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.