0.11193E-05 -5.9511 0.11193E-05 -5.9511 0.10000E+01 0.0000 90 CuCl,aq 0.61666E-10 -10.2100 0.61666E-10 -10.2100 0.10000E+01 0.0000 91 CuCl2- 0.56380E-09 -9.2489 0.36160E-09 -9.4418 0.64136E+00 -0.1929 92 CuCl3-2 0.52680E-10 -10.2784 0.81710E-11 -11.0877 0.15511E+00 -0.8094 98 HF,aq 0.24333E-04 -4.6138 0.24333E-04 -4.6138 0.10000E+01 0.0000 99 HF2- 0.40322E-08 -8.3945 0.25861E-08 -8.5874 0.64136E+00 -0.1929 101 FeCl+ 0.57711E-07 -7.2387 0.37048E-07 -7.4312 0.64195E+00 -0.1925 104 FeF+ 0.19544E-08 -8.7090 0.12547E-08 -8.9015 0.64195E+00 -0.1925 107 FeOH+ 0.26317E-09 -9.5798 0.16895E-09 -9.7723 0.64195E+00 -0.1925 113 H2,aq 0.12107E-08 -8.9170 0.11101E-08 -8.9546 0.91691E+00 -0.0377 114 KCl,aq 0.52881E-04 -4.2767 0.52881E-04 -4.2767 0.10000E+01 0.0000 116 KOH,aq 0.31103E-09 -9.5072 0.31103E-09 -9.5072 0.10000E+01 0.0000 117 KSO4- 0.26187E-05 -5.5819 0.16795E-05 -5.7748 0.64136E+00 -0.1929 118 MgCO3,aq 0.13471E-08 -8.8706 0.13471E-08 -8.8706 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.18772E-05 -5.7265 0.12051E-05 -5.9190 0.64195E+00 -0.1925 120 MgCl+ 0.58187E-05 -5.2352 0.37353E-05 -5.4277 0.64195E+00 -0.1925 121 MgF+ 0.21654E-06 -6.6645 0.13901E-06 -6.8570 0.64195E+00 -0.1925 122 MgOH+ 0.24466E-09 -9.6114 0.15706E-09 -9.8039 0.64195E+00 -0.1925 124 MnF+ 0.11183E-07 -7.9514 0.71789E-08 -8.1439 0.64195E+00 -0.1925 126 MnOH+ 0.42172E-09 -9.3750 0.27072E-09 -9.5675 0.64195E+00 -0.1925 131 MnCl+ 0.36264E-05 -5.4405 0.23280E-05 -5.6330 0.64195E+00 -0.1925 132 MnSO4,aq 0.35679E-08 -8.4476 0.35679E-08 -8.4476 0.10000E+01 0.0000 133 NaCl,aq 0.34823E-01 -1.4581 0.34823E-01 -1.4581 0.10000E+01 0.0000 134 NaF,aq 0.24762E-04 -4.6062 0.24762E-04 -4.6062 0.10000E+01 0.0000 135 NaOH,aq 0.10397E-07 -7.9831 0.10397E-07 -7.9831 0.10000E+01 0.0000 137 OH- 0.71195E-07 -7.1476 0.45852E-07 -7.3386 0.64403E+00 -0.1911 140 PbCl+ 0.51149E-08 -8.2912 0.32836E-08 -8.4837 0.64195E+00 -0.1925 141 PbCl2,aq 0.60577E-08 -8.2177 0.60577E-08 -8.2177 0.10000E+01 0.0000 142 PbCl3- 0.15197E-08 -8.8182 0.97467E-09 -9.0111 0.64136E+00 -0.1929 143 PbCl4-2 0.61500E-09 -9.2111 0.95391E-10 -10.0205 0.15511E+00 -0.8094 144 PbF+ 0.12843E-10 -10.8913 0.82444E-11 -11.0838 0.64195E+00 -0.1925 150 H2S,aq 0.23297E-05 -5.6327 0.21361E-05 -5.6704 0.91691E+00 -0.0377 159 HSO4- 0.13833E-06 -6.8591 0.89446E-07 -7.0484 0.64661E+00 -0.1894 173 ZnCl+ 0.46281E-06 -6.3346 0.29710E-06 -6.5271 0.64195E+00 -0.1925 174 ZnCl2,aq 0.60018E-07 -7.2217 0.60018E-07 -7.2217 0.10000E+01 0.0000 175 ZnCl3- 0.53249E-08 -8.2737 0.34152E-08 -8.4666 0.64136E+00 -0.1929 176 ZnF+ 0.19816E-09 -9.7030 0.12721E-09 -9.8955 0.64195E+00 -0.1925 178 ZnOH+ 0.60672E-08 -8.2170 0.38949E-08 -8.4095 0.64195E+00 -0.1925 Charge balance for all species = -.4981E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2117578E-04 0.1242882E+00 0.1202897E+03 0.0000 2 H2O 0.1000000E+01 0.5538404E+02 0.9580537E+06 0.0000 3 Cl- 0.5588660E+00 0.5938365E+00 0.2021546E+05 4.4092 4 SO4-- 0.6943463E-04 0.7248503E-04 0.6685931E+01 4.7455 5 HCO3- 0.1024770E-01 0.1344636E+00 0.7878085E+04 2.6739 6 HS- 0.9652194E-07 0.2428545E-05 0.7712059E-01 -2.3534 7 H4SiO4 0.1008854E-02 0.1009516E-02 0.9316868E+02 -2.9962 8 Al+++ 0.1771272E-10 0.1246016E-08 0.3228149E-04 1.9819 9 Ca++ 0.7051020E-03 0.8089546E-03 0.3113106E+02 5.7325 10 Mg++ 0.5809128E-04 0.6600539E-04 0.1540862E+01 4.6419 11 Fe++ 0.5432167E-06 0.6031458E-06 0.3234342E-01 2.6141 12 K+ 0.1741150E-01 0.1746700E-01 0.6558145E+03 2.9028 13 Na+ 0.5506878E+00 0.5855358E+00 0.1292565E+05 4.4002 14 Mn++ 0.9606650E-05 0.1324820E-04 0.6988654E+00 3.8628 15 Zn++ 0.9037341E-07 0.6247930E-06 0.3921737E-01 1.8352 16 Cu+ 0.4638781E-13 0.6781899E-09 0.4137731E-04 -8.6743 17 Pb++ 0.1178911E-08 0.1450386E-07 0.2885467E-02 -0.0390 18 Ag+ 0.1157021E-12 0.2530996E-08 0.2621536E-03 -8.2753 19 Au+ 0.3665643E-24 0.6041927E-12 0.1142701E-06 -19.7735 20 Ba++ 0.1323290E-05 0.1561789E-05 0.2059601E+00 3.0151 21 F- 0.5755282E-03 0.6255748E-03 0.1141171E+02 1.4248 22 H2AsO3- 0.1713239E-07 0.4981555E-04 0.5976064E+01 -3.0703 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234476E+00 -.1248466E-04 0.0000000E+00 2 H2O 0.1441311E+03 0.1441314E+03 -.3667657E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886351E-03 0.4209469E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6320045E-05 0.7710265E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2627165E-02 0.1845764E-03 0.0000000E+00 8 Al+++ 0.2407279E-05 0.3242633E-08 0.2404036E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569627E-05 0.3367844E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.1625961E-05 0.5842215E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1764921E-08 0.1683922E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.3774484E-07 0.1527276E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.6586664E-08 0.4205414E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.1572351E-11 0.1538610E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627996E-02 0.2404036E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.8470E-21 Mass of aqueous solution: 0.271026E+04 g Temperature = 94.39 C Pressure = 500.00 bar Mixer frac. = 1.6000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.1834E-03 -3.737 0.1102E-01 -1.958 89.99 0.4161E-02 argentite 0.2103E-06 -6.677 0.5210E-04 -4.283 0.4256 0.7317E-05 bornite 0.3368E-07 -7.473 0.1690E-04 -4.772 0.1380 0.3325E-05 topaz 0.1202E-05 -5.920 0.2212E-03 -3.655 1.807 0.6193E-04 galena 0.1527E-05 -5.816 0.3654E-03 -3.437 2.985 0.4809E-04 gold,native 0.1539E-11 -11.813 0.3031E-09 -9.518 0.2476E-05 0.1572E-10 silver,native 0.1151E-11 -11.939 0.1242E-09 -9.906 0.1014E-05 0.1182E-10 sphalerite 0.5842E-05 -5.233 0.5692E-03 -3.245 4.650 0.1392E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5720E+00 0.2420E+00 0.4231 -0.616 silver,native 0.4280E+00 0.6433E-01 0.1503 -1.192 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.6000000 Solid products produced: Mass = 0.012242 g Volume = 0.004420 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 94.3913 deg.C Sat. pressure: 24.3966 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4995E-01 0.8696 0.1060E+01 0.1219E+01 CO2,gas 0.9500E+00 0.9296 0.2155E+02 0.2318E+02 CH4,gas 0.4431E-08 1.0193 0.1102E-06 0.1081E-06 H2,gas 0.9028E-07 1.0133 0.2232E-05 0.2203E-05 H2S,gas 0.4312E-05 0.9075 0.9548E-04 0.1052E-03 S2,gas 0.1223E-17 1.0000 0.2984E-16 0.2984E-16 CO,gas 0.4091E-09 1.0000 0.9981E-08 0.9981E-08 SO3,gas 0.9161E-32 1.0000 0.2235E-30 0.2235E-30 O2,gas 0.8185E-54 1.0000 0.1997E-52 0.1997E-52 SO2,gas 0.1526E-14 1.0000 0.3722E-13 0.3722E-13 HF,gas 0.2414E-08 1.0000 0.5889E-07 0.5889E-07 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -2.98 -2.98 0.00 0.000 0.00000E+00 197 argentite -28.61 -28.61 0.00 0.000 0.00000E+00 206 bornite -89.33 -89.33 0.00 0.000 0.23900E-10 226 topaz -15.60 -15.60 0.00 0.000 0.00000E+00 261 galena -12.10 -12.10 0.00 0.000 -0.59750E-11 262 gold,native -18.84 -18.84 0.00 0.000 0.00000E+00 263 silver,native -6.76 -6.76 0.00 0.000 -0.14937E-11 273 sphalerite -10.23 -10.23 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 2.67 -0.01 -2.67 -2.674 0.44967E+04 0.025 2 CO2,gas -5.66 -7.03 -1.37 -0.455 0.22967E+04 1.333 3 CH4,gas 5.22 -4.43 -9.66 -2.414 0.16241E+05 -6.958 4 H2,gas 8.99 0.64 -8.35 -4.772 0.14044E+05 -5.651 5 H2S,gas -5.34 -12.06 -6.72 -3.360 0.11300E+05 -4.020 6 S2,gas -6.19 -25.41 -19.22 -2.958 0.32331E+05 -16.525 7 CO,gas 4.33 -6.37 -10.70 -3.292 0.17995E+05 -8.001 8 SO3,gas 18.68 -14.67 -33.35 -8.337 0.56088E+05 -30.651 9 O2,gas 54.09 -1.31 -55.40 -36.932 0.93170E+05 -52.700 10 SO2,gas 2.12 -14.01 -16.13 -4.301 0.27125E+05 -13.429 11 HF,gas 1.64 -8.28 -9.93 -4.964 0.16699E+05 -7.230 12 HCl,gas 3.56 -5.30 -8.86 -4.432 0.14908E+05 -8.864 17 albite-high 1.32 -2.57 -3.89 -0.300 0.65501E+04 18 albite 0.21 -2.57 -2.79 -0.214 0.46847E+04 22 analcite 3.92 0.40 -3.52 -0.391 0.59179E+04 26 anhydrite -4.91 -8.94 -4.03 -2.016 0.67796E+04 27 ankerite -1.65 -5.72 -4.08 -0.680 0.68606E+04 34 aragonite 1.21 -1.30 -2.51 -0.838 0.42258E+04 36 calcite 1.07 -1.30 -2.37 -0.792 0.39942E+04 53 coesite -2.37 -2.98 -0.61 -0.203 0.10240E+04 60 cristobalite -2.51 -2.98 -0.47 -0.157 0.79283E+03 65 diaspore 3.28 1.96 -1.31 -0.219 0.22099E+04 66 diamond -3.22 -5.72 -2.50 -0.714 0.42054E+04 69 dolomite,ordered 1.06 -3.70 -4.75 -0.792 0.79958E+04 83 gibbsite 4.45 1.96 -2.49 -0.356 0.41959E+04 86 goethite 6.67 2.27 -4.39 -0.950 0.73915E+04 87 graphite -3.66 -5.72 -2.06 -0.590 0.34729E+04 90 halite 1.64 -0.90 -2.54 -1.272 0.42769E+04 96 jadeite 4.69 0.41 -4.28 -0.428 0.72018E+04 99 kaolinite -0.54 -2.04 -1.49 -0.136 0.25139E+04 100 kyanite 5.80 0.96 -4.84 -0.484 0.81368E+04 107 magnesite 0.96 -2.39 -3.36 -1.118 0.56431E+04 117 microcline -1.95 -4.07 -2.12 -0.163 0.35601E+04 121 muscovite 3.90 -0.14 -4.04 -0.238 0.67960E+04 122 paragonite 5.61 1.36 -4.25 -0.250 0.71439E+04 143 pyrite -21.24 -22.16 -0.91 -0.215 0.15335E+04 145 pyrrhotiteFe0.875 -5.87 -9.86 -3.98 -1.464 0.66947E+04 147 pyrophyllite -5.31 -7.99 -2.68 -0.167 0.45053E+04 153 rhodochrosite -0.77 -3.17 -2.40 -0.801 0.40422E+04 155 sanidine -0.72 -4.07 -3.35 -0.257 0.56257E+04 157 siderite -2.37 -4.42 -2.05 -0.683 0.34436E+04 165 stilbite -6.47 -11.25 -4.78 -0.228 0.80369E+04 171 sulfur -9.12 -12.71 -3.59 -1.105 0.60397E+04 172 sylvite 1.39 -2.40 -3.79 -1.893 0.63676E+04 180 topaz-H 5.43 0.95 -4.48 -0.407 0.75316E+04 181 tridymite -2.57 -2.98 -0.41 -0.135 0.68164E+03 198 arsenic -7.36 -11.79 -4.43 -1.142 0.74431E+04 201 beidellite-Ca -0.55 -5.41 -4.85 -0.300 0.81646E+04 203 beidellite-K -0.47 -5.40 -4.93 -0.302 0.82895E+04 204 beidellite-Mg -0.73 -5.59 -4.86 -0.301 0.81750E+04 205 beidellite-Na -0.28 -4.90 -4.62 -0.283 0.77721E+04 208 chalcedony -2.79 -2.98 -0.19 -0.063 0.31963E+03 209 chalcocite -28.17 -29.41 -1.25 -0.312 0.20957E+04 211 covellite -20.08 -21.06 -0.98 -0.373 0.16449E+04 212 dawsonite 2.11 -0.67 -2.79 -0.348 0.46839E+04 214 montmorillonite-Ca -1.40 -6.16 -4.76 -0.295 0.80069E+04 215 montmorillonite-K -1.39 -6.15 -4.77 -0.292 0.80139E+04 216 montmorillonite-Mg -1.58 -6.34 -4.76 -0.295 0.80094E+04 217 montmorillonite-Na -1.16 -5.66 -4.50 -0.275 0.75622E+04 230 gypsum -4.65 -8.96 -4.31 -1.078 0.72534E+04 246 acanthite -28.53 -28.61 -0.08 -0.021 0.13836E+03 252 barite -9.17 -11.66 -2.49 -1.244 0.41857E+04 253 boehmite 4.86 1.96 -2.89 -0.482 0.48651E+04 254 cerussite -2.70 -7.07 -4.38 -1.460 0.73647E+04 255 chalcopyrite -28.62 -30.51 -1.88 -0.350 0.31682E+04 260 fluorite -9.60 -10.84 -1.23 -0.411 0.20735E+04 270 silica-amorphous -2.02 -2.98 -0.96 -0.319 0.16118E+04 271 smithsonite -0.48 -5.20 -4.72 -1.572 0.79330E+04 274 wurtzite -8.36 -10.23 -1.86 -0.621 0.31334E+04 276 an20ab80 2.77 -1.32 -4.08 -0.314 0.68673E+04 277 an25ab75 3.43 -1.00 -4.44 -0.341 0.74595E+04 278 an30ab70 4.10 -0.69 -4.79 -0.369 0.80618E+04 Calculations done for 94.3913 Deg. C; 500.0000 bar Mixer fraction: 1.6000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 94.391 .66942E+00 1.867 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1459E+03 New heat: 1.823 New temperature: 91.861 New mixer fraction: 1.7000000 Resulting temperature: 91.861Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 91.86 C Pressure = 500.00 bar Mixer fraction = 1.7000000 Water: Moles liquid = 0.1500E+03 kg liquid = 0.2702E+01 Moles total = 0.1497E+03 kg total = 0.2697E+01 Activity = 0.9810 Stoichiometric ionic strength = .6445904E+00 Osmotic coef. = 0.9285 True ionic strength = .5511349E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21464E-04 -4.6683 0.14248E-04 -4.8462 0.66383E+00 -0.1779 2 H2O 0.98105E+00 -0.0083 0.98105E+00 -0.0083 3 Cl- 0.53978E+00 -0.2678 0.34777E+00 -0.4587 0.64428E+00 -0.1909 4 SO4-- 0.66966E-04 -4.1741 0.10786E-04 -4.9672 0.16106E+00 -0.7930 5 HCO3- 0.98700E-02 -2.0057 0.63761E-02 -2.1954 0.64601E+00 -0.1898 6 HS- 0.88489E-07 -7.0531 0.57018E-07 -7.2440 0.64435E+00 -0.1909 7 H4SiO4 0.96377E-03 -3.0160 0.96377E-03 -3.0160 0.10000E+01 0.0000 8 Al+++ 0.21074E-10 -10.6763 0.33341E-12 -12.4770 0.15821E-01 -1.8008 9 Ca++ 0.68330E-03 -3.1654 0.10533E-03 -3.9775 0.15414E+00 -0.8121 10 Mg++ 0.56197E-04 -4.2503 0.85440E-05 -5.0683 0.15204E+00 -0.8181 11 Fe++ 0.52515E-06 -6.2797 0.80060E-07 -7.0966 0.15245E+00 -0.8169 12 K+ 0.16771E-01 -1.7754 0.10801E-01 -1.9665 0.64402E+00 -0.1911 13 Na+ 0.53189E+00 -0.2742 0.34067E+00 -0.4677 0.64048E+00 -0.1935 14 Mn++ 0.94433E-05 -5.0249 0.14430E-05 -5.8407 0.15281E+00 -0.8159 15 Zn++ 0.91642E-07 -7.0379 0.13971E-07 -7.8548 0.15245E+00 -0.8169 16 Cu+ 0.38408E-13 -13.4156 0.24597E-13 -13.6091 0.64042E+00 -0.1935 17 Pb++ 0.10801E-08 -8.9666 0.16841E-09 -9.7736 0.15593E+00 -0.8071 18 Ag+ 0.94842E-13 -13.0230 0.60998E-13 -13.2147 0.64315E+00 -0.1917 19 Au+ 0.25977E-24 -24.5854 0.16743E-24 -24.7762 0.64455E+00 -0.1907 20 Ba++ 0.12879E-05 -5.8901 0.20254E-06 -6.6935 0.15726E+00 -0.8034 21 F- 0.55607E-03 -3.2549 0.36089E-03 -3.4426 0.64900E+00 -0.1878 22 H2AsO3- 0.14987E-07 -7.8243 0.10411E-07 -7.9825 0.69471E+00 -0.1582 24 HSiO3- 0.13549E-06 -6.8681 0.87291E-07 -7.0590 0.64428E+00 -0.1909 25 Ca(HSiO3)+ 0.25699E-09 -9.5901 0.16564E-09 -9.7808 0.64455E+00 -0.1907 26 Mg(HSiO3)+ 0.26772E-10 -10.5723 0.17256E-10 -10.7631 0.64455E+00 -0.1907 27 NaHSiO3,aq 0.46272E-06 -6.3347 0.46272E-06 -6.3347 0.10000E+01 0.0000 31 AgCl,aq 0.14972E-10 -10.8247 0.14972E-10 -10.8247 0.10000E+01 0.0000 32 AgCl2- 0.35239E-09 -9.4530 0.22704E-09 -9.6439 0.64428E+00 -0.1909 33 AgCl3-2 0.85280E-10 -10.0692 0.13625E-10 -10.8657 0.15976E+00 -0.7965 38 Ag(HS),aq 0.18373E-08 -8.7358 0.18373E-08 -8.7358 0.10000E+01 0.0000 40 AlO+ 0.10862E-09 -9.9641 0.70008E-10 -10.1549 0.64455E+00 -0.1907 41 AlOH+2 0.46266E-10 -10.3347 0.70908E-11 -11.1493 0.15326E+00 -0.8146 42 HAlO2,aq 0.77439E-09 -9.1110 0.77439E-09 -9.1110 0.10000E+01 0.0000 43 AlO2- 0.15819E-09 -9.8008 0.10240E-09 -9.9897 0.64736E+00 -0.1889 44 AsO2- 0.11092E-07 -7.9550 0.71461E-08 -8.1459 0.64428E+00 -0.1909 45 HAsO2,aq 0.20205E-04 -4.6945 0.20205E-04 -4.6945 0.10000E+01 0.0000 46 H3AsO3,aq 0.27741E-04 -4.5569 0.27741E-04 -4.5569 0.10000E+01 0.0000 62 BaCO3,aq 0.26966E-10 -10.5692 0.26966E-10 -10.5692 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.90256E-07 -7.0445 0.58422E-07 -7.2334 0.64729E+00 -0.1889 64 BaCl+ 0.12557E-06 -6.9011 0.80935E-07 -7.0919 0.64455E+00 -0.1907 65 BaF+ 0.19875E-09 -9.7017 0.12811E-09 -9.8924 0.64455E+00 -0.1907 66 CH4,aq 0.37816E-10 -10.4223 0.34732E-10 -10.4593 0.91844E+00 -0.0370 72 CO2,aq 0.11959E+00 -0.9223 0.10984E+00 -0.9592 0.91844E+00 -0.0370 73 CO3-2 0.40642E-06 -6.3910 0.64931E-07 -7.1876 0.15976E+00 -0.7965 74 CaCO3,aq 0.58896E-07 -7.2299 0.58896E-07 -7.2299 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.21068E-04 -4.6764 0.13579E-04 -4.8671 0.64455E+00 -0.1907 76 CaCl+ 0.70433E-04 -4.1522 0.45397E-04 -4.3430 0.64455E+00 -0.1907 77 CaCl2,aq 0.32282E-05 -5.4910 0.32282E-05 -5.4910 0.10000E+01 0.0000 78 CaF+ 0.65829E-06 -6.1816 0.42430E-06 -6.3723 0.64455E+00 -0.1907 79 CaOH+ 0.42982E-09 -9.3667 0.27704E-09 -9.5575 0.64455E+00 -0.1907 80 CaSO4,aq 0.27796E-06 -6.5560 0.27796E-06 -6.5560 0.10000E+01 0.0000 81 HCl,aq 0.10966E-05 -5.9600 0.10966E-05 -5.9600 0.10000E+01 0.0000 90 CuCl,aq 0.50589E-10 -10.2959 0.50589E-10 -10.2959 0.10000E+01 0.0000 91 CuCl2- 0.44716E-09 -9.3495 0.28810E-09 -9.5405 0.64428E+00 -0.1909 92 CuCl3-2 0.40517E-10 -10.3924 0.64731E-11 -11.1889 0.15976E+00 -0.7965 98 HF,aq 0.22819E-04 -4.6417 0.22819E-04 -4.6417 0.10000E+01 0.0000 99 HF2- 0.36390E-08 -8.4390 0.23446E-08 -8.6299 0.64428E+00 -0.1909 101 FeCl+ 0.53596E-07 -7.2709 0.34545E-07 -7.4616 0.64455E+00 -0.1907 104 FeF+ 0.18286E-08 -8.7379 0.11786E-08 -8.9286 0.64455E+00 -0.1907 107 FeOH+ 0.22866E-09 -9.6408 0.14738E-09 -9.8316 0.64455E+00 -0.1907 113 H2,aq 0.10270E-08 -8.9884 0.94325E-09 -9.0254 0.91844E+00 -0.0370 114 KCl,aq 0.46881E-04 -4.3290 0.46881E-04 -4.3290 0.10000E+01 0.0000 116 KOH,aq 0.26170E-09 -9.5822 0.26170E-09 -9.5822 0.10000E+01 0.0000 117 KSO4- 0.24269E-05 -5.6150 0.15636E-05 -5.8059 0.64428E+00 -0.1909 118 MgCO3,aq 0.12242E-08 -8.9122 0.12242E-08 -8.9122 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.17337E-05 -5.7610 0.11174E-05 -5.9518 0.64455E+00 -0.1907 120 MgCl+ 0.54300E-05 -5.2652 0.34999E-05 -5.4559 0.64455E+00 -0.1907 121 MgF+ 0.20086E-06 -6.6971 0.12946E-06 -6.8878 0.64455E+00 -0.1907 122 MgOH+ 0.20560E-09 -9.6870 0.13252E-09 -9.8777 0.64455E+00 -0.1907 124 MnF+ 0.10580E-07 -7.9755 0.68192E-08 -8.1663 0.64455E+00 -0.1907 126 MnOH+ 0.36690E-09 -9.4354 0.23649E-09 -9.6262 0.64455E+00 -0.1907 131 MnCl+ 0.33003E-05 -5.4815 0.21272E-05 -5.6722 0.64455E+00 -0.1907 132 MnSO4,aq 0.34384E-08 -8.4636 0.34384E-08 -8.4636 0.10000E+01 0.0000 133 NaCl,aq 0.31951E-01 -1.4955 0.31951E-01 -1.4955 0.10000E+01 0.0000 134 NaF,aq 0.22654E-04 -4.6449 0.22654E-04 -4.6449 0.10000E+01 0.0000 135 NaOH,aq 0.88962E-08 -8.0508 0.88962E-08 -8.0508 0.10000E+01 0.0000 137 OH- 0.63028E-07 -7.2005 0.40802E-07 -7.3893 0.64736E+00 -0.1889 140 PbCl+ 0.45059E-08 -8.3462 0.29043E-08 -8.5370 0.64455E+00 -0.1907 141 PbCl2,aq 0.50812E-08 -8.2940 0.50812E-08 -8.2940 0.10000E+01 0.0000 142 PbCl3- 0.12203E-08 -8.9135 0.78623E-09 -9.1044 0.64428E+00 -0.1909 143 PbCl4-2 0.47209E-09 -9.3260 0.75422E-10 -10.1225 0.15976E+00 -0.7965 144 PbF+ 0.11511E-10 -10.9389 0.74191E-11 -11.1296 0.64455E+00 -0.1907 150 H2S,aq 0.22112E-05 -5.6554 0.20308E-05 -5.6923 0.91844E+00 -0.0370 159 HSO4- 0.12839E-06 -6.8915 0.83337E-07 -7.0792 0.64909E+00 -0.1877 173 ZnCl+ 0.41256E-06 -6.3845 0.26591E-06 -6.5753 0.64455E+00 -0.1907 174 ZnCl2,aq 0.52319E-07 -7.2813 0.52319E-07 -7.2813 0.10000E+01 0.0000 175 ZnCl3- 0.45751E-08 -8.3396 0.29477E-08 -8.5305 0.64428E+00 -0.1909 176 ZnF+ 0.19381E-09 -9.7126 0.12492E-09 -9.9034 0.64455E+00 -0.1907 178 ZnOH+ 0.52554E-08 -8.2794 0.33873E-08 -8.4701 0.64455E+00 -0.1907 Charge balance for all species = -.4796E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2146362E-04 0.1196890E+00 0.1160094E+03 0.0000 2 H2O 0.1000000E+01 0.5538863E+02 0.9595470E+06 0.0000 3 Cl- 0.5397770E+00 0.5718619E+00 0.1949612E+05 4.3875 4 SO4-- 0.6696639E-04 0.6980277E-04 0.6448023E+01 4.7253 5 HCO3- 0.9869952E-02 0.1294878E+00 0.7597756E+04 2.6508 6 HS- 0.8848874E-07 0.2301797E-05 0.7320346E-01 -2.3977 7 H4SiO4 0.9637685E-03 0.9643670E-03 0.8913318E+02 -3.0160 8 Al+++ 0.2107382E-10 0.1108536E-08 0.2876205E-04 2.0617 9 Ca++ 0.6832954E-03 0.7790197E-03 0.3002331E+02 5.7150 10 Mg++ 0.5619694E-04 0.6356290E-04 0.1486033E+01 4.6241 11 Fe++ 0.5251507E-06 0.5808038E-06 0.3119130E-01 2.5959 12 K+ 0.1677133E-01 0.1682064E-01 0.6324783E+03 2.8797 13 Na+ 0.5318947E+00 0.5638684E+00 0.1246571E+05 4.3786 14 Mn++ 0.9443308E-05 0.1275796E-04 0.6739974E+00 3.8517 15 Zn++ 0.9164231E-07 0.5665450E-06 0.3561369E-01 1.8377 16 Cu+ 0.3840759E-13 0.5383039E-09 0.3289114E-04 -8.7629 17 Pb++ 0.1080052E-08 0.1237525E-07 0.2465625E-02 -0.0812 18 Ag+ 0.9484157E-13 0.2292937E-08 0.2378466E-03 -8.3684 19 Au+ 0.2597673E-24 0.5333344E-12 0.1010176E-06 -19.9299 20 Ba++ 0.1287944E-05 0.1503996E-05 0.1986314E+00 2.9990 21 F- 0.5560736E-03 0.6024257E-03 0.1100565E+02 1.4036 22 H2AsO3- 0.1498656E-07 0.4797216E-04 0.5763416E+01 -3.1363 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234477E+00 -.1258476E-04 0.0000000E+00 2 H2O 0.1496819E+03 0.1496823E+03 -.4088824E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886350E-03 0.4217198E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6220378E-05 0.7809932E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2606106E-02 0.2056349E-03 0.0000000E+00 8 Al+++ 0.2407279E-05 0.2995708E-08 0.2404283E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569565E-05 0.3374048E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.1531032E-05 0.5937145E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1454713E-08 0.1687024E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.3344290E-07 0.1531578E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.6196435E-08 0.4209317E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.1441283E-11 0.1669677E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627996E-02 0.2404283E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.1694E-20 Mass of aqueous solution: 0.281025E+04 g Temperature = 91.86 C Pressure = 500.00 bar Mixer frac. = 1.7000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.2044E-03 -3.689 0.1228E-01 -1.911 90.86 0.4638E-02 argentite 0.2105E-06 -6.677 0.5215E-04 -4.283 0.3858 0.7324E-05 bornite 0.3374E-07 -7.472 0.1693E-04 -4.771 0.1253 0.3331E-05 topaz 0.1202E-05 -5.920 0.2212E-03 -3.655 1.637 0.6194E-04 galena 0.1532E-05 -5.815 0.3664E-03 -3.436 2.711 0.4823E-04 gold,native 0.1670E-11 -11.777 0.3289E-09 -9.483 0.2433E-05 0.1706E-10 silver,native 0.1229E-11 -11.910 0.1326E-09 -9.878 0.9808E-06 0.1263E-10 sphalerite 0.5937E-05 -5.226 0.5785E-03 -3.238 4.279 0.1415E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5760E+00 0.2464E+00 0.4277 -0.608 silver,native 0.4240E+00 0.6133E-01 0.1447 -1.212 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.7000000 Solid products produced: Mass = 0.013518 g Volume = 0.004901 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 91.8610 deg.C Sat. pressure: 22.9375 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4815E-01 0.8764 0.9680E+00 0.1105E+01 CO2,gas 0.9518E+00 0.9319 0.2035E+02 0.2183E+02 CH4,gas 0.4270E-08 1.0179 0.9970E-07 0.9795E-07 H2,gas 0.8261E-07 1.0126 0.1919E-05 0.1895E-05 H2S,gas 0.4260E-05 0.9112 0.8903E-04 0.9771E-04 S2,gas 0.1041E-17 1.0000 0.2388E-16 0.2388E-16 CO,gas 0.3526E-09 1.0000 0.8088E-08 0.8088E-08 SO3,gas 0.5712E-32 1.0000 0.1310E-30 0.1310E-30 O2,gas 0.3281E-54 1.0000 0.7525E-53 0.7525E-53 SO2,gas 0.1238E-14 1.0000 0.2840E-13 0.2840E-13 HF,gas 0.2172E-08 1.0000 0.4982E-07 0.4982E-07 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -3.00 -3.00 0.00 0.000 0.00000E+00 197 argentite -28.83 -28.83 0.00 0.000 0.00000E+00 206 bornite -89.90 -89.90 0.00 0.000 0.23735E-10 226 topaz -15.47 -15.47 0.00 0.000 0.59338E-11 261 galena -12.17 -12.17 0.00 0.000 0.00000E+00 262 gold,native -19.00 -19.00 0.00 0.000 -0.59338E-11 263 silver,native -6.84 -6.84 0.00 0.000 -0.14835E-11 273 sphalerite -10.25 -10.25 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 2.70 -0.01 -2.71 -2.713 0.45315E+04 -0.014 2 CO2,gas -5.64 -7.03 -1.39 -0.463 0.23224E+04 1.308 3 CH4,gas 5.22 -4.48 -9.70 -2.425 0.16202E+05 -7.001 4 H2,gas 9.05 0.63 -8.42 -4.809 0.14057E+05 -5.717 5 H2S,gas -5.34 -12.09 -6.75 -3.375 0.11273E+05 -4.050 6 S2,gas -6.13 -25.45 -19.32 -2.972 0.32270E+05 -16.622 7 CO,gas 4.40 -6.39 -10.79 -3.320 0.18024E+05 -8.092 8 SO3,gas 18.93 -14.65 -33.58 -8.395 0.56089E+05 -30.883 9 O2,gas 54.54 -1.28 -55.82 -37.215 0.93236E+05 -53.123 10 SO2,gas 2.24 -14.01 -16.25 -4.332 0.27134E+05 -13.547 11 HF,gas 1.71 -8.29 -10.00 -5.001 0.16705E+05 -7.303 12 HCl,gas 3.64 -5.30 -8.95 -4.475 0.14948E+05 -8.950 17 albite-high 1.41 -2.57 -3.99 -0.307 0.66588E+04 18 albite 0.29 -2.57 -2.86 -0.220 0.47831E+04 22 analcite 4.01 0.42 -3.60 -0.400 0.60103E+04 26 anhydrite -4.87 -8.94 -4.08 -2.038 0.68089E+04 27 ankerite -1.58 -5.77 -4.19 -0.698 0.69964E+04 34 aragonite 1.24 -1.33 -2.57 -0.857 0.42940E+04 36 calcite 1.11 -1.33 -2.43 -0.811 0.40642E+04 53 coesite -2.39 -3.00 -0.61 -0.204 0.10230E+04 60 cristobalite -2.52 -3.00 -0.48 -0.159 0.79706E+03 65 diaspore 3.38 2.05 -1.34 -0.223 0.22309E+04 66 diamond -3.26 -5.75 -2.49 -0.711 0.41589E+04 69 dolomite,ordered 1.14 -3.74 -4.88 -0.813 0.81518E+04 83 gibbsite 4.55 2.04 -2.52 -0.359 0.42016E+04 86 goethite 6.74 2.26 -4.48 -0.968 0.74784E+04 87 graphite -3.70 -5.75 -2.05 -0.587 0.34287E+04 90 halite 1.65 -0.93 -2.57 -1.286 0.42973E+04 96 jadeite 4.78 0.42 -4.36 -0.436 0.72810E+04 99 kaolinite -0.40 -1.92 -1.52 -0.138 0.25388E+04 100 kyanite 6.01 1.10 -4.92 -0.492 0.82105E+04 107 magnesite 1.01 -2.42 -3.43 -1.144 0.57302E+04 117 microcline -1.90 -4.07 -2.17 -0.167 0.36263E+04 121 muscovite 4.15 0.02 -4.14 -0.243 0.69107E+04 122 paragonite 5.88 1.52 -4.36 -0.257 0.72861E+04 143 pyrite -21.33 -22.22 -0.89 -0.210 0.14890E+04 145 pyrrhotiteFe0.875 -5.87 -9.90 -4.03 -1.481 0.67258E+04 147 pyrophyllite -5.18 -7.91 -2.72 -0.170 0.45511E+04 153 rhodochrosite -0.74 -3.19 -2.45 -0.816 0.40872E+04 155 sanidine -0.67 -4.07 -3.41 -0.262 0.56918E+04 157 siderite -2.35 -4.45 -2.10 -0.700 0.35079E+04 165 stilbite -6.40 -11.25 -4.85 -0.231 0.81014E+04 171 sulfur -9.15 -12.72 -3.58 -1.101 0.59757E+04 172 sylvite 1.38 -2.43 -3.81 -1.903 0.63577E+04 180 topaz-H 5.62 1.09 -4.53 -0.412 0.75685E+04 181 tridymite -2.59 -3.00 -0.41 -0.137 0.68406E+03 198 arsenic -7.42 -11.85 -4.43 -1.144 0.74013E+04 201 beidellite-Ca -0.36 -5.30 -4.94 -0.305 0.82442E+04 204 beidellite-Mg -0.54 -5.48 -4.94 -0.306 0.82587E+04 205 beidellite-Na -0.10 -4.80 -4.70 -0.288 0.78492E+04 208 chalcedony -2.81 -3.00 -0.19 -0.064 0.31976E+03 209 chalcocite -28.37 -29.62 -1.25 -0.312 0.20836E+04 211 covellite -20.21 -21.17 -0.96 -0.365 0.16022E+04 212 dawsonite 2.19 -0.62 -2.81 -0.351 0.46863E+04 214 montmorillonite-Ca -1.27 -6.12 -4.85 -0.300 0.81057E+04 215 montmorillonite-K -1.26 -6.11 -4.85 -0.297 0.81022E+04 216 montmorillonite-Mg -1.44 -6.30 -4.86 -0.300 0.81119E+04 217 montmorillonite-Na -1.03 -5.62 -4.59 -0.281 0.76581E+04 230 gypsum -4.62 -8.96 -4.34 -1.084 0.72434E+04 246 acanthite -28.75 -28.83 -0.08 -0.020 0.13234E+03 252 barite -9.17 -11.66 -2.49 -1.245 0.41600E+04 253 boehmite 4.98 2.05 -2.93 -0.488 0.48954E+04 254 cerussite -2.70 -7.12 -4.42 -1.475 0.73896E+04 255 chalcopyrite -28.77 -30.66 -1.90 -0.353 0.31717E+04 260 fluorite -9.60 -10.86 -1.27 -0.422 0.21144E+04 270 silica-amorphous -2.03 -3.00 -0.97 -0.323 0.16175E+04 271 smithsonite -0.45 -5.20 -4.76 -1.586 0.79478E+04 274 wurtzite -8.38 -10.25 -1.88 -0.625 0.31335E+04 276 an20ab80 2.89 -1.30 -4.18 -0.322 0.69896E+04 277 an25ab75 3.56 -0.98 -4.54 -0.349 0.75875E+04 278 an30ab70 4.25 -0.66 -4.91 -0.377 0.81952E+04 Calculations done for 91.8610 Deg. C; 500.0000 bar Mixer fraction: 1.7000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 91.861 .64459E+00 1.823 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1514E+03 New heat: 1.781 New temperature: 89.509 New mixer fraction: 1.8000000 Resulting temperature: 89.509Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 89.51 C Pressure = 500.00 bar Mixer fraction = 1.8000000 Water: Moles liquid = 0.1556E+03 kg liquid = 0.2802E+01 Moles total = 0.1552E+03 kg total = 0.2797E+01 Activity = 0.9817 Stoichiometric ionic strength = .6215409E+00 Osmotic coef. = 0.9282 True ionic strength = .5328702E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21702E-04 -4.6635 0.14490E-04 -4.8389 0.66767E+00 -0.1754 2 H2O 0.98172E+00 -0.0080 0.98172E+00 -0.0080 3 Cl- 0.52191E+00 -0.2824 0.33771E+00 -0.4715 0.64706E+00 -0.1891 4 SO4-- 0.64666E-04 -4.1893 0.10702E-04 -4.9705 0.16550E+00 -0.7812 5 HCO3- 0.95191E-02 -2.0214 0.61739E-02 -2.2094 0.64858E+00 -0.1880 6 HS- 0.81541E-07 -7.0886 0.52766E-07 -7.2776 0.64711E+00 -0.1890 7 H4SiO4 0.92284E-03 -3.0349 0.92284E-03 -3.0349 0.10000E+01 0.0000 8 Al+++ 0.24762E-10 -10.6062 0.41781E-12 -12.3790 0.16873E-01 -1.7728 9 Ca++ 0.66267E-03 -3.1787 0.10510E-03 -3.9784 0.15860E+00 -0.7997 10 Mg++ 0.54418E-04 -4.2643 0.85207E-05 -5.0695 0.15658E+00 -0.8053 11 Fe++ 0.50821E-06 -6.2940 0.79775E-07 -7.0981 0.15697E+00 -0.8042 12 K+ 0.16176E-01 -1.7911 0.10459E-01 -1.9805 0.64655E+00 -0.1894 13 Na+ 0.51430E+00 -0.2888 0.33083E+00 -0.4804 0.64327E+00 -0.1916 14 Mn++ 0.92753E-05 -5.0327 0.14591E-05 -5.8359 0.15731E+00 -0.8032 15 Zn++ 0.92628E-07 -7.0333 0.14540E-07 -7.8374 0.15697E+00 -0.8042 16 Cu+ 0.32090E-13 -13.4936 0.20641E-13 -13.6853 0.64322E+00 -0.1916 17 Pb++ 0.99157E-09 -9.0037 0.15900E-09 -9.7986 0.16035E+00 -0.7949 18 Ag+ 0.78498E-13 -13.1051 0.50689E-13 -13.2951 0.64573E+00 -0.1899 19 Au+ 0.18715E-24 -24.7278 0.12109E-24 -24.9169 0.64705E+00 -0.1891 20 Ba++ 0.12538E-05 -5.9018 0.20269E-06 -6.6932 0.16166E+00 -0.7914 21 F- 0.53787E-03 -3.2693 0.35079E-03 -3.4550 0.65218E+00 -0.1856 22 H2AsO3- 0.13220E-07 -7.8788 0.92001E-08 -8.0362 0.69590E+00 -0.1575 24 HSiO3- 0.12260E-06 -6.9115 0.79328E-07 -7.1006 0.64706E+00 -0.1891 25 Ca(HSiO3)+ 0.22439E-09 -9.6490 0.14519E-09 -9.8381 0.64705E+00 -0.1891 26 Mg(HSiO3)+ 0.23608E-10 -10.6269 0.15275E-10 -10.8160 0.64705E+00 -0.1891 27 NaHSiO3,aq 0.42119E-06 -6.3755 0.42119E-06 -6.3755 0.10000E+01 0.0000 31 AgCl,aq 0.12306E-10 -10.9099 0.12306E-10 -10.9099 0.10000E+01 0.0000 32 AgCl2- 0.28305E-09 -9.5481 0.18315E-09 -9.7372 0.64706E+00 -0.1891 33 AgCl3-2 0.66571E-10 -10.1767 0.10933E-10 -10.9613 0.16423E+00 -0.7846 38 Ag(HS),aq 0.17319E-08 -8.7615 0.17319E-08 -8.7615 0.10000E+01 0.0000 40 AlO+ 0.10642E-09 -9.9730 0.68860E-10 -10.1620 0.64705E+00 -0.1891 41 AlOH+2 0.49221E-10 -10.3078 0.77647E-11 -11.1099 0.15775E+00 -0.8020 42 HAlO2,aq 0.68884E-09 -9.1619 0.68884E-09 -9.1619 0.10000E+01 0.0000 43 AlO2- 0.12901E-09 -9.8894 0.83916E-10 -10.0762 0.65048E+00 -0.1868 44 AsO2- 0.10142E-07 -7.9939 0.65623E-08 -8.1829 0.64706E+00 -0.1891 45 HAsO2,aq 0.19676E-04 -4.7061 0.19676E-04 -4.7061 0.10000E+01 0.0000 46 H3AsO3,aq 0.26561E-04 -4.5758 0.26561E-04 -4.5758 0.10000E+01 0.0000 62 BaCO3,aq 0.24241E-10 -10.6155 0.24241E-10 -10.6155 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.81005E-07 -7.0915 0.52626E-07 -7.2788 0.64967E+00 -0.1873 64 BaCl+ 0.11533E-06 -6.9380 0.74626E-07 -7.1271 0.64705E+00 -0.1891 65 BaF+ 0.18438E-09 -9.7343 0.11930E-09 -9.9233 0.64705E+00 -0.1891 66 CH4,aq 0.34352E-10 -10.4640 0.31601E-10 -10.5003 0.91992E+00 -0.0362 72 CO2,aq 0.11533E+00 -0.9381 0.10609E+00 -0.9743 0.91992E+00 -0.0362 73 CO3-2 0.37633E-06 -6.4244 0.61804E-07 -7.2090 0.16423E+00 -0.7846 74 CaCO3,aq 0.52916E-07 -7.2764 0.52916E-07 -7.2764 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.19541E-04 -4.7091 0.12644E-04 -4.8981 0.64705E+00 -0.1891 76 CaCl+ 0.65145E-04 -4.1861 0.42152E-04 -4.3752 0.64705E+00 -0.1891 77 CaCl2,aq 0.29317E-05 -5.5329 0.29317E-05 -5.5329 0.10000E+01 0.0000 78 CaF+ 0.60939E-06 -6.2151 0.39431E-06 -6.4042 0.64705E+00 -0.1891 79 CaOH+ 0.35775E-09 -9.4464 0.23148E-09 -9.6355 0.64705E+00 -0.1891 80 CaSO4,aq 0.26650E-06 -6.5743 0.26650E-06 -6.5743 0.10000E+01 0.0000 81 HCl,aq 0.10741E-05 -5.9690 0.10741E-05 -5.9690 0.10000E+01 0.0000 90 CuCl,aq 0.41884E-10 -10.3780 0.41884E-10 -10.3780 0.10000E+01 0.0000 91 CuCl2- 0.35831E-09 -9.4457 0.23185E-09 -9.6348 0.64706E+00 -0.1891 92 CuCl3-2 0.31529E-10 -10.5013 0.51780E-11 -11.2858 0.16423E+00 -0.7846 98 HF,aq 0.21438E-04 -4.6688 0.21438E-04 -4.6688 0.10000E+01 0.0000 99 HF2- 0.32926E-08 -8.4825 0.21306E-08 -8.6715 0.64706E+00 -0.1891 101 FeCl+ 0.49931E-07 -7.3016 0.32308E-07 -7.4907 0.64705E+00 -0.1891 104 FeF+ 0.17152E-08 -8.7657 0.11098E-08 -8.9547 0.64705E+00 -0.1891 107 FeOH+ 0.20032E-09 -9.6983 0.12962E-09 -9.8873 0.64705E+00 -0.1891 113 H2,aq 0.88021E-09 -9.0554 0.80973E-09 -9.0917 0.91992E+00 -0.0362 114 KCl,aq 0.41797E-04 -4.3789 0.41797E-04 -4.3789 0.10000E+01 0.0000 116 KOH,aq 0.22238E-09 -9.6529 0.22238E-09 -9.6529 0.10000E+01 0.0000 117 KSO4- 0.22565E-05 -5.6466 0.14601E-05 -5.8356 0.64706E+00 -0.1891 118 MgCO3,aq 0.11177E-08 -8.9517 0.11177E-08 -8.9517 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.16069E-05 -5.7940 0.10398E-05 -5.9831 0.64705E+00 -0.1891 120 MgCl+ 0.50815E-05 -5.2940 0.32880E-05 -5.4831 0.64705E+00 -0.1891 121 MgF+ 0.18692E-06 -6.7283 0.12095E-06 -6.9174 0.64705E+00 -0.1891 122 MgOH+ 0.17457E-09 -9.7580 0.11296E-09 -9.9471 0.64705E+00 -0.1891 124 MnF+ 0.10021E-07 -7.9991 0.64838E-08 -8.1882 0.64705E+00 -0.1891 126 MnOH+ 0.32150E-09 -9.4928 0.20803E-09 -9.6819 0.64705E+00 -0.1891 131 MnCl+ 0.30137E-05 -5.5209 0.19500E-05 -5.7100 0.64705E+00 -0.1891 132 MnSO4,aq 0.33122E-08 -8.4799 0.33122E-08 -8.4799 0.10000E+01 0.0000 133 NaCl,aq 0.29423E-01 -1.5313 0.29423E-01 -1.5313 0.10000E+01 0.0000 134 NaF,aq 0.20803E-04 -4.6819 0.20803E-04 -4.6819 0.10000E+01 0.0000 135 NaOH,aq 0.76799E-08 -8.1146 0.76799E-08 -8.1146 0.10000E+01 0.0000 137 OH- 0.56227E-07 -7.2501 0.36574E-07 -7.4368 0.65048E+00 -0.1868 140 PbCl+ 0.39853E-08 -8.3995 0.25787E-08 -8.5886 0.64705E+00 -0.1891 141 PbCl2,aq 0.42904E-08 -8.3675 0.42904E-08 -8.3675 0.10000E+01 0.0000 142 PbCl3- 0.98829E-09 -9.0051 0.63949E-09 -9.1942 0.64706E+00 -0.1891 143 PbCl4-2 0.36629E-09 -9.4362 0.60155E-10 -10.2207 0.16423E+00 -0.7846 144 PbF+ 0.10348E-10 -10.9852 0.66954E-11 -11.1742 0.64705E+00 -0.1891 150 H2S,aq 0.21047E-05 -5.6768 0.19361E-05 -5.7131 0.91992E+00 -0.0362 159 HSO4- 0.11946E-06 -6.9228 0.77825E-07 -7.1089 0.65149E+00 -0.1861 173 ZnCl+ 0.36912E-06 -6.4328 0.23884E-06 -6.6219 0.64705E+00 -0.1891 174 ZnCl2,aq 0.45841E-07 -7.3387 0.45841E-07 -7.3387 0.10000E+01 0.0000 175 ZnCl3- 0.39537E-08 -8.4030 0.25583E-08 -8.5920 0.64706E+00 -0.1891 176 ZnF+ 0.18925E-09 -9.7230 0.12245E-09 -9.9120 0.64705E+00 -0.1891 178 ZnOH+ 0.45825E-08 -8.3389 0.29651E-08 -8.5280 0.64705E+00 -0.1891 Charge balance for all species = -.4625E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2170244E-04 0.1154181E+00 0.1120233E+03 0.0000 2 H2O 0.1000000E+01 0.5539290E+02 0.9609377E+06 0.0000 3 Cl- 0.5219104E+00 0.5514556E+00 0.1882622E+05 4.3675 4 SO4-- 0.6466638E-04 0.6731193E-04 0.6226463E+01 4.7073 5 HCO3- 0.9519071E-02 0.1248672E+00 0.7336691E+04 2.6295 6 HS- 0.8154064E-07 0.2188218E-05 0.6968682E-01 -2.4387 7 H4SiO4 0.9228415E-03 0.9233855E-03 0.8546251E+02 -3.0349 8 Al+++ 0.2476156E-10 0.9982526E-09 0.2593619E-04 2.1378 9 Ca++ 0.6626746E-03 0.7512213E-03 0.2899169E+02 5.6995 10 Mg++ 0.5441808E-04 0.6129472E-04 0.1434972E+01 4.6083 11 Fe++ 0.5082144E-06 0.5600610E-06 0.3011860E-01 2.5797 12 K+ 0.1617636E-01 0.1622042E-01 0.6107459E+03 2.8584 13 Na+ 0.5143035E+00 0.5437474E+00 0.1203738E+05 4.3585 14 Mn++ 0.9275306E-05 0.1230271E-04 0.6508383E+00 3.8419 15 Zn++ 0.9262798E-07 0.5163097E-06 0.3250037E-01 1.8404 16 Cu+ 0.3208957E-13 0.4317505E-09 0.2641677E-04 -8.8463 17 Pb++ 0.9915697E-09 0.1063584E-07 0.2121975E-02 -0.1208 18 Ag+ 0.7849827E-13 0.2096082E-08 0.2177251E-03 -8.4562 19 Au+ 0.1871490E-24 0.4734105E-12 0.8979062E-07 -20.0779 20 Ba++ 0.1253781E-05 0.1450328E-05 0.1918062E+00 2.9847 21 F- 0.5378728E-03 0.5809287E-03 0.1062748E+02 1.3840 22 H2AsO3- 0.1322043E-07 0.4626033E-04 0.5565380E+01 -3.1973 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234478E+00 -.1267322E-04 0.0000000E+00 2 H2O 0.1552327E+03 0.1552332E+03 -.4457005E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886350E-03 0.4223295E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6132266E-05 0.7898045E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2587697E-02 0.2240440E-03 0.0000000E+00 8 Al+++ 0.2407279E-05 0.2797504E-08 0.2404481E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569516E-05 0.3378944E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.1446907E-05 0.6021269E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1209938E-08 0.1689472E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.2980590E-07 0.1535215E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.5874062E-08 0.4212540E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.1326686E-11 0.1784274E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627996E-02 0.2404481E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: -.1271E-20 Mass of aqueous solution: 0.291025E+04 g Temperature = 89.51 C Pressure = 500.00 bar Mixer frac. = 1.8000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.2228E-03 -3.652 0.1339E-01 -1.873 91.50 0.5056E-02 argentite 0.2106E-06 -6.676 0.5219E-04 -4.282 0.3567 0.7329E-05 bornite 0.3379E-07 -7.471 0.1696E-04 -4.771 0.1159 0.3336E-05 topaz 0.1202E-05 -5.920 0.2213E-03 -3.655 1.512 0.6194E-04 galena 0.1535E-05 -5.814 0.3673E-03 -3.435 2.510 0.4834E-04 gold,native 0.1784E-11 -11.749 0.3514E-09 -9.454 0.2402E-05 0.1823E-10 silver,native 0.1294E-11 -11.888 0.1396E-09 -9.855 0.9539E-06 0.1329E-10 sphalerite 0.6021E-05 -5.220 0.5867E-03 -3.232 4.009 0.1435E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5796E+00 0.2503E+00 0.4319 -0.601 silver,native 0.4204E+00 0.5866E-01 0.1395 -1.232 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.8000000 Solid products produced: Mass = 0.014633 g Volume = 0.005320 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 89.5087 deg.C Sat. pressure: 21.6034 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4659E-01 0.8827 0.8884E+00 0.1006E+01 CO2,gas 0.9534E+00 0.9342 0.1924E+02 0.2060E+02 CH4,gas 0.4130E-08 1.0167 0.9072E-07 0.8923E-07 H2,gas 0.7613E-07 1.0119 0.1664E-05 0.1645E-05 H2S,gas 0.4215E-05 0.9147 0.8329E-04 0.9106E-04 S2,gas 0.8936E-18 1.0000 0.1930E-16 0.1930E-16 CO,gas 0.3066E-09 1.0000 0.6625E-08 0.6625E-08 SO3,gas 0.3653E-32 1.0000 0.7891E-31 0.7891E-31 O2,gas 0.1385E-54 1.0000 0.2991E-53 0.2991E-53 SO2,gas 0.1016E-14 1.0000 0.2196E-13 0.2196E-13 HF,gas 0.1966E-08 1.0000 0.4246E-07 0.4246E-07 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -3.02 -3.02 0.00 0.000 0.00000E+00 197 argentite -29.03 -29.03 0.00 0.000 0.00000E+00 206 bornite -90.43 -90.43 0.00 0.000 -0.23582E-10 226 topaz -15.35 -15.35 0.00 0.000 -0.11791E-10 261 galena -12.24 -12.24 0.00 0.000 0.00000E+00 262 gold,native -19.16 -19.16 0.00 0.000 0.00000E+00 263 silver,native -6.91 -6.91 0.00 0.000 0.00000E+00 273 sphalerite -10.28 -10.28 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 2.74 -0.01 -2.75 -2.750 0.45641E+04 -0.051 2 CO2,gas -5.63 -7.04 -1.41 -0.472 0.23477E+04 1.284 3 CH4,gas 5.22 -4.52 -9.74 -2.435 0.16165E+05 -7.042 4 H2,gas 9.10 0.62 -8.48 -4.844 0.14069E+05 -5.779 5 H2S,gas -5.34 -12.12 -6.78 -3.389 0.11249E+05 -4.079 6 S2,gas -6.07 -25.48 -19.41 -2.987 0.32216E+05 -16.714 7 CO,gas 4.47 -6.41 -10.88 -3.347 0.18051E+05 -8.179 8 SO3,gas 19.16 -14.64 -33.80 -8.450 0.56093E+05 -31.103 9 O2,gas 54.96 -1.27 -56.22 -37.482 0.93300E+05 -53.524 10 SO2,gas 2.35 -14.01 -16.36 -4.362 0.27145E+05 -13.658 11 HF,gas 1.78 -8.29 -10.07 -5.035 0.16712E+05 -7.372 12 HCl,gas 3.72 -5.31 -9.03 -4.516 0.14988E+05 -9.032 17 albite-high 1.50 -2.58 -4.07 -0.313 0.67584E+04 18 albite 0.36 -2.58 -2.94 -0.226 0.48730E+04 22 analcite 4.11 0.43 -3.67 -0.408 0.60947E+04 26 anhydrite -4.83 -8.95 -4.12 -2.060 0.68367E+04 27 ankerite -1.53 -5.82 -4.29 -0.715 0.71224E+04 34 aragonite 1.28 -1.35 -2.63 -0.875 0.43572E+04 36 calcite 1.14 -1.35 -2.49 -0.829 0.41291E+04 53 coesite -2.40 -3.02 -0.62 -0.205 0.10221E+04 60 cristobalite -2.54 -3.02 -0.48 -0.161 0.80105E+03 65 diaspore 3.48 2.12 -1.36 -0.226 0.22492E+04 66 diamond -3.29 -5.77 -2.48 -0.709 0.41161E+04 69 dolomite,ordered 1.21 -3.79 -5.00 -0.833 0.82967E+04 83 gibbsite 4.65 2.11 -2.53 -0.362 0.42060E+04 86 goethite 6.81 2.25 -4.55 -0.985 0.75580E+04 87 graphite -3.73 -5.77 -2.04 -0.583 0.33880E+04 90 halite 1.65 -0.95 -2.60 -1.301 0.43172E+04 96 jadeite 4.87 0.44 -4.43 -0.443 0.73530E+04 99 kaolinite -0.26 -1.80 -1.54 -0.140 0.25598E+04 100 kyanite 6.22 1.23 -4.99 -0.499 0.82764E+04 107 magnesite 1.06 -2.44 -3.50 -1.167 0.58111E+04 117 microcline -1.86 -4.08 -2.22 -0.171 0.36859E+04 121 muscovite 4.39 0.17 -4.23 -0.249 0.70130E+04 122 paragonite 6.14 1.67 -4.47 -0.263 0.74143E+04 143 pyrite -21.41 -22.28 -0.87 -0.205 0.14471E+04 145 pyrrhotiteFe0.875 -5.87 -9.94 -4.07 -1.497 0.67539E+04 147 pyrophyllite -5.07 -7.83 -2.77 -0.173 0.45913E+04 153 rhodochrosite -0.72 -3.21 -2.49 -0.829 0.41295E+04 155 sanidine -0.61 -4.08 -3.47 -0.267 0.57514E+04 157 siderite -2.32 -4.47 -2.15 -0.717 0.35675E+04 165 stilbite -6.33 -11.25 -4.92 -0.234 0.81583E+04 171 sulfur -9.18 -12.74 -3.57 -1.097 0.59169E+04 172 sylvite 1.37 -2.45 -3.83 -1.913 0.63491E+04 180 topaz-H 5.80 1.22 -4.58 -0.416 0.76004E+04 181 tridymite -2.61 -3.02 -0.41 -0.138 0.68629E+03 198 arsenic -7.48 -11.91 -4.44 -1.145 0.73624E+04 205 beidellite-Na 0.07 -4.70 -4.77 -0.292 0.79179E+04 208 chalcedony -2.83 -3.02 -0.19 -0.064 0.31987E+03 209 chalcocite -28.56 -29.81 -1.25 -0.312 0.20727E+04 211 covellite -20.33 -21.28 -0.94 -0.359 0.15631E+04 212 dawsonite 2.26 -0.57 -2.83 -0.353 0.46888E+04 214 montmorillonite-Ca -1.14 -6.08 -4.94 -0.305 0.81950E+04 215 montmorillonite-K -1.14 -6.07 -4.93 -0.302 0.81815E+04 216 montmorillonite-Mg -1.31 -6.26 -4.94 -0.306 0.82046E+04 217 montmorillonite-Na -0.91 -5.58 -4.67 -0.286 0.77448E+04 230 gypsum -4.61 -8.96 -4.36 -1.090 0.72348E+04 246 acanthite -28.95 -29.03 -0.08 -0.019 0.12680E+03 252 barite -9.17 -11.66 -2.49 -1.246 0.41367E+04 253 boehmite 5.09 2.12 -2.97 -0.494 0.49224E+04 254 cerussite -2.70 -7.17 -4.47 -1.489 0.74137E+04 255 chalcopyrite -28.90 -30.81 -1.91 -0.356 0.31743E+04 260 fluorite -9.59 -10.89 -1.30 -0.433 0.21537E+04 270 silica-amorphous -2.04 -3.02 -0.98 -0.326 0.16230E+04 271 smithsonite -0.41 -5.21 -4.80 -1.599 0.79625E+04 274 wurtzite -8.39 -10.28 -1.89 -0.629 0.31337E+04 276 an20ab80 3.00 -1.28 -4.28 -0.329 0.71013E+04 277 an25ab75 3.69 -0.96 -4.64 -0.357 0.77043E+04 Calculations done for 89.5087 Deg. C; 500.0000 bar Mixer fraction: 1.8000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 89.509 .62154E+00 1.781 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1570E+03 New heat: 1.742 New temperature: 87.316 New mixer fraction: 1.9000000 Resulting temperature: 87.316Deg. C Solids and gases carried Charge balance check after fractionation or titration: TBAL = -.1296E-03 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Test file for CHIM-XPT. Mixing of cold water into metal bearing water starting at 199.97 C. Illustrates fluid-fluid mixing. CHIMRUN demo-3 ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Number of loops used = 7 Loop limit = 70 Temperature = 87.32 C Pressure = 500.00 bar Mixer fraction = 1.9000000 Water: Moles liquid = 0.1611E+03 kg liquid = 0.2902E+01 Moles total = 0.1608E+03 kg total = 0.2897E+01 Activity = 0.9824 Stoichiometric ionic strength = .6000830E+00 Osmotic coef. = 0.9278 True ionic strength = .5157457E+00 Chg. balance for total moles = -.1296E-03 Max. difference allowed = 0.1545E-03 Log Log Log Species(n) Molality Molality Activity Activity Gamma Gamma 1 H+ 0.21899E-04 -4.6596 0.14699E-04 -4.8327 0.67124E+00 -0.1731 2 H2O 0.98235E+00 -0.0077 0.98235E+00 -0.0077 3 Cl- 0.50516E+00 -0.2966 0.32821E+00 -0.4838 0.64972E+00 -0.1873 4 SO4-- 0.62518E-04 -4.2040 0.10613E-04 -4.9742 0.16976E+00 -0.7702 5 HCO3- 0.91923E-02 -2.0366 0.59847E-02 -2.2230 0.65106E+00 -0.1864 6 HS- 0.75490E-07 -7.1221 0.49050E-07 -7.3094 0.64975E+00 -0.1873 7 H4SiO4 0.88558E-03 -3.0528 0.88558E-03 -3.0528 0.10000E+01 0.0000 8 Al+++ 0.28771E-10 -10.5410 0.51554E-12 -12.2877 0.17919E-01 -1.7467 9 Ca++ 0.64316E-03 -3.1917 0.10476E-03 -3.9798 0.16289E+00 -0.7881 10 Mg++ 0.52745E-04 -4.2778 0.84886E-05 -5.0712 0.16094E+00 -0.7933 11 Fe++ 0.49231E-06 -6.3078 0.79414E-07 -7.1001 0.16131E+00 -0.7923 12 K+ 0.15622E-01 -1.8063 0.10139E-01 -1.9940 0.64899E+00 -0.1878 13 Na+ 0.49781E+00 -0.3029 0.32155E+00 -0.4928 0.64593E+00 -0.1898 14 Mn++ 0.91048E-05 -5.0407 0.14716E-05 -5.8322 0.16163E+00 -0.7915 15 Zn++ 0.93371E-07 -7.0298 0.15061E-07 -7.8221 0.16131E+00 -0.7923 16 Cu+ 0.27041E-13 -13.5680 0.17466E-13 -13.7578 0.64589E+00 -0.1898 17 Pb++ 0.91241E-09 -9.0398 0.15018E-09 -9.8234 0.16460E+00 -0.7836 18 Ag+ 0.65566E-13 -13.1833 0.42501E-13 -13.3716 0.64821E+00 -0.1883 19 Au+ 0.13694E-24 -24.8635 0.88941E-25 -25.0509 0.64946E+00 -0.1874 20 Ba++ 0.12208E-05 -5.9133 0.20253E-06 -6.6935 0.16589E+00 -0.7802 21 F- 0.52081E-03 -3.2833 0.34122E-03 -3.4670 0.65517E+00 -0.1836 22 H2AsO3- 0.11751E-07 -7.9299 0.81921E-08 -8.0866 0.69712E+00 -0.1567 24 HSiO3- 0.11161E-06 -6.9523 0.72512E-07 -7.1396 0.64972E+00 -0.1873 25 Ca(HSiO3)+ 0.19744E-09 -9.7046 0.12823E-09 -9.8920 0.64946E+00 -0.1874 26 Mg(HSiO3)+ 0.20968E-10 -10.6784 0.13618E-10 -10.8659 0.64946E+00 -0.1874 27 NaHSiO3,aq 0.38548E-06 -6.4140 0.38548E-06 -6.4140 0.10000E+01 0.0000 31 AgCl,aq 0.10208E-10 -10.9910 0.10208E-10 -10.9910 0.10000E+01 0.0000 32 AgCl2- 0.22970E-09 -9.6388 0.14924E-09 -9.8261 0.64972E+00 -0.1873 33 AgCl3-2 0.52589E-10 -10.2791 0.88619E-11 -11.0525 0.16851E+00 -0.7734 38 Ag(HS),aq 0.16367E-08 -8.7860 0.16367E-08 -8.7860 0.10000E+01 0.0000 40 AlO+ 0.10435E-09 -9.9815 0.67770E-10 -10.1690 0.64946E+00 -0.1874 41 AlOH+2 0.52146E-10 -10.2828 0.84506E-11 -11.0731 0.16206E+00 -0.7903 42 HAlO2,aq 0.61701E-09 -9.2097 0.61701E-09 -9.2097 0.10000E+01 0.0000 43 AlO2- 0.10668E-09 -9.9719 0.69705E-10 -10.1567 0.65342E+00 -0.1848 44 AsO2- 0.93182E-08 -8.0307 0.60542E-08 -8.2179 0.64972E+00 -0.1873 45 HAsO2,aq 0.19169E-04 -4.7174 0.19169E-04 -4.7174 0.10000E+01 0.0000 46 H3AsO3,aq 0.25477E-04 -4.5939 0.25477E-04 -4.5939 0.10000E+01 0.0000 62 BaCO3,aq 0.21900E-10 -10.6596 0.21900E-10 -10.6596 0.10000E+01 0.0000 63 Ba(HCO3)+ 0.73040E-07 -7.1364 0.47620E-07 -7.3222 0.65197E+00 -0.1858 64 BaCl+ 0.10627E-06 -6.9736 0.69021E-07 -7.1610 0.64946E+00 -0.1874 65 BaF+ 0.17149E-09 -9.7658 0.11138E-09 -9.9532 0.64946E+00 -0.1874 66 CH4,aq 0.31399E-10 -10.5031 0.28931E-10 -10.5386 0.92137E+00 -0.0356 72 CO2,aq 0.11135E+00 -0.9533 0.10260E+00 -0.9889 0.92137E+00 -0.0356 73 CO3-2 0.34998E-06 -6.4560 0.58976E-07 -7.2293 0.16851E+00 -0.7734 74 CaCO3,aq 0.47793E-07 -7.3206 0.47793E-07 -7.3206 0.10000E+01 0.0000 75 Ca(HCO3)+ 0.18185E-04 -4.7403 0.11811E-04 -4.9277 0.64946E+00 -0.1874 76 CaCl+ 0.60447E-04 -4.2186 0.39258E-04 -4.4061 0.64946E+00 -0.1874 77 CaCl2,aq 0.26737E-05 -5.5729 0.26737E-05 -5.5729 0.10000E+01 0.0000 78 CaF+ 0.56592E-06 -6.2472 0.36754E-06 -6.4347 0.64946E+00 -0.1874 79 CaOH+ 0.30079E-09 -9.5217 0.19535E-09 -9.7092 0.64946E+00 -0.1874 80 CaSO4,aq 0.25569E-06 -6.5923 0.25569E-06 -6.5923 0.10000E+01 0.0000 81 HCl,aq 0.10519E-05 -5.9780 0.10519E-05 -5.9780 0.10000E+01 0.0000 90 CuCl,aq 0.34977E-10 -10.4562 0.34977E-10 -10.4562 0.10000E+01 0.0000 91 CuCl2- 0.28990E-09 -9.5378 0.18835E-09 -9.7250 0.64972E+00 -0.1873 92 CuCl3-2 0.24806E-10 -10.6054 0.41801E-11 -11.3788 0.16851E+00 -0.7734 98 HF,aq 0.20177E-04 -4.6951 0.20177E-04 -4.6951 0.10000E+01 0.0000 99 HF2- 0.29870E-08 -8.5248 0.19407E-08 -8.7120 0.64972E+00 -0.1873 101 FeCl+ 0.46652E-07 -7.3311 0.30299E-07 -7.5186 0.64946E+00 -0.1874 104 FeF+ 0.16128E-08 -8.7924 0.10474E-08 -8.9799 0.64946E+00 -0.1874 107 FeOH+ 0.17682E-09 -9.7525 0.11484E-09 -9.9399 0.64946E+00 -0.1874 113 H2,aq 0.76148E-09 -9.1183 0.70161E-09 -9.1539 0.92137E+00 -0.0356 114 KCl,aq 0.37459E-04 -4.4264 0.37459E-04 -4.4264 0.10000E+01 0.0000 116 KOH,aq 0.19068E-09 -9.7197 0.19068E-09 -9.7197 0.10000E+01 0.0000 117 KSO4- 0.21045E-05 -5.6769 0.13673E-05 -5.8641 0.64972E+00 -0.1873 118 MgCO3,aq 0.10249E-08 -8.9893 0.10249E-08 -8.9893 0.10000E+01 0.0000 119 Mg(HCO3)+ 0.14944E-05 -5.8255 0.97056E-06 -6.0130 0.64946E+00 -0.1874 120 MgCl+ 0.47677E-05 -5.3217 0.30964E-05 -5.5091 0.64946E+00 -0.1874 121 MgF+ 0.17447E-06 -6.7583 0.11331E-06 -6.9457 0.64946E+00 -0.1874 122 MgOH+ 0.14962E-09 -9.8250 0.97175E-10 -10.0124 0.64946E+00 -0.1874 124 MnF+ 0.95018E-08 -8.0222 0.61711E-08 -8.2096 0.64946E+00 -0.1874 126 MnOH+ 0.28359E-09 -9.5473 0.18418E-09 -9.7348 0.64946E+00 -0.1874 131 MnCl+ 0.27610E-05 -5.5589 0.17932E-05 -5.7464 0.64946E+00 -0.1874 132 MnSO4,aq 0.31899E-08 -8.4962 0.31899E-08 -8.4962 0.10000E+01 0.0000 133 NaCl,aq 0.27186E-01 -1.5657 0.27186E-01 -1.5657 0.10000E+01 0.0000 134 NaF,aq 0.19169E-04 -4.7174 0.19169E-04 -4.7174 0.10000E+01 0.0000 135 NaOH,aq 0.66840E-08 -8.1750 0.66840E-08 -8.1750 0.10000E+01 0.0000 137 OH- 0.50510E-07 -7.2966 0.33004E-07 -7.4814 0.65342E+00 -0.1848 140 PbCl+ 0.35391E-08 -8.4511 0.22985E-08 -8.6386 0.64946E+00 -0.1874 141 PbCl2,aq 0.36456E-08 -8.4382 0.36456E-08 -8.4382 0.10000E+01 0.0000 142 PbCl3- 0.80688E-09 -9.0932 0.52425E-09 -9.2805 0.64972E+00 -0.1873 143 PbCl4-2 0.28709E-09 -9.5420 0.48379E-10 -10.3153 0.16851E+00 -0.7734 150 H2S,aq 0.20086E-05 -5.6971 0.18507E-05 -5.7327 0.92137E+00 -0.0356 159 HSO4- 0.11142E-06 -6.9531 0.72845E-07 -7.1376 0.65381E+00 -0.1845 173 ZnCl+ 0.33146E-06 -6.4796 0.21527E-06 -6.6670 0.64946E+00 -0.1874 174 ZnCl2,aq 0.40361E-07 -7.3940 0.40361E-07 -7.3940 0.10000E+01 0.0000 175 ZnCl3- 0.34354E-08 -8.4640 0.22321E-08 -8.6513 0.64972E+00 -0.1873 176 ZnF+ 0.18458E-09 -9.7338 0.11988E-09 -9.9213 0.64946E+00 -0.1874 178 ZnOH+ 0.40210E-08 -8.3957 0.26115E-08 -8.5831 0.64946E+00 -0.1874 Charge balance for all species = -.4466E-04 Component Molality Aq.molality ppm log[A(N)/A(H+)**Z] (total) 1 H+ 0.2189889E-04 0.1114415E+00 0.1083019E+03 0.0000 2 H2O 0.1000000E+01 0.5539688E+02 0.9622358E+06 0.0000 3 Cl- 0.5051570E+00 0.5324556E+00 0.1820083E+05 4.3489 4 SO4-- 0.6251816E-04 0.6499273E-04 0.6019624E+01 4.6912 5 HCO3- 0.9192292E-02 0.1205650E+00 0.7092970E+04 2.6097 6 HS- 0.7549029E-07 0.2085968E-05 0.6651548E-01 -2.4767 7 H4SiO4 0.8855770E-03 0.8860744E-03 0.8211412E+02 -3.0528 8 Al+++ 0.2877115E-10 0.9089568E-09 0.2364635E-04 2.2104 9 Ca++ 0.6431628E-03 0.7253384E-03 0.2802860E+02 5.6856 10 Mg++ 0.5274509E-04 0.5918285E-04 0.1387303E+01 4.5942 11 Fe++ 0.4923097E-06 0.5407510E-06 0.2911735E-01 2.5653 12 K+ 0.1562199E-01 0.1566155E-01 0.5904572E+03 2.8387 13 Na+ 0.4978071E+00 0.5250129E+00 0.1163750E+05 4.3399 14 Mn++ 0.9104806E-05 0.1187882E-04 0.6292178E+00 3.8332 15 Zn++ 0.9337077E-07 0.4728280E-06 0.2980138E-01 1.8433 16 Cu+ 0.2704133E-13 0.3497051E-09 0.2142417E-04 -8.9251 17 Pb++ 0.9124067E-09 0.9203666E-08 0.1838588E-02 -0.1580 18 Ag+ 0.6556593E-13 0.1930921E-08 0.2008260E-03 -8.5389 19 Au+ 0.1369448E-24 0.4224419E-12 0.8022600E-07 -20.2182 20 Ba++ 0.1220850E-05 0.1400357E-05 0.1854345E+00 2.9719 21 F- 0.5208091E-03 0.5609131E-03 0.1027444E+02 1.3657 22 H2AsO3- 0.1175123E-07 0.4466645E-04 0.5380501E+01 -3.2539 Component Tot moles Aq. moles Solid moles Gas moles 1 H+ 0.3234352E+00 0.3234479E+00 -.1275145E-04 0.0000000E+00 2 H2O 0.1607835E+03 0.1607840E+03 -.4776063E-03 0.0000000E+00 3 Cl- 0.1545400E+01 0.1545400E+01 0.0000000E+00 0.0000000E+00 4 SO4-- 0.1886393E-03 0.1886350E-03 0.4228149E-08 0.0000000E+00 5 HCO3- 0.3499280E+00 0.3499280E+00 0.0000000E+00 0.0000000E+00 6 HS- 0.1403031E-04 0.6054316E-05 0.7975994E-05 0.0000000E+00 7 H4SiO4 0.2811741E-02 0.2571744E-02 0.2399970E-03 0.0000000E+00 8 Al+++ 0.2407279E-05 0.2638158E-08 0.2404641E-05 0.0000000E+00 9 Ca++ 0.2105223E-02 0.2105223E-02 0.0000000E+00 0.0000000E+00 10 Mg++ 0.1717724E-03 0.1717724E-03 0.0000000E+00 0.0000000E+00 11 Fe++ 0.1603305E-05 0.1569477E-05 0.3382843E-07 0.0000000E+00 12 K+ 0.4545612E-01 0.4545612E-01 0.0000000E+00 0.0000000E+00 13 Na+ 0.1523798E+01 0.1523798E+01 0.0000000E+00 0.0000000E+00 14 Mn++ 0.3447712E-04 0.3447712E-04 0.0000000E+00 0.0000000E+00 15 Zn++ 0.7468176E-05 0.1372337E-05 0.6095839E-05 0.0000000E+00 16 Cu+ 0.1701571E-06 0.1014985E-08 0.1691421E-06 0.0000000E+00 17 Pb++ 0.1565021E-05 0.2671274E-07 0.1538308E-05 0.0000000E+00 18 Ag+ 0.4271281E-06 0.5604309E-08 0.4215238E-06 0.0000000E+00 19 Au+ 0.3110961E-11 0.1226096E-11 0.1884865E-11 0.0000000E+00 20 Ba++ 0.4064400E-05 0.4064400E-05 0.0000000E+00 0.0000000E+00 21 F- 0.1630400E-02 0.1627995E-02 0.2404641E-05 0.0000000E+00 22 H2AsO3- 0.1296400E-03 0.1296400E-03 0.0000000E+00 0.0000000E+00 Chg. balance for solid moles: 0.4235E-21 Mass of aqueous solution: 0.301025E+04 g Temperature = 87.32 C Pressure = 500.00 bar Mixer frac. = 1.9000000 Log Log Vol Gas or mineral Moles Moles Grams Grams Wt.% (cm3) quartz 0.2388E-03 -3.622 0.1435E-01 -1.843 91.97 0.5418E-02 argentite 0.2108E-06 -6.676 0.5223E-04 -4.282 0.3348 0.7334E-05 bornite 0.3383E-07 -7.471 0.1698E-04 -4.770 0.1088 0.3340E-05 topaz 0.1202E-05 -5.920 0.2213E-03 -3.655 1.419 0.6195E-04 galena 0.1538E-05 -5.813 0.3680E-03 -3.434 2.359 0.4844E-04 gold,native 0.1885E-11 -11.725 0.3713E-09 -9.430 0.2380E-05 0.1925E-10 silver,native 0.1348E-11 -11.870 0.1454E-09 -9.837 0.9324E-06 0.1385E-10 sphalerite 0.6096E-05 -5.215 0.5939E-03 -3.226 3.807 0.1452E-03 Partial press. Fugacity coef Log fugacity Gas or Mineral Mole fraction or activity Activity coef Log activity quartz 0.1000E+01 0.1000E+01 1.0000 0.000 argentite 0.1000E+01 0.1000E+01 1.0000 0.000 bornite 0.1000E+01 0.1000E+01 1.0000 0.000 topaz 0.1000E+01 0.1000E+01 1.0000 0.000 galena 0.1000E+01 0.1000E+01 1.0000 0.000 gold,native 0.5830E+00 0.2540E+00 0.4357 -0.595 silver,native 0.4170E+00 0.5626E-01 0.1349 -1.250 sphalerite 0.1000E+01 0.1000E+01 1.0000 0.000 Total fraction of mixing solution added: 1.9000000 Solid products produced: Mass = 0.015599 g Volume = 0.005684 cm3 WARNING: mineral volume may be in error because some mineral densities were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt. Gas composition at saturation ( 3 iterations) ------------------------------------------------- Temperature: 87.3161 deg.C Sat. pressure: 20.3825 bar Gas Mole fraction phi Fugacity Partial P(bar) H2O,gas 0.4522E-01 0.8885 0.8190E+00 0.9217E+00 CO2,gas 0.9548E+00 0.9364 0.1822E+02 0.1946E+02 CH4,gas 0.4008E-08 1.0156 0.8297E-07 0.8170E-07 H2,gas 0.7060E-07 1.0113 0.1455E-05 0.1439E-05 H2S,gas 0.4176E-05 0.9180 0.7814E-04 0.8513E-04 S2,gas 0.7730E-18 1.0000 0.1576E-16 0.1576E-16 CO,gas 0.2688E-09 1.0000 0.5479E-08 0.5479E-08 SO3,gas 0.2391E-32 1.0000 0.4873E-31 0.4873E-31 O2,gas 0.6128E-55 1.0000 0.1249E-53 0.1249E-53 SO2,gas 0.8428E-15 1.0000 0.1718E-13 0.1718E-13 HF,gas 0.1788E-08 1.0000 0.3644E-07 0.3644E-07 NON-Ideal mixing with H2O, CO2, CH4 Gases ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ The following gases and minerals are presently in matrix or were just added Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity 148 quartz -3.04 -3.04 0.00 0.000 0.00000E+00 197 argentite -29.22 -29.22 0.00 0.000 0.58600E-11 206 bornite -90.94 -90.94 0.00 0.000 -0.23440E-10 226 topaz -15.23 -15.23 0.00 0.000 0.11720E-10 261 galena -12.30 -12.30 0.00 0.000 0.00000E+00 262 gold,native -19.31 -19.31 0.00 0.000 -0.58600E-11 263 silver,native -6.98 -6.98 0.00 0.000 0.14650E-11 273 sphalerite -10.30 -10.30 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 2.78 -0.01 -2.79 -2.786 0.45948E+04 -0.087 2 CO2,gas -5.61 -7.05 -1.44 -0.479 0.23725E+04 1.261 3 CH4,gas 5.21 -4.57 -9.78 -2.445 0.16132E+05 -7.081 4 H2,gas 9.15 0.62 -8.54 -4.878 0.14080E+05 -5.837 5 H2S,gas -5.34 -12.14 -6.81 -3.403 0.11226E+05 -4.107 6 S2,gas -6.02 -25.52 -19.50 -3.000 0.32166E+05 -16.803 7 CO,gas 4.54 -6.42 -10.96 -3.372 0.18078E+05 -8.261 8 SO3,gas 19.38 -14.63 -34.01 -8.503 0.56099E+05 -31.312 9 O2,gas 55.35 -1.25 -56.60 -37.735 0.93362E+05 -53.903 10 SO2,gas 2.46 -14.01 -16.46 -4.390 0.27156E+05 -13.765 11 HF,gas 1.84 -8.30 -10.14 -5.069 0.16721E+05 -7.438 12 HCl,gas 3.79 -5.32 -9.11 -4.555 0.15026E+05 -9.110 17 albite-high 1.58 -2.58 -4.15 -0.319 0.68500E+04 18 albite 0.43 -2.58 -3.00 -0.231 0.49555E+04 22 analcite 4.19 0.45 -3.74 -0.416 0.61722E+04 26 anhydrite -4.79 -8.95 -4.16 -2.080 0.68632E+04 27 ankerite -1.47 -5.86 -4.39 -0.732 0.72395E+04 34 aragonite 1.31 -1.37 -2.68 -0.892 0.44162E+04 36 calcite 1.17 -1.37 -2.54 -0.847 0.41896E+04 53 coesite -2.42 -3.04 -0.62 -0.206 0.10212E+04 60 cristobalite -2.55 -3.04 -0.49 -0.163 0.80483E+03 65 diaspore 3.57 2.19 -1.37 -0.229 0.22651E+04 66 diamond -3.33 -5.80 -2.47 -0.706 0.40765E+04 83 gibbsite 4.74 2.19 -2.55 -0.365 0.42091E+04 86 goethite 6.87 2.24 -4.63 -1.000 0.76313E+04 87 graphite -3.77 -5.80 -2.03 -0.580 0.33504E+04 90 halite 1.65 -0.98 -2.63 -1.315 0.43365E+04 96 jadeite 4.96 0.46 -4.50 -0.450 0.74188E+04 99 kaolinite -0.13 -1.69 -1.56 -0.142 0.25772E+04 107 magnesite 1.11 -2.46 -3.57 -1.190 0.58867E+04 117 microcline -1.81 -4.08 -2.27 -0.174 0.37398E+04 121 muscovite 4.62 0.31 -4.31 -0.253 0.71045E+04 122 paragonite 6.38 1.81 -4.57 -0.269 0.75301E+04 143 pyrite -21.48 -22.34 -0.85 -0.201 0.14077E+04 145 pyrrhotiteFe0.875 -5.86 -9.97 -4.11 -1.512 0.67794E+04 147 pyrophyllite -4.95 -7.76 -2.80 -0.175 0.46265E+04 153 rhodochrosite -0.69 -3.22 -2.53 -0.843 0.41694E+04 155 sanidine -0.56 -4.08 -3.52 -0.271 0.58054E+04 157 siderite -2.29 -4.49 -2.20 -0.732 0.36229E+04 165 stilbite -6.26 -11.24 -4.98 -0.237 0.82085E+04 171 sulfur -9.20 -12.76 -3.55 -1.094 0.58628E+04 172 sylvite 1.37 -2.48 -3.84 -1.922 0.63417E+04 180 topaz-H 5.98 1.35 -4.62 -0.420 0.76279E+04 181 tridymite -2.62 -3.04 -0.42 -0.139 0.68834E+03 198 arsenic -7.53 -11.97 -4.44 -1.146 0.73261E+04 205 beidellite-Na 0.24 -4.60 -4.84 -0.296 0.79793E+04 208 chalcedony -2.84 -3.04 -0.19 -0.065 0.31995E+03 209 chalcocite -28.74 -29.99 -1.25 -0.313 0.20628E+04 211 covellite -20.45 -21.38 -0.93 -0.353 0.15271E+04 212 dawsonite 2.32 -0.52 -2.84 -0.356 0.46914E+04 217 montmorillonite-Na -0.80 -5.54 -4.74 -0.290 0.78234E+04 230 gypsum -4.59 -8.97 -4.38 -1.095 0.72276E+04 246 acanthite -29.15 -29.22 -0.07 -0.018 0.12169E+03 252 barite -9.17 -11.67 -2.50 -1.248 0.41156E+04 253 boehmite 5.19 2.19 -3.00 -0.500 0.49465E+04 254 cerussite -2.70 -7.21 -4.51 -1.503 0.74371E+04 255 chalcopyrite -29.03 -30.95 -1.93 -0.358 0.31762E+04 260 fluorite -9.59 -10.91 -1.33 -0.443 0.21915E+04 270 silica-amorphous -2.05 -3.04 -0.99 -0.329 0.16282E+04 271 smithsonite -0.38 -5.21 -4.84 -1.612 0.79770E+04 274 wurtzite -8.40 -10.30 -1.90 -0.633 0.31339E+04 276 an20ab80 3.11 -1.26 -4.37 -0.336 0.72037E+04 277 an25ab75 3.80 -0.93 -4.74 -0.364 0.78114E+04 Calculations done for 87.3161 Deg. C; 500.0000 bar Mixer fraction: 1.9000000 Temperature Stoc.ionic strength Heat per mole Actual solution: 87.316 .60008E+00 1.742 Mixing solution: 25.000 .50000E-10 0.646 Fract. of mixing solution added: 0.100000 BITMOL = 0.5551E+01 OLDMOL = 0.1625E+03 New heat: 1.706 New temperature: 85.268 New mixer fraction: 2.0000000 Resulting temperature: 85.268Deg. C Mixing fraction reached given limit of 0.2000E+01 TOTMIX = 0.2000E+01 Execution stopped.