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.
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.
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Species No. Charge Tot.moles Trial molality Gamma Mixing solution
H+ 1 1. 0.12000E-03 0.10244E-06 0.9818 0.00000000E+00
H2O 2 0. 0.55508E+02 0.10000E+01 1.0000 0.00000000E+00
Cl- 3 -1. 0.10000E-06 0.10000E-06 0.9818 0.00000000E+00
SO4-- 4 -2. 0.12000E-03 0.43237E-20 0.9802 0.00000000E+00
HS- 5 -1. -0.12000E-03 0.36416-158 0.9818 0.00000000E+00
Na+ 6 1. 0.10000E-06 0.10000E-06 0.9818 0.00000000E+00
NH4+ 7 1. 0.10000E-49 0.24356-109 0.9818 0.00000000E+00
Chg. balance for total moles = -.2435E-20 Max. difference allowed = 0.1000E-10
The following parameters were given:
ERPC = 0.1000E-11 pH = 0.0000 PFLUID = 1.0000
SLIM = 0.100000E-19 TEMP = 25.0000 SINC = 0.1000E-21
TEMPC = 0.0000 TOTMIX = 0.000000E+00 ENTH = 0.0000
SENTH = 0.0000 DENTH = 0.0000 TOTWAT = 90.0000
SOLMIN = 0.0000E+00 RM = 0.0000 AQGRM = 0.0000
SUPRNT = 0.1000-199 VBOX-1 = 1.0000 RHOFRS = 0.0000
RHOROC = 2.5000
The following options were selected:
CONFLG = 1 C = 3 IFRAC = 0 IPUNCH = 1
NLOOP = 400 ISTEP = 2 LIMSOL = 1 LOOC = 0
IENTH = 0 ITREF = 0 IDEAL = 0 IPSAT = 1
INCREM = 0 INCP = 0 MINSOL = 3 NEUT = 0
AWAT = 0 CHGF = 0
Of the derived species, only those with molality > 0.10-199 will appear in the output
Species No. Charge Log K(diss) Species No. Charge Log K(diss)
HCl,aq 8 0. 0.7100 S2-2 31 -2. 1.3120
HClO,aq 9 0. 42.1310 S3-2 32 -2. -10.2330
ClO- 10 -1. 49.6810 S3- 33 -1. -17.6990
HClO2,aq 11 0. 90.2870 S4-2 34 -2. -21.5580
H2,aq 12 0. 11.5270 S5-2 35 -2. -32.6630
NH3,aq 13 0. 9.2410 SO2,aq 36 0. 2.9800
HNO2,aq 14 0. 62.8880 SO3-2 37 -2. 12.0450
NO2- 15 -1. 66.1130 HSO3- 38 -1. 4.8400
HNO3,aq 16 0. 86.7600 HSO4- 39 -1. -1.9790
NO3- 17 -1. 85.4580 HSO5- 40 -1. 51.8660
N2,aq 18 0. 5.7590 S2O3-2 41 -2. -4.7780
N2O2-2 19 -2. 101.5910 HS2O3- 42 -1. -6.4630
HN2O2- 20 -1. 90.5960 H2S2O3,aq 43 0. -7.0500
H2N2O2,aq 21 0. 83.5590 S2O4-2 44 -2. 14.7190
N2H5+ 22 1. 33.8570 HS2O4- 45 -1. 12.2260
N2H6+2 23 2. 34.8840 H2S2O4,aq 46 0. 11.8600
NaCl,aq 24 0. 0.7770 S2O5-2 47 -2. 14.4970
NaOH,aq 25 0. 14.2050 S2O6-2 48 -2. 16.8410
O2,aq 26 0. 69.1580 S2O8-2 49 -2. 57.0790
OH- 27 -1. 13.9950 S3O6-2 50 -2. 7.7880
HO2- 28 -1. 62.8880 S4O6-2 51 -2. -17.1710
H2O2,aq 29 0. 51.2040 S5O6-2 52 -2. -13.2500
H2S,aq 30 0. -6.9880 53 0. 13.0680
For mixed gases (JSOLS=6), log K(hydrol) = log (K*P)
Log K Trial Log K Trial
Mineral No. hydrol Moles Mineral No. hydrol Moles
H2O,gas 1 1.511 0.0000E+00 N2,gas 9 2.572 0.0000E+00
H2,gas 2 8.421 0.0000E+00 SO2,gas 10 3.150 0.0000E+00
H2S,gas 3 -7.901 0.0000E+00 HCl,gas 11 6.306 0.0000E+00
S2,gas 4 -7.236 0.0000E+00 halite 12 1.572 0.0000E+00
NO2,gas 5 76.516 0.0000E+00 sulfur 13 -10.519 0.0000E+00
SO3,gas 6 23.875 0.0000E+00 mascagnite 14 -0.023 0.0000E+00
O2,gas 7 66.258 0.0000E+00 niter-Na 15 81.636 0.0000E+00
NH3,gas 8 11.038 0.0000E+00 sodium-oxide 16 67.427 0.0000E+00
Initial composition of reactant (mole%):
N2 gas 100.0 0.000
Sum of wt% of reactants: 100.0000
Reactant consumed: 0.0000000 moles log =-100.0000
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
The following minerals and/or gases with identical index are in solid solution:
H2O,gas 6
H2,gas 6
H2S,gas 6
S2,gas 6
NO2,gas 6
SO3,gas 6
NH3,gas 6
N2,gas 6
SO2,gas 6
HCl,gas 6
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.2435E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43236E-20 -20.3642 0.42382E-20 -20.3728 0.98023E+00 -0.0087
5 HS- 0.36415-158 -158.4387 0.35751-158 -158.4467 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.24356-109 -109.6134 0.23913-109 -109.6214 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.13650-111 -111.8649 0.13650-111 -111.8649 0.99996E+00 0.0000
14 HNO2,aq 0.62434E-67 -67.2046 0.62434E-67 -67.2046 0.10000E+01 0.0000
15 NO2- 0.37662E-63 -63.4241 0.36976E-63 -63.4321 0.98178E+00 -0.0080
16 HNO3,aq 0.49262E-58 -58.3075 0.49262E-58 -58.3075 0.10000E+01 0.0000
17 NO3- 0.10000E-49 -50.0000 0.98178E-50 -50.0080 0.98178E+00 -0.0080
18 N2,aq 0.19979-112 -112.6994 0.19978-112 -112.6995 0.99996E+00 0.0000
19 N2O2-2 0.17431-161 -161.7587 0.17086-161 -161.7674 0.98023E+00 -0.0087
20 HN2O2- 0.17303-157 -157.7619 0.16988-157 -157.7699 0.98178E+00 -0.0080
21 H2N2O2,aq 0.18606-157 -157.7304 0.18606-157 -157.7304 0.10000E+01 0.0000
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34979-158 -158.4562 0.34978-158 -158.4562 0.99996E+00 0.0000
36 SO2,aq 0.76398E-70 -70.1169 0.76398E-70 -70.1169 0.10000E+01 0.0000
37 SO3-2 0.66336E-65 -65.1782 0.65025E-65 -65.1869 0.98023E+00 -0.0087
38 HSO3- 0.10680E-64 -64.9714 0.10485E-64 -64.9794 0.98178E+00 -0.0080
39 HSO4- 0.41368E-25 -25.3833 0.40614E-25 -25.3913 0.98178E+00 -0.0080
40 HSO5- 0.34734E-46 -46.4592 0.34101E-46 -46.4672 0.98178E+00 -0.0080
41 S2O3-2 0.93248-181 -181.0304 0.91404-181 -181.0390 0.98023E+00 -0.0087
42 HS2O3- 0.45337-186 -186.3435 0.44511-186 -186.3515 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17297-192 -192.7620 0.17297-192 -192.7620 0.10000E+01 0.0000
44 S2O4-2 0.17448-167 -167.7583 0.17103-167 -167.7669 0.98023E+00 -0.0087
45 HS2O4- 0.54519-172 -172.2635 0.53526-172 -172.2714 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12504-178 -178.9029 0.12504-178 -178.9029 0.10000E+01 0.0000
47 S2O5-2 0.17094-134 -134.7672 0.16756-134 -134.7758 0.98023E+00 -0.0087
48 S2O6-2 0.45491-104 -104.3421 0.44592-104 -104.3507 0.98023E+00 -0.0087
49 S2O8-2 0.90807E-79 -79.0419 0.89012E-79 -79.0506 0.98023E+00 -0.0087
Charge balance for all species = 0.7854E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log =-100.0000
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8291-223 1.0000 0.2863-157 0.2863-157
S2,gas 0.0000E+00 1.0000 0.7687-258 0.7687-258
NO2,gas 0.1032-129 1.0000 0.3564E-64 0.3564E-64
SO3,gas 0.1656-123 1.0000 0.5717E-58 0.5717E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.6309-179 1.0000 0.2178-113 0.2178-113
N2,gas 0.8899-175 1.0000 0.3073-109 0.3073-109
SO2,gas 0.1496-135 1.0000 0.5165E-70 0.5165E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 12.07 -64.45 -14.731 0.87925E+05 -64.448
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -102.62 -113.66 -56.831 0.15507E+06 -113.662
9 N2,gas 2.57 -106.94 -109.51 -14.131 0.14941E+06 -109.512
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.2235E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.2235E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43235E-20 -20.3642 0.42381E-20 -20.3728 0.98023E+00 -0.0087
5 HS- 0.36414-158 -158.4387 0.35750-158 -158.4467 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.48713E-81 -81.3124 0.47825E-81 -81.3203 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.27301E-83 -83.5638 0.27300E-83 -83.5638 0.99996E+00 0.0000
14 HNO2,aq 0.12487E-38 -38.9036 0.12487E-38 -38.9036 0.10000E+01 0.0000
15 NO2- 0.75324E-35 -35.1231 0.73952E-35 -35.1311 0.98178E+00 -0.0080
16 HNO3,aq 0.98525E-30 -30.0065 0.98525E-30 -30.0065 0.10000E+01 0.0000
17 NO3- 0.20000E-21 -21.6990 0.19636E-21 -21.7070 0.98178E+00 -0.0080
18 N2,aq 0.79915E-56 -56.0974 0.79911E-56 -56.0974 0.99996E+00 0.0000
19 N2O2-2 0.69723-105 -105.1566 0.68345-105 -105.1653 0.98023E+00 -0.0087
20 HN2O2- 0.69213-101 -101.1598 0.67952-101 -101.1678 0.98178E+00 -0.0080
21 H2N2O2,aq 0.74422-101 -101.1283 0.74422-101 -101.1283 0.10000E+01 0.0000
22 N2H5+ 0.18919-156 -156.7231 0.18574-156 -156.7311 0.98178E+00 -0.0080
23 N2H6+2 0.17910-164 -164.7469 0.17556-164 -164.7556 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34978-158 -158.4562 0.34977-158 -158.4562 0.99996E+00 0.0000
36 SO2,aq 0.76396E-70 -70.1169 0.76396E-70 -70.1169 0.10000E+01 0.0000
37 SO3-2 0.66335E-65 -65.1783 0.65023E-65 -65.1869 0.98023E+00 -0.0087
38 HSO3- 0.10680E-64 -64.9714 0.10485E-64 -64.9794 0.98178E+00 -0.0080
39 HSO4- 0.41367E-25 -25.3833 0.40613E-25 -25.3913 0.98178E+00 -0.0080
40 HSO5- 0.34733E-46 -46.4593 0.34101E-46 -46.4672 0.98178E+00 -0.0080
41 S2O3-2 0.93243-181 -181.0304 0.91400-181 -181.0391 0.98023E+00 -0.0087
42 HS2O3- 0.45335-186 -186.3436 0.44509-186 -186.3516 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17296-192 -192.7621 0.17296-192 -192.7621 0.10000E+01 0.0000
44 S2O4-2 0.17447-167 -167.7583 0.17102-167 -167.7670 0.98023E+00 -0.0087
45 HS2O4- 0.54517-172 -172.2635 0.53523-172 -172.2715 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12504-178 -178.9030 0.12504-178 -178.9030 0.10000E+01 0.0000
47 S2O5-2 0.17093-134 -134.7672 0.16755-134 -134.7759 0.98023E+00 -0.0087
48 S2O6-2 0.45489-104 -104.3421 0.44590-104 -104.3508 0.98023E+00 -0.0087
49 S2O8-2 0.90803E-79 -79.0419 0.89008E-79 -79.0506 0.98023E+00 -0.0087
Charge balance for all species = -.4547E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -22.0000
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8291-223 1.0000 0.2863-157 0.2863-157
S2,gas 0.0000E+00 1.0000 0.7687-258 0.7687-258
NO2,gas 0.2064-101 1.0000 0.7128E-36 0.7128E-36
SO3,gas 0.1656-123 1.0000 0.5717E-58 0.5717E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1262-150 1.0000 0.4357E-85 0.4357E-85
N2,gas 0.3560-118 1.0000 0.1229E-52 0.1229E-52
SO2,gas 0.1496-135 1.0000 0.5165E-70 0.5165E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 40.37 -36.15 -8.262 0.49315E+05 -36.147
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -74.32 -85.36 -42.680 0.11646E+06 -85.361
9 N2,gas 2.57 -50.34 -52.91 -6.827 0.72185E+05 -52.910
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.2035E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.2035E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43234E-20 -20.3642 0.42379E-20 -20.3728 0.98023E+00 -0.0087
5 HS- 0.36413-158 -158.4387 0.35749-158 -158.4467 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.97426E-81 -81.0113 0.95651E-81 -81.0193 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.54602E-83 -83.2628 0.54600E-83 -83.2628 0.99996E+00 0.0000
14 HNO2,aq 0.24973E-38 -38.6025 0.24973E-38 -38.6025 0.10000E+01 0.0000
15 NO2- 0.15065E-34 -34.8220 0.14790E-34 -34.8300 0.98178E+00 -0.0080
16 HNO3,aq 0.19705E-29 -29.7054 0.19705E-29 -29.7054 0.10000E+01 0.0000
17 NO3- 0.40000E-21 -21.3979 0.39271E-21 -21.4059 0.98178E+00 -0.0080
18 N2,aq 0.31966E-55 -55.4953 0.31964E-55 -55.4953 0.99996E+00 0.0000
19 N2O2-2 0.27889-104 -104.5546 0.27338-104 -104.5632 0.98023E+00 -0.0087
20 HN2O2- 0.27685-100 -100.5578 0.27181-100 -100.5657 0.98178E+00 -0.0080
21 H2N2O2,aq 0.29769-100 -100.5262 0.29769-100 -100.5262 0.10000E+01 0.0000
22 N2H5+ 0.75676-156 -156.1210 0.74298-156 -156.1290 0.98178E+00 -0.0080
23 N2H6+2 0.71639-164 -164.1449 0.70222-164 -164.1535 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34977-158 -158.4562 0.34976-158 -158.4562 0.99996E+00 0.0000
36 SO2,aq 0.76394E-70 -70.1169 0.76394E-70 -70.1169 0.10000E+01 0.0000
37 SO3-2 0.66333E-65 -65.1783 0.65022E-65 -65.1869 0.98023E+00 -0.0087
38 HSO3- 0.10679E-64 -64.9715 0.10485E-64 -64.9794 0.98178E+00 -0.0080
39 HSO4- 0.41366E-25 -25.3834 0.40612E-25 -25.3913 0.98178E+00 -0.0080
40 HSO5- 0.34733E-46 -46.4593 0.34100E-46 -46.4672 0.98178E+00 -0.0080
41 S2O3-2 0.93239-181 -181.0304 0.91396-181 -181.0391 0.98023E+00 -0.0087
42 HS2O3- 0.45333-186 -186.3436 0.44507-186 -186.3516 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17295-192 -192.7621 0.17295-192 -192.7621 0.10000E+01 0.0000
44 S2O4-2 0.17446-167 -167.7583 0.17101-167 -167.7670 0.98023E+00 -0.0087
45 HS2O4- 0.54514-172 -172.2635 0.53521-172 -172.2715 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12503-178 -178.9030 0.12503-178 -178.9030 0.10000E+01 0.0000
47 S2O5-2 0.17092-134 -134.7672 0.16754-134 -134.7759 0.98023E+00 -0.0087
48 S2O6-2 0.45487-104 -104.3421 0.44588-104 -104.3508 0.98023E+00 -0.0087
49 S2O8-2 0.90799E-79 -79.0419 0.89004E-79 -79.0506 0.98023E+00 -0.0087
Charge balance for all species = -.8548E-21
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.6990
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8290-223 1.0000 0.2863-157 0.2863-157
S2,gas 0.0000E+00 1.0000 0.7687-258 0.7687-258
NO2,gas 0.4129-101 1.0000 0.1426E-35 0.1426E-35
SO3,gas 0.1656-123 1.0000 0.5717E-58 0.5717E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2523-150 1.0000 0.8713E-85 0.8713E-85
N2,gas 0.1424-117 1.0000 0.4917E-52 0.4917E-52
SO2,gas 0.1496-135 1.0000 0.5165E-70 0.5165E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 40.67 -35.85 -8.193 0.48904E+05 -35.846
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -74.02 -85.06 -42.530 0.11605E+06 -85.060
9 N2,gas 2.57 -49.74 -52.31 -6.749 0.71363E+05 -52.308
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.1835E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.1835E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43233E-20 -20.3642 0.42378E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36412-158 -158.4388 0.35749-158 -158.4467 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.14614E-80 -80.8352 0.14348E-80 -80.8432 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.81903E-83 -83.0867 0.81899E-83 -83.0867 0.99996E+00 0.0000
14 HNO2,aq 0.37460E-38 -38.4264 0.37460E-38 -38.4264 0.10000E+01 0.0000
15 NO2- 0.22597E-34 -34.6459 0.22186E-34 -34.6539 0.98178E+00 -0.0080
16 HNO3,aq 0.29557E-29 -29.5293 0.29557E-29 -29.5293 0.10000E+01 0.0000
17 NO3- 0.60000E-21 -21.2218 0.58907E-21 -21.2298 0.98178E+00 -0.0080
18 N2,aq 0.71923E-55 -55.1431 0.71920E-55 -55.1431 0.99996E+00 0.0000
19 N2O2-2 0.62751-104 -104.2024 0.61510-104 -104.2111 0.98023E+00 -0.0087
20 HN2O2- 0.62292-100 -100.2056 0.61157-100 -100.2136 0.98178E+00 -0.0080
21 H2N2O2,aq 0.66980-100 -100.1741 0.66980-100 -100.1741 0.10000E+01 0.0000
22 N2H5+ 0.17027-155 -155.7689 0.16717-155 -155.7768 0.98178E+00 -0.0080
23 N2H6+2 0.16119-163 -163.7927 0.15800-163 -163.8013 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34977-158 -158.4562 0.34975-158 -158.4562 0.99996E+00 0.0000
36 SO2,aq 0.76392E-70 -70.1170 0.76392E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66332E-65 -65.1783 0.65020E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10679E-64 -64.9715 0.10485E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41365E-25 -25.3834 0.40611E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34732E-46 -46.4593 0.34099E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93235-181 -181.0304 0.91391-181 -181.0391 0.98023E+00 -0.0087
42 HS2O3- 0.45330-186 -186.3436 0.44505-186 -186.3516 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17294-192 -192.7621 0.17294-192 -192.7621 0.10000E+01 0.0000
44 S2O4-2 0.17445-167 -167.7583 0.17100-167 -167.7670 0.98023E+00 -0.0087
45 HS2O4- 0.54511-172 -172.2635 0.53518-172 -172.2715 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12503-178 -178.9030 0.12503-178 -178.9030 0.10000E+01 0.0000
47 S2O5-2 0.17091-134 -134.7672 0.16753-134 -134.7759 0.98023E+00 -0.0087
48 S2O6-2 0.45485-104 -104.3421 0.44586-104 -104.3508 0.98023E+00 -0.0087
49 S2O8-2 0.90794E-79 -79.0419 0.88999E-79 -79.0506 0.98023E+00 -0.0087
Charge balance for all species = 0.6517E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.5229
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8290-223 1.0000 0.2863-157 0.2863-157
S2,gas 0.0000E+00 1.0000 0.7686-258 0.7686-258
NO2,gas 0.6193-101 1.0000 0.2139E-35 0.2139E-35
SO3,gas 0.1656-123 1.0000 0.5717E-58 0.5717E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.3785-150 1.0000 0.1307E-84 0.1307E-84
N2,gas 0.3204-117 1.0000 0.1106E-51 0.1106E-51
SO2,gas 0.1496-135 1.0000 0.5165E-70 0.5165E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 40.85 -35.67 -8.153 0.48664E+05 -35.670
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.85 -84.88 -42.442 0.11581E+06 -84.884
9 N2,gas 2.57 -49.38 -51.96 -6.704 0.70883E+05 -51.956
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.1635E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.1635E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43232E-20 -20.3642 0.42377E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36411-158 -158.4388 0.35748-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.19485E-80 -80.7103 0.19130E-80 -80.7183 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.10920E-82 -82.9618 0.10920E-82 -82.9618 0.99996E+00 0.0000
14 HNO2,aq 0.49947E-38 -38.3015 0.49947E-38 -38.3015 0.10000E+01 0.0000
15 NO2- 0.30130E-34 -34.5210 0.29581E-34 -34.5290 0.98178E+00 -0.0080
16 HNO3,aq 0.39410E-29 -29.4044 0.39410E-29 -29.4044 0.10000E+01 0.0000
17 NO3- 0.80000E-21 -21.0969 0.78543E-21 -21.1049 0.98178E+00 -0.0080
18 N2,aq 0.12786E-54 -54.8933 0.12786E-54 -54.8933 0.99996E+00 0.0000
19 N2O2-2 0.11156-103 -103.9525 0.10935-103 -103.9612 0.98023E+00 -0.0087
20 HN2O2- 0.11074E-99 -99.9557 0.10872E-99 -99.9637 0.98178E+00 -0.0080
21 H2N2O2,aq 0.11908E-99 -99.9242 0.11908E-99 -99.9242 0.10000E+01 0.0000
22 N2H5+ 0.30271-155 -155.5190 0.29719-155 -155.5270 0.98178E+00 -0.0080
23 N2H6+2 0.28655-163 -163.5428 0.28089-163 -163.5515 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34976-158 -158.4562 0.34974-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76390E-70 -70.1170 0.76390E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66330E-65 -65.1783 0.65019E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10679E-64 -64.9715 0.10484E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41364E-25 -25.3834 0.40610E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34731E-46 -46.4593 0.34098E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93230-181 -181.0304 0.91387-181 -181.0391 0.98023E+00 -0.0087
42 HS2O3- 0.45328-186 -186.3436 0.44502-186 -186.3516 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17294-192 -192.7621 0.17294-192 -192.7621 0.10000E+01 0.0000
44 S2O4-2 0.17444-167 -167.7583 0.17099-167 -167.7670 0.98023E+00 -0.0087
45 HS2O4- 0.54509-172 -172.2635 0.53516-172 -172.2715 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12502-178 -178.9030 0.12502-178 -178.9030 0.10000E+01 0.0000
47 S2O5-2 0.17090-134 -134.7673 0.16752-134 -134.7759 0.98023E+00 -0.0087
48 S2O6-2 0.45483-104 -104.3422 0.44583-104 -104.3508 0.98023E+00 -0.0087
49 S2O8-2 0.90790E-79 -79.0420 0.88995E-79 -79.0506 0.98023E+00 -0.0087
Charge balance for all species = -.5143E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.3979
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8290-223 1.0000 0.2863-157 0.2863-157
S2,gas 0.0000E+00 1.0000 0.7686-258 0.7686-258
NO2,gas 0.8258-101 1.0000 0.2851E-35 0.2851E-35
SO3,gas 0.1656-123 1.0000 0.5717E-58 0.5717E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.5047-150 1.0000 0.1743E-84 0.1743E-84
N2,gas 0.5696-117 1.0000 0.1967E-51 0.1967E-51
SO2,gas 0.1496-135 1.0000 0.5165E-70 0.5165E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 40.97 -35.54 -8.125 0.48493E+05 -35.545
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.72 -84.76 -42.379 0.11564E+06 -84.759
9 N2,gas 2.57 -49.13 -51.71 -6.672 0.70542E+05 -51.706
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.1435E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.1435E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43231E-20 -20.3642 0.42376E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36410-158 -158.4388 0.35747-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.24356E-80 -80.6134 0.23913E-80 -80.6214 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.13650E-82 -82.8649 0.13650E-82 -82.8649 0.99996E+00 0.0000
14 HNO2,aq 0.62434E-38 -38.2046 0.62434E-38 -38.2046 0.10000E+01 0.0000
15 NO2- 0.37662E-34 -34.4241 0.36976E-34 -34.4321 0.98178E+00 -0.0080
16 HNO3,aq 0.49262E-29 -29.3075 0.49262E-29 -29.3075 0.10000E+01 0.0000
17 NO3- 0.10000E-20 -21.0000 0.98178E-21 -21.0080 0.98178E+00 -0.0080
18 N2,aq 0.19979E-54 -54.6994 0.19978E-54 -54.6995 0.99996E+00 0.0000
19 N2O2-2 0.17431-103 -103.7587 0.17086-103 -103.7674 0.98023E+00 -0.0087
20 HN2O2- 0.17303E-99 -99.7619 0.16988E-99 -99.7699 0.98178E+00 -0.0080
21 H2N2O2,aq 0.18606E-99 -99.7304 0.18606E-99 -99.7304 0.10000E+01 0.0000
22 N2H5+ 0.47298-155 -155.3252 0.46436-155 -155.3331 0.98178E+00 -0.0080
23 N2H6+2 0.44774-163 -163.3490 0.43889-163 -163.3576 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34975-158 -158.4562 0.34973-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76389E-70 -70.1170 0.76389E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66328E-65 -65.1783 0.65017E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10679E-64 -64.9715 0.10484E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41363E-25 -25.3834 0.40609E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34730E-46 -46.4593 0.34097E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93226-181 -181.0305 0.91383-181 -181.0391 0.98023E+00 -0.0087
42 HS2O3- 0.45326-186 -186.3437 0.44500-186 -186.3516 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17293-192 -192.7621 0.17293-192 -192.7621 0.10000E+01 0.0000
44 S2O4-2 0.17443-167 -167.7584 0.17099-167 -167.7670 0.98023E+00 -0.0087
45 HS2O4- 0.54506-172 -172.2636 0.53513-172 -172.2715 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12501-178 -178.9030 0.12501-178 -178.9030 0.10000E+01 0.0000
47 S2O5-2 0.17089-134 -134.7673 0.16752-134 -134.7759 0.98023E+00 -0.0087
48 S2O6-2 0.45480-104 -104.3422 0.44581-104 -104.3508 0.98023E+00 -0.0087
49 S2O8-2 0.90786E-79 -79.0420 0.88991E-79 -79.0507 0.98023E+00 -0.0087
Charge balance for all species = -.1464E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.3010
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8290-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7685-258 0.7685-258
NO2,gas 0.1032-100 1.0000 0.3564E-35 0.3564E-35
SO3,gas 0.1656-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.6309-150 1.0000 0.2178E-84 0.2178E-84
N2,gas 0.8899-117 1.0000 0.3073E-51 0.3073E-51
SO2,gas 0.1496-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.07 -35.45 -8.102 0.48361E+05 -35.448
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.62 -84.66 -42.331 0.11550E+06 -84.662
9 N2,gas 2.57 -48.94 -51.51 -6.647 0.70278E+05 -51.512
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.1235E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.1235E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43230E-20 -20.3642 0.42375E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36409-158 -158.4388 0.35746-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.29228E-80 -80.5342 0.28695E-80 -80.5422 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.16381E-82 -82.7857 0.16380E-82 -82.7857 0.99996E+00 0.0000
14 HNO2,aq 0.74920E-38 -38.1254 0.74920E-38 -38.1254 0.10000E+01 0.0000
15 NO2- 0.45194E-34 -34.3449 0.44371E-34 -34.3529 0.98178E+00 -0.0080
16 HNO3,aq 0.59115E-29 -29.2283 0.59115E-29 -29.2283 0.10000E+01 0.0000
17 NO3- 0.12000E-20 -20.9208 0.11781E-20 -20.9288 0.98178E+00 -0.0080
18 N2,aq 0.28769E-54 -54.5411 0.28768E-54 -54.5411 0.99996E+00 0.0000
19 N2O2-2 0.25100-103 -103.6003 0.24604-103 -103.6090 0.98023E+00 -0.0087
20 HN2O2- 0.24917E-99 -99.6035 0.24463E-99 -99.6115 0.98178E+00 -0.0080
21 H2N2O2,aq 0.26792E-99 -99.5720 0.26792E-99 -99.5720 0.10000E+01 0.0000
22 N2H5+ 0.68109-155 -155.1668 0.66868-155 -155.1748 0.98178E+00 -0.0080
23 N2H6+2 0.64475-163 -163.1906 0.63200-163 -163.1993 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34974-158 -158.4563 0.34973-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76387E-70 -70.1170 0.76387E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66327E-65 -65.1783 0.65016E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10678E-64 -64.9715 0.10484E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41362E-25 -25.3834 0.40608E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34729E-46 -46.4593 0.34097E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93221-181 -181.0305 0.91378-181 -181.0392 0.98023E+00 -0.0087
42 HS2O3- 0.45324-186 -186.3437 0.44498-186 -186.3517 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17292-192 -192.7622 0.17292-192 -192.7622 0.10000E+01 0.0000
44 S2O4-2 0.17443-167 -167.7584 0.17098-167 -167.7671 0.98023E+00 -0.0087
45 HS2O4- 0.54503-172 -172.2636 0.53511-172 -172.2716 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12501-178 -178.9031 0.12501-178 -178.9031 0.10000E+01 0.0000
47 S2O5-2 0.17089-134 -134.7673 0.16751-134 -134.7760 0.98023E+00 -0.0087
48 S2O6-2 0.45478-104 -104.3422 0.44579-104 -104.3509 0.98023E+00 -0.0087
49 S2O8-2 0.90781E-79 -79.0420 0.88987E-79 -79.0507 0.98023E+00 -0.0087
Charge balance for all species = 0.5908E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.2218
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8290-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7685-258 0.7685-258
NO2,gas 0.1239-100 1.0000 0.4277E-35 0.4277E-35
SO3,gas 0.1655-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.7570-150 1.0000 0.2614E-84 0.2614E-84
N2,gas 0.1281-116 1.0000 0.4425E-51 0.4425E-51
SO2,gas 0.1496-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.15 -35.37 -8.084 0.48253E+05 -35.369
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.54 -84.58 -42.291 0.11539E+06 -84.583
9 N2,gas 2.57 -48.78 -51.35 -6.626 0.70062E+05 -51.354
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95891E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.1035E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.1035E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43229E-20 -20.3642 0.42374E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36409-158 -158.4388 0.35745-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.34099E-80 -80.4673 0.33478E-80 -80.4752 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.19111E-82 -82.7187 0.19110E-82 -82.7187 0.99996E+00 0.0000
14 HNO2,aq 0.87407E-38 -38.0585 0.87407E-38 -38.0585 0.10000E+01 0.0000
15 NO2- 0.52727E-34 -34.2780 0.51766E-34 -34.2860 0.98178E+00 -0.0080
16 HNO3,aq 0.68967E-29 -29.1614 0.68967E-29 -29.1614 0.10000E+01 0.0000
17 NO3- 0.14000E-20 -20.8539 0.13745E-20 -20.8619 0.98178E+00 -0.0080
18 N2,aq 0.39158E-54 -54.4072 0.39156E-54 -54.4072 0.99996E+00 0.0000
19 N2O2-2 0.34164-103 -103.4664 0.33489-103 -103.4751 0.98023E+00 -0.0087
20 HN2O2- 0.33914E-99 -99.4696 0.33297E-99 -99.4776 0.98178E+00 -0.0080
21 H2N2O2,aq 0.36467E-99 -99.4381 0.36467E-99 -99.4381 0.10000E+01 0.0000
22 N2H5+ 0.92703-155 -155.0329 0.91015-155 -155.0409 0.98178E+00 -0.0080
23 N2H6+2 0.87757-163 -163.0567 0.86022-163 -163.0654 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34973-158 -158.4563 0.34972-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76385E-70 -70.1170 0.76385E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66325E-65 -65.1783 0.65014E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10678E-64 -64.9715 0.10484E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41361E-25 -25.3834 0.40607E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34728E-46 -46.4593 0.34096E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93217-181 -181.0305 0.91374-181 -181.0392 0.98023E+00 -0.0087
42 HS2O3- 0.45322-186 -186.3437 0.44496-186 -186.3517 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17291-192 -192.7622 0.17291-192 -192.7622 0.10000E+01 0.0000
44 S2O4-2 0.17442-167 -167.7584 0.17097-167 -167.7671 0.98023E+00 -0.0087
45 HS2O4- 0.54501-172 -172.2636 0.53508-172 -172.2716 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12500-178 -178.9031 0.12500-178 -178.9031 0.10000E+01 0.0000
47 S2O5-2 0.17088-134 -134.7673 0.16750-134 -134.7760 0.98023E+00 -0.0087
48 S2O6-2 0.45476-104 -104.3422 0.44577-104 -104.3509 0.98023E+00 -0.0087
49 S2O8-2 0.90777E-79 -79.0420 0.88982E-79 -79.0507 0.98023E+00 -0.0087
Charge balance for all species = -.5752E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.1549
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8289-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7685-258 0.7685-258
NO2,gas 0.1445-100 1.0000 0.4990E-35 0.4990E-35
SO3,gas 0.1655-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.8832-150 1.0000 0.3050E-84 0.3050E-84
N2,gas 0.1744-116 1.0000 0.6023E-51 0.6023E-51
SO2,gas 0.1496-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.21 -35.30 -8.069 0.48162E+05 -35.302
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.48 -84.52 -42.258 0.11530E+06 -84.516
9 N2,gas 2.57 -48.65 -51.22 -6.609 0.69879E+05 -51.220
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.8352E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.8352E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43228E-20 -20.3642 0.42373E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36408-158 -158.4388 0.35744-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.38970E-80 -80.4093 0.38260E-80 -80.4173 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.21841E-82 -82.6607 0.21840E-82 -82.6608 0.99996E+00 0.0000
14 HNO2,aq 0.99894E-38 -38.0005 0.99894E-38 -38.0005 0.10000E+01 0.0000
15 NO2- 0.60259E-34 -34.2200 0.59161E-34 -34.2280 0.98178E+00 -0.0080
16 HNO3,aq 0.78820E-29 -29.1034 0.78820E-29 -29.1034 0.10000E+01 0.0000
17 NO3- 0.16000E-20 -20.7959 0.15709E-20 -20.8039 0.98178E+00 -0.0080
18 N2,aq 0.51145E-54 -54.2912 0.51143E-54 -54.2912 0.99996E+00 0.0000
19 N2O2-2 0.44623-103 -103.3504 0.43741-103 -103.3591 0.98023E+00 -0.0087
20 HN2O2- 0.44296E-99 -99.3536 0.43489E-99 -99.3616 0.98178E+00 -0.0080
21 H2N2O2,aq 0.47630E-99 -99.3221 0.47630E-99 -99.3221 0.10000E+01 0.0000
22 N2H5+ 0.12108-154 -154.9169 0.11888-154 -154.9249 0.98178E+00 -0.0080
23 N2H6+2 0.11462-162 -162.9407 0.11236-162 -162.9494 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34972-158 -158.4563 0.34971-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76383E-70 -70.1170 0.76383E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66324E-65 -65.1783 0.65013E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10678E-64 -64.9715 0.10483E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41360E-25 -25.3834 0.40606E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34728E-46 -46.4593 0.34095E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93212-181 -181.0305 0.91369-181 -181.0392 0.98023E+00 -0.0087
42 HS2O3- 0.45320-186 -186.3437 0.44494-186 -186.3517 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17290-192 -192.7622 0.17290-192 -192.7622 0.10000E+01 0.0000
44 S2O4-2 0.17441-167 -167.7584 0.17096-167 -167.7671 0.98023E+00 -0.0087
45 HS2O4- 0.54498-172 -172.2636 0.53505-172 -172.2716 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12500-178 -178.9031 0.12500-178 -178.9031 0.10000E+01 0.0000
47 S2O5-2 0.17087-134 -134.7673 0.16749-134 -134.7760 0.98023E+00 -0.0087
48 S2O6-2 0.45474-104 -104.3422 0.44575-104 -104.3509 0.98023E+00 -0.0087
49 S2O8-2 0.90773E-79 -79.0420 0.88978E-79 -79.0507 0.98023E+00 -0.0087
Charge balance for all species = -.2059E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.0969
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8289-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7684-258 0.7684-258
NO2,gas 0.1652-100 1.0000 0.5703E-35 0.5703E-35
SO3,gas 0.1655-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1009-149 1.0000 0.3485E-84 0.3485E-84
N2,gas 0.2278-116 1.0000 0.7867E-51 0.7867E-51
SO2,gas 0.1496-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.27 -35.24 -8.056 0.48083E+05 -35.244
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.42 -84.46 -42.229 0.11522E+06 -84.458
9 N2,gas 2.57 -48.53 -51.10 -6.594 0.69721E+05 -51.104
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.6352E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.6352E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43227E-20 -20.3642 0.42372E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36407-158 -158.4388 0.35744-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.43842E-80 -80.3581 0.43043E-80 -80.3661 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.24571E-82 -82.6096 0.24570E-82 -82.6096 0.99996E+00 0.0000
14 HNO2,aq 0.11238E-37 -37.9493 0.11238E-37 -37.9493 0.10000E+01 0.0000
15 NO2- 0.67792E-34 -34.1688 0.66557E-34 -34.1768 0.98178E+00 -0.0080
16 HNO3,aq 0.88672E-29 -29.0522 0.88672E-29 -29.0522 0.10000E+01 0.0000
17 NO3- 0.18000E-20 -20.7447 0.17672E-20 -20.7527 0.98178E+00 -0.0080
18 N2,aq 0.64731E-54 -54.1889 0.64728E-54 -54.1889 0.99996E+00 0.0000
19 N2O2-2 0.56476-103 -103.2481 0.55359-103 -103.2568 0.98023E+00 -0.0087
20 HN2O2- 0.56063E-99 -99.2513 0.55041E-99 -99.2593 0.98178E+00 -0.0080
21 H2N2O2,aq 0.60282E-99 -99.2198 0.60282E-99 -99.2198 0.10000E+01 0.0000
22 N2H5+ 0.15324-154 -154.8146 0.15045-154 -154.8226 0.98178E+00 -0.0080
23 N2H6+2 0.14507-162 -162.8384 0.14220-162 -162.8471 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34972-158 -158.4563 0.34970-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76381E-70 -70.1170 0.76381E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66322E-65 -65.1783 0.65011E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10678E-64 -64.9715 0.10483E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41359E-25 -25.3834 0.40605E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34727E-46 -46.4593 0.34094E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93208-181 -181.0305 0.91365-181 -181.0392 0.98023E+00 -0.0087
42 HS2O3- 0.45317-186 -186.3437 0.44492-186 -186.3517 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17289-192 -192.7622 0.17289-192 -192.7622 0.10000E+01 0.0000
44 S2O4-2 0.17440-167 -167.7585 0.17095-167 -167.7671 0.98023E+00 -0.0087
45 HS2O4- 0.54496-172 -172.2636 0.53503-172 -172.2716 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12499-178 -178.9031 0.12499-178 -178.9031 0.10000E+01 0.0000
47 S2O5-2 0.17086-134 -134.7674 0.16748-134 -134.7760 0.98023E+00 -0.0087
48 S2O6-2 0.45472-104 -104.3423 0.44573-104 -104.3509 0.98023E+00 -0.0087
49 S2O8-2 0.90768E-79 -79.0421 0.88974E-79 -79.0507 0.98023E+00 -0.0087
Charge balance for all species = 0.5313E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.0458
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8289-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7684-258 0.7684-258
NO2,gas 0.1858-100 1.0000 0.6416E-35 0.6416E-35
SO3,gas 0.1655-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1136-149 1.0000 0.3921E-84 0.3921E-84
N2,gas 0.2883-116 1.0000 0.9956E-51 0.9956E-51
SO2,gas 0.1496-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.32 -35.19 -8.044 0.48013E+05 -35.193
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.37 -84.41 -42.203 0.11515E+06 -84.407
9 N2,gas 2.57 -48.43 -51.00 -6.581 0.69581E+05 -51.002
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.4352E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.4352E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43226E-20 -20.3643 0.42371E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36406-158 -158.4388 0.35743-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.48713E-80 -80.3124 0.47825E-80 -80.3203 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.27301E-82 -82.5638 0.27300E-82 -82.5638 0.99996E+00 0.0000
14 HNO2,aq 0.12487E-37 -37.9036 0.12487E-37 -37.9036 0.10000E+01 0.0000
15 NO2- 0.75324E-34 -34.1231 0.73952E-34 -34.1311 0.98178E+00 -0.0080
16 HNO3,aq 0.98525E-29 -29.0065 0.98525E-29 -29.0065 0.10000E+01 0.0000
17 NO3- 0.20000E-20 -20.6990 0.19636E-20 -20.7070 0.98178E+00 -0.0080
18 N2,aq 0.79915E-54 -54.0974 0.79911E-54 -54.0974 0.99996E+00 0.0000
19 N2O2-2 0.69723-103 -103.1566 0.68345-103 -103.1653 0.98023E+00 -0.0087
20 HN2O2- 0.69213E-99 -99.1598 0.67952E-99 -99.1678 0.98178E+00 -0.0080
21 H2N2O2,aq 0.74422E-99 -99.1283 0.74422E-99 -99.1283 0.10000E+01 0.0000
22 N2H5+ 0.18919-154 -154.7231 0.18574-154 -154.7311 0.98178E+00 -0.0080
23 N2H6+2 0.17910-162 -162.7469 0.17556-162 -162.7556 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34971-158 -158.4563 0.34969-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76379E-70 -70.1170 0.76379E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66321E-65 -65.1784 0.65009E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10677E-64 -64.9715 0.10483E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41358E-25 -25.3834 0.40604E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34726E-46 -46.4593 0.34093E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93203-181 -181.0306 0.91361-181 -181.0392 0.98023E+00 -0.0087
42 HS2O3- 0.45315-186 -186.3438 0.44490-186 -186.3517 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17289-192 -192.7622 0.17289-192 -192.7622 0.10000E+01 0.0000
44 S2O4-2 0.17439-167 -167.7585 0.17094-167 -167.7671 0.98023E+00 -0.0087
45 HS2O4- 0.54493-172 -172.2637 0.53500-172 -172.2716 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12498-178 -178.9031 0.12498-178 -178.9031 0.10000E+01 0.0000
47 S2O5-2 0.17085-134 -134.7674 0.16748-134 -134.7760 0.98023E+00 -0.0087
48 S2O6-2 0.45470-104 -104.3423 0.44571-104 -104.3510 0.98023E+00 -0.0087
49 S2O8-2 0.90764E-79 -79.0421 0.88970E-79 -79.0508 0.98023E+00 -0.0087
Charge balance for all species = -.6347E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -21.0000
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8289-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7684-258 0.7684-258
NO2,gas 0.2064-100 1.0000 0.7128E-35 0.7128E-35
SO3,gas 0.1655-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1262-149 1.0000 0.4357E-84 0.4357E-84
N2,gas 0.3560-116 1.0000 0.1229E-50 0.1229E-50
SO2,gas 0.1495-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.37 -35.15 -8.034 0.47951E+05 -35.147
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.32 -84.36 -42.180 0.11509E+06 -84.361
9 N2,gas 2.57 -48.34 -50.91 -6.569 0.69456E+05 -50.910
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.2352E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.2352E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43225E-20 -20.3643 0.42370E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36405-158 -158.4388 0.35742-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.53584E-80 -80.2710 0.52608E-80 -80.2789 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.30031E-82 -82.5224 0.30030E-82 -82.5224 0.99996E+00 0.0000
14 HNO2,aq 0.13735E-37 -37.8622 0.13735E-37 -37.8622 0.10000E+01 0.0000
15 NO2- 0.82856E-34 -34.0817 0.81347E-34 -34.0897 0.98178E+00 -0.0080
16 HNO3,aq 0.10838E-28 -28.9651 0.10838E-28 -28.9651 0.10000E+01 0.0000
17 NO3- 0.22000E-20 -20.6576 0.21599E-20 -20.6656 0.98178E+00 -0.0080
18 N2,aq 0.96697E-54 -54.0146 0.96693E-54 -54.0146 0.99996E+00 0.0000
19 N2O2-2 0.84365-103 -103.0738 0.82697-103 -103.0825 0.98023E+00 -0.0087
20 HN2O2- 0.83748E-99 -99.0770 0.82222E-99 -99.0850 0.98178E+00 -0.0080
21 H2N2O2,aq 0.90051E-99 -99.0455 0.90051E-99 -99.0455 0.10000E+01 0.0000
22 N2H5+ 0.22892-154 -154.6403 0.22475-154 -154.6483 0.98178E+00 -0.0080
23 N2H6+2 0.21671-162 -162.6641 0.21242-162 -162.6728 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34970-158 -158.4563 0.34968-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76378E-70 -70.1170 0.76378E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66319E-65 -65.1784 0.65008E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10677E-64 -64.9715 0.10483E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41357E-25 -25.3835 0.40603E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34725E-46 -46.4594 0.34093E-46 -46.4673 0.98178E+00 -0.0080
41 S2O3-2 0.93199-181 -181.0306 0.91356-181 -181.0393 0.98023E+00 -0.0087
42 HS2O3- 0.45313-186 -186.3438 0.44488-186 -186.3518 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17288-192 -192.7623 0.17288-192 -192.7623 0.10000E+01 0.0000
44 S2O4-2 0.17438-167 -167.7585 0.17094-167 -167.7672 0.98023E+00 -0.0087
45 HS2O4- 0.54490-172 -172.2637 0.53498-172 -172.2717 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12498-178 -178.9032 0.12498-178 -178.9032 0.10000E+01 0.0000
47 S2O5-2 0.17085-134 -134.7674 0.16747-134 -134.7761 0.98023E+00 -0.0087
48 S2O6-2 0.45467-104 -104.3423 0.44569-104 -104.3510 0.98023E+00 -0.0087
49 S2O8-2 0.90760E-79 -79.0421 0.88965E-79 -79.0508 0.98023E+00 -0.0087
Charge balance for all species = -.2655E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.9586
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8289-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7683-258 0.7683-258
NO2,gas 0.2271-100 1.0000 0.7841E-35 0.7841E-35
SO3,gas 0.1655-123 1.0000 0.5716E-58 0.5716E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1388-149 1.0000 0.4792E-84 0.4792E-84
N2,gas 0.4307-116 1.0000 0.1487E-50 0.1487E-50
SO2,gas 0.1495-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.41 -35.11 -8.024 0.47894E+05 -35.106
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.28 -84.32 -42.160 0.11504E+06 -84.319
9 N2,gas 2.57 -48.26 -50.83 -6.558 0.69343E+05 -50.828
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = -.3522E-22
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = -.3522E-22 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43224E-20 -20.3643 0.42369E-20 -20.3729 0.98023E+00 -0.0087
5 HS- 0.36404-158 -158.4388 0.35741-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.58456E-80 -80.2332 0.57391E-80 -80.2412 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.32761E-82 -82.4846 0.32760E-82 -82.4847 0.99996E+00 0.0000
14 HNO2,aq 0.14984E-37 -37.8244 0.14984E-37 -37.8244 0.10000E+01 0.0000
15 NO2- 0.90389E-34 -34.0439 0.88742E-34 -34.0519 0.98178E+00 -0.0080
16 HNO3,aq 0.11823E-28 -28.9273 0.11823E-28 -28.9273 0.10000E+01 0.0000
17 NO3- 0.24000E-20 -20.6198 0.23563E-20 -20.6278 0.98178E+00 -0.0080
18 N2,aq 0.11508E-53 -53.9390 0.11507E-53 -53.9390 0.99996E+00 0.0000
19 N2O2-2 0.10040-102 -102.9983 0.98416-103 -103.0069 0.98023E+00 -0.0087
20 HN2O2- 0.99667E-99 -99.0014 0.97851E-99 -99.0094 0.98178E+00 -0.0080
21 H2N2O2,aq 0.10717E-98 -98.9699 0.10717E-98 -98.9699 0.10000E+01 0.0000
22 N2H5+ 0.27243-154 -154.5647 0.26747-154 -154.5727 0.98178E+00 -0.0080
23 N2H6+2 0.25790-162 -162.5886 0.25280-162 -162.5972 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34969-158 -158.4563 0.34968-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76376E-70 -70.1170 0.76376E-70 -70.1170 0.10000E+01 0.0000
37 SO3-2 0.66317E-65 -65.1784 0.65006E-65 -65.1870 0.98023E+00 -0.0087
38 HSO3- 0.10677E-64 -64.9716 0.10482E-64 -64.9795 0.98178E+00 -0.0080
39 HSO4- 0.41356E-25 -25.3835 0.40602E-25 -25.3914 0.98178E+00 -0.0080
40 HSO5- 0.34724E-46 -46.4594 0.34092E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93194-181 -181.0306 0.91352-181 -181.0393 0.98023E+00 -0.0087
42 HS2O3- 0.45311-186 -186.3438 0.44485-186 -186.3518 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17287-192 -192.7623 0.17287-192 -192.7623 0.10000E+01 0.0000
44 S2O4-2 0.17438-167 -167.7585 0.17093-167 -167.7672 0.98023E+00 -0.0087
45 HS2O4- 0.54488-172 -172.2637 0.53495-172 -172.2717 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12497-178 -178.9032 0.12497-178 -178.9032 0.10000E+01 0.0000
47 S2O5-2 0.17084-134 -134.7674 0.16746-134 -134.7761 0.98023E+00 -0.0087
48 S2O6-2 0.45465-104 -104.3423 0.44566-104 -104.3510 0.98023E+00 -0.0087
49 S2O8-2 0.90755E-79 -79.0421 0.88961E-79 -79.0508 0.98023E+00 -0.0087
Charge balance for all species = 0.4717E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.9208
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8288-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7683-258 0.7683-258
NO2,gas 0.2477-100 1.0000 0.8554E-35 0.8554E-35
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1514-149 1.0000 0.5228E-84 0.5228E-84
N2,gas 0.5126-116 1.0000 0.1770E-50 0.1770E-50
SO2,gas 0.1495-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.45 -35.07 -8.016 0.47843E+05 -35.068
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.24 -84.28 -42.141 0.11498E+06 -84.282
9 N2,gas 2.57 -48.18 -50.75 -6.549 0.69240E+05 -50.752
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.1648E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.1648E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43223E-20 -20.3643 0.42368E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36403-158 -158.4389 0.35740-158 -158.4468 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.63327E-80 -80.1984 0.62173E-80 -80.2064 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.35491E-82 -82.4499 0.35490E-82 -82.4499 0.99996E+00 0.0000
14 HNO2,aq 0.16233E-37 -37.7896 0.16233E-37 -37.7896 0.10000E+01 0.0000
15 NO2- 0.97921E-34 -34.0091 0.96137E-34 -34.0171 0.98178E+00 -0.0080
16 HNO3,aq 0.12808E-28 -28.8925 0.12808E-28 -28.8925 0.10000E+01 0.0000
17 NO3- 0.26000E-20 -20.5850 0.25526E-20 -20.5930 0.98178E+00 -0.0080
18 N2,aq 0.13506E-53 -53.8695 0.13505E-53 -53.8695 0.99996E+00 0.0000
19 N2O2-2 0.11783-102 -102.9287 0.11550-102 -102.9374 0.98023E+00 -0.0087
20 HN2O2- 0.11697E-98 -98.9319 0.11484E-98 -98.9399 0.98178E+00 -0.0080
21 H2N2O2,aq 0.12577E-98 -98.9004 0.12577E-98 -98.9004 0.10000E+01 0.0000
22 N2H5+ 0.31973-154 -154.4952 0.31391-154 -154.5032 0.98178E+00 -0.0080
23 N2H6+2 0.30267-162 -162.5190 0.29669-162 -162.5277 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34968-158 -158.4563 0.34967-158 -158.4563 0.99996E+00 0.0000
36 SO2,aq 0.76374E-70 -70.1171 0.76374E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66316E-65 -65.1784 0.65005E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10677E-64 -64.9716 0.10482E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41355E-25 -25.3835 0.40601E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34723E-46 -46.4594 0.34091E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93190-181 -181.0306 0.91348-181 -181.0393 0.98023E+00 -0.0087
42 HS2O3- 0.45309-186 -186.3438 0.44483-186 -186.3518 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17286-192 -192.7623 0.17286-192 -192.7623 0.10000E+01 0.0000
44 S2O4-2 0.17437-167 -167.7585 0.17092-167 -167.7672 0.98023E+00 -0.0087
45 HS2O4- 0.54485-172 -172.2637 0.53493-172 -172.2717 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12497-178 -178.9032 0.12497-178 -178.9032 0.10000E+01 0.0000
47 S2O5-2 0.17083-134 -134.7674 0.16745-134 -134.7761 0.98023E+00 -0.0087
48 S2O6-2 0.45463-104 -104.3423 0.44564-104 -104.3510 0.98023E+00 -0.0087
49 S2O8-2 0.90751E-79 -79.0421 0.88957E-79 -79.0508 0.98023E+00 -0.0087
Charge balance for all species = -.6943E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.8861
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8288-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7683-258 0.7683-258
NO2,gas 0.2684-100 1.0000 0.9267E-35 0.9267E-35
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1640-149 1.0000 0.5664E-84 0.5664E-84
N2,gas 0.6016-116 1.0000 0.2077E-50 0.2077E-50
SO2,gas 0.1495-135 1.0000 0.5164E-70 0.5164E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.114
5 NO2,gas 76.52 41.48 -35.03 -8.008 0.47795E+05 -35.033
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.21 -84.25 -42.123 0.11494E+06 -84.247
9 N2,gas 2.57 -48.11 -50.68 -6.540 0.69145E+05 -50.683
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.3648E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.3648E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43222E-20 -20.3643 0.42367E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36402-158 -158.4389 0.35739-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.68198E-80 -80.1662 0.66956E-80 -80.1742 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.38221E-82 -82.4177 0.38220E-82 -82.4177 0.99996E+00 0.0000
14 HNO2,aq 0.17481E-37 -37.7574 0.17481E-37 -37.7574 0.10000E+01 0.0000
15 NO2- 0.10545E-33 -33.9769 0.10353E-33 -33.9849 0.98178E+00 -0.0080
16 HNO3,aq 0.13793E-28 -28.8603 0.13793E-28 -28.8603 0.10000E+01 0.0000
17 NO3- 0.28000E-20 -20.5528 0.27490E-20 -20.5608 0.98178E+00 -0.0080
18 N2,aq 0.15663E-53 -53.8051 0.15663E-53 -53.8051 0.99996E+00 0.0000
19 N2O2-2 0.13666-102 -102.8644 0.13396-102 -102.8730 0.98023E+00 -0.0087
20 HN2O2- 0.13566E-98 -98.8676 0.13319E-98 -98.8755 0.98178E+00 -0.0080
21 H2N2O2,aq 0.14587E-98 -98.8360 0.14587E-98 -98.8360 0.10000E+01 0.0000
22 N2H5+ 0.37081-154 -154.4308 0.36406-154 -154.4388 0.98178E+00 -0.0080
23 N2H6+2 0.35103-162 -162.4547 0.34409-162 -162.4633 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34967-158 -158.4563 0.34966-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76372E-70 -70.1171 0.76372E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66314E-65 -65.1784 0.65003E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10676E-64 -64.9716 0.10482E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41354E-25 -25.3835 0.40600E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34723E-46 -46.4594 0.34090E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93186-181 -181.0307 0.91343-181 -181.0393 0.98023E+00 -0.0087
42 HS2O3- 0.45307-186 -186.3438 0.44481-186 -186.3518 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17285-192 -192.7623 0.17285-192 -192.7623 0.10000E+01 0.0000
44 S2O4-2 0.17436-167 -167.7586 0.17091-167 -167.7672 0.98023E+00 -0.0087
45 HS2O4- 0.54483-172 -172.2637 0.53490-172 -172.2717 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12496-178 -178.9032 0.12496-178 -178.9032 0.10000E+01 0.0000
47 S2O5-2 0.17082-134 -134.7675 0.16744-134 -134.7761 0.98023E+00 -0.0087
48 S2O6-2 0.45461-104 -104.3424 0.44562-104 -104.3510 0.98023E+00 -0.0087
49 S2O8-2 0.90747E-79 -79.0422 0.88953E-79 -79.0508 0.98023E+00 -0.0087
Charge balance for all species = -.3264E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.8539
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8288-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7682-258 0.7682-258
NO2,gas 0.2890-100 1.0000 0.9980E-35 0.9980E-35
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1766-149 1.0000 0.6099E-84 0.6099E-84
N2,gas 0.6977-116 1.0000 0.2409E-50 0.2409E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.52 -35.00 -8.000 0.47751E+05 -35.001
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.18 -84.21 -42.107 0.11489E+06 -84.215
9 N2,gas 2.57 -48.05 -50.62 -6.531 0.69058E+05 -50.618
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.5648E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.5648E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43221E-20 -20.3643 0.42366E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36402-158 -158.4389 0.35738-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.73069E-80 -80.1363 0.71738E-80 -80.1442 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.40951E-82 -82.3877 0.40950E-82 -82.3877 0.99996E+00 0.0000
14 HNO2,aq 0.18730E-37 -37.7275 0.18730E-37 -37.7275 0.10000E+01 0.0000
15 NO2- 0.11299E-33 -33.9470 0.11093E-33 -33.9550 0.98178E+00 -0.0080
16 HNO3,aq 0.14779E-28 -28.8304 0.14779E-28 -28.8304 0.10000E+01 0.0000
17 NO3- 0.30000E-20 -20.5229 0.29453E-20 -20.5309 0.98178E+00 -0.0080
18 N2,aq 0.17981E-53 -53.7452 0.17980E-53 -53.7452 0.99996E+00 0.0000
19 N2O2-2 0.15688-102 -102.8044 0.15378-102 -102.8131 0.98023E+00 -0.0087
20 HN2O2- 0.15573E-98 -98.8076 0.15289E-98 -98.8156 0.98178E+00 -0.0080
21 H2N2O2,aq 0.16745E-98 -98.7761 0.16745E-98 -98.7761 0.10000E+01 0.0000
22 N2H5+ 0.42568-154 -154.3709 0.41792-154 -154.3789 0.98178E+00 -0.0080
23 N2H6+2 0.40297-162 -162.3947 0.39500-162 -162.4034 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34967-158 -158.4563 0.34965-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76370E-70 -70.1171 0.76370E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66313E-65 -65.1784 0.65002E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10676E-64 -64.9716 0.10482E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41353E-25 -25.3835 0.40600E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34722E-46 -46.4594 0.34089E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93181-181 -181.0307 0.91339-181 -181.0393 0.98023E+00 -0.0087
42 HS2O3- 0.45304-186 -186.3439 0.44479-186 -186.3518 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17284-192 -192.7623 0.17284-192 -192.7623 0.10000E+01 0.0000
44 S2O4-2 0.17435-167 -167.7586 0.17090-167 -167.7672 0.98023E+00 -0.0087
45 HS2O4- 0.54480-172 -172.2638 0.53488-172 -172.2717 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12495-178 -178.9032 0.12495-178 -178.9032 0.10000E+01 0.0000
47 S2O5-2 0.17081-134 -134.7675 0.16744-134 -134.7762 0.98023E+00 -0.0087
48 S2O6-2 0.45459-104 -104.3424 0.44560-104 -104.3511 0.98023E+00 -0.0087
49 S2O8-2 0.90742E-79 -79.0422 0.88948E-79 -79.0509 0.98023E+00 -0.0087
Charge balance for all species = 0.4108E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.8239
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8288-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7682-258 0.7682-258
NO2,gas 0.3097-100 1.0000 0.1069E-34 0.1069E-34
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.1893-149 1.0000 0.6535E-84 0.6535E-84
N2,gas 0.8009-116 1.0000 0.2766E-50 0.2766E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.55 -34.97 -7.993 0.47710E+05 -34.971
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.15 -84.18 -42.092 0.11485E+06 -84.185
9 N2,gas 2.57 -47.99 -50.56 -6.524 0.68976E+05 -50.558
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.7648E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.7648E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43220E-20 -20.3643 0.42365E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36401-158 -158.4389 0.35738-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.77941E-80 -80.1082 0.76521E-80 -80.1162 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.43681E-82 -82.3597 0.43680E-82 -82.3597 0.99996E+00 0.0000
14 HNO2,aq 0.19979E-37 -37.6994 0.19979E-37 -37.6994 0.10000E+01 0.0000
15 NO2- 0.12052E-33 -33.9189 0.11832E-33 -33.9269 0.98178E+00 -0.0080
16 HNO3,aq 0.15764E-28 -28.8023 0.15764E-28 -28.8023 0.10000E+01 0.0000
17 NO3- 0.32000E-20 -20.4949 0.31417E-20 -20.5028 0.98178E+00 -0.0080
18 N2,aq 0.20458E-53 -53.6891 0.20457E-53 -53.6892 0.99996E+00 0.0000
19 N2O2-2 0.17849-102 -102.7484 0.17496-102 -102.7571 0.98023E+00 -0.0087
20 HN2O2- 0.17719E-98 -98.7516 0.17396E-98 -98.7596 0.98178E+00 -0.0080
21 H2N2O2,aq 0.19052E-98 -98.7201 0.19052E-98 -98.7201 0.10000E+01 0.0000
22 N2H5+ 0.48433-154 -154.3149 0.47550-154 -154.3228 0.98178E+00 -0.0080
23 N2H6+2 0.45849-162 -162.3387 0.44942-162 -162.3473 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34966-158 -158.4564 0.34964-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76368E-70 -70.1171 0.76368E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66311E-65 -65.1784 0.65000E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10676E-64 -64.9716 0.10481E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41352E-25 -25.3835 0.40599E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34721E-46 -46.4594 0.34088E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93177-181 -181.0307 0.91335-181 -181.0394 0.98023E+00 -0.0087
42 HS2O3- 0.45302-186 -186.3439 0.44477-186 -186.3519 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17284-192 -192.7624 0.17284-192 -192.7624 0.10000E+01 0.0000
44 S2O4-2 0.17434-167 -167.7586 0.17090-167 -167.7673 0.98023E+00 -0.0087
45 HS2O4- 0.54477-172 -172.2638 0.53485-172 -172.2718 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12495-178 -178.9033 0.12495-178 -178.9033 0.10000E+01 0.0000
47 S2O5-2 0.17080-134 -134.7675 0.16743-134 -134.7762 0.98023E+00 -0.0087
48 S2O6-2 0.45457-104 -104.3424 0.44558-104 -104.3511 0.98023E+00 -0.0087
49 S2O8-2 0.90738E-79 -79.0422 0.88944E-79 -79.0509 0.98023E+00 -0.0087
Charge balance for all species = -.7552E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.7959
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8288-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7681-258 0.7681-258
NO2,gas 0.3303-100 1.0000 0.1141E-34 0.1141E-34
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2019-149 1.0000 0.6971E-84 0.6971E-84
N2,gas 0.9113-116 1.0000 0.3147E-50 0.3147E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.57 -34.94 -7.987 0.47672E+05 -34.943
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.12 -84.16 -42.078 0.11481E+06 -84.157
9 N2,gas 2.57 -47.93 -50.50 -6.516 0.68899E+05 -50.502
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.9648E-21
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.9648E-21 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43219E-20 -20.3643 0.42364E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36400-158 -158.4389 0.35737-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.82812E-80 -80.0819 0.81303E-80 -80.0899 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.46412E-82 -82.3334 0.46410E-82 -82.3334 0.99996E+00 0.0000
14 HNO2,aq 0.21227E-37 -37.6731 0.21227E-37 -37.6731 0.10000E+01 0.0000
15 NO2- 0.12805E-33 -33.8926 0.12572E-33 -33.9006 0.98178E+00 -0.0080
16 HNO3,aq 0.16749E-28 -28.7760 0.16749E-28 -28.7760 0.10000E+01 0.0000
17 NO3- 0.34000E-20 -20.4685 0.33381E-20 -20.4765 0.98178E+00 -0.0080
18 N2,aq 0.23095E-53 -53.6365 0.23094E-53 -53.6365 0.99996E+00 0.0000
19 N2O2-2 0.20150-102 -102.6957 0.19752-102 -102.7044 0.98023E+00 -0.0087
20 HN2O2- 0.20003E-98 -98.6989 0.19638E-98 -98.7069 0.98178E+00 -0.0080
21 H2N2O2,aq 0.21508E-98 -98.6674 0.21508E-98 -98.6674 0.10000E+01 0.0000
22 N2H5+ 0.54676-154 -154.2622 0.53680-154 -154.2702 0.98178E+00 -0.0080
23 N2H6+2 0.51759-162 -162.2860 0.50736-162 -162.2947 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34965-158 -158.4564 0.34963-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76367E-70 -70.1171 0.76367E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66309E-65 -65.1784 0.64999E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10676E-64 -64.9716 0.10481E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41351E-25 -25.3835 0.40598E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34720E-46 -46.4594 0.34088E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93172-181 -181.0307 0.91330-181 -181.0394 0.98023E+00 -0.0087
42 HS2O3- 0.45300-186 -186.3439 0.44475-186 -186.3519 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17283-192 -192.7624 0.17283-192 -192.7624 0.10000E+01 0.0000
44 S2O4-2 0.17433-167 -167.7586 0.17089-167 -167.7673 0.98023E+00 -0.0087
45 HS2O4- 0.54475-172 -172.2638 0.53482-172 -172.2718 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12494-178 -178.9033 0.12494-178 -178.9033 0.10000E+01 0.0000
47 S2O5-2 0.17080-134 -134.7675 0.16742-134 -134.7762 0.98023E+00 -0.0087
48 S2O6-2 0.45454-104 -104.3424 0.44556-104 -104.3511 0.98023E+00 -0.0087
49 S2O8-2 0.90734E-79 -79.0422 0.88940E-79 -79.0509 0.98023E+00 -0.0087
Charge balance for all species = -.3859E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.7696
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.1110E-15 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1389E-59 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8287-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7681-258 0.7681-258
NO2,gas 0.3510-100 1.0000 0.1212E-34 0.1212E-34
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2145-149 1.0000 0.7406E-84 0.7406E-84
N2,gas 0.1029-115 1.0000 0.3552E-50 0.3552E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.60 -34.92 -7.981 0.47636E+05 -34.917
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.09 -84.13 -42.065 0.11478E+06 -84.130
9 N2,gas 2.57 -47.88 -50.45 -6.510 0.68828E+05 -50.449
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.1165E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.1165E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43218E-20 -20.3643 0.42363E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36399-158 -158.4389 0.35736-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.87683E-80 -80.0571 0.86086E-80 -80.0651 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.49142E-82 -82.3086 0.49140E-82 -82.3086 0.99996E+00 0.0000
14 HNO2,aq 0.22476E-37 -37.6483 0.22476E-37 -37.6483 0.10000E+01 0.0000
15 NO2- 0.13558E-33 -33.8678 0.13311E-33 -33.8758 0.98178E+00 -0.0080
16 HNO3,aq 0.17734E-28 -28.7512 0.17734E-28 -28.7512 0.10000E+01 0.0000
17 NO3- 0.36000E-20 -20.4437 0.35344E-20 -20.4517 0.98178E+00 -0.0080
18 N2,aq 0.25892E-53 -53.5868 0.25891E-53 -53.5868 0.99996E+00 0.0000
19 N2O2-2 0.22590-102 -102.6461 0.22144-102 -102.6548 0.98023E+00 -0.0087
20 HN2O2- 0.22425E-98 -98.6493 0.22017E-98 -98.6573 0.98178E+00 -0.0080
21 H2N2O2,aq 0.24113E-98 -98.6178 0.24113E-98 -98.6178 0.10000E+01 0.0000
22 N2H5+ 0.61298-154 -154.2126 0.60181-154 -154.2205 0.98178E+00 -0.0080
23 N2H6+2 0.58027-162 -162.2364 0.56880-162 -162.2450 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34964-158 -158.4564 0.34963-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76365E-70 -70.1171 0.76365E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66308E-65 -65.1784 0.64997E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10675E-64 -64.9716 0.10481E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41350E-25 -25.3835 0.40597E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34719E-46 -46.4594 0.34087E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93168-181 -181.0307 0.91326-181 -181.0394 0.98023E+00 -0.0087
42 HS2O3- 0.45298-186 -186.3439 0.44473-186 -186.3519 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17282-192 -192.7624 0.17282-192 -192.7624 0.10000E+01 0.0000
44 S2O4-2 0.17433-167 -167.7586 0.17088-167 -167.7673 0.98023E+00 -0.0087
45 HS2O4- 0.54472-172 -172.2638 0.53480-172 -172.2718 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12494-178 -178.9033 0.12494-178 -178.9033 0.10000E+01 0.0000
47 S2O5-2 0.17079-134 -134.7675 0.16741-134 -134.7762 0.98023E+00 -0.0087
48 S2O6-2 0.45452-104 -104.3424 0.44554-104 -104.3511 0.98023E+00 -0.0087
49 S2O8-2 0.90729E-79 -79.0423 0.88936E-79 -79.0509 0.98023E+00 -0.0087
Charge balance for all species = 0.3513E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.7447
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8287-223 1.0000 0.2862-157 0.2862-157
S2,gas 0.0000E+00 1.0000 0.7681-258 0.7681-258
NO2,gas 0.3716-100 1.0000 0.1283E-34 0.1283E-34
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2271-149 1.0000 0.7842E-84 0.7842E-84
N2,gas 0.1153-115 1.0000 0.3982E-50 0.3982E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.62 -34.89 -7.975 0.47602E+05 -34.892
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.07 -84.11 -42.053 0.11474E+06 -84.106
9 N2,gas 2.57 -47.83 -50.40 -6.503 0.68760E+05 -50.400
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.1365E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.1365E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43217E-20 -20.3643 0.42362E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36398-158 -158.4389 0.35735-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.92555E-80 -80.0336 0.90868E-80 -80.0416 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.51872E-82 -82.2851 0.51870E-82 -82.2851 0.99996E+00 0.0000
14 HNO2,aq 0.23725E-37 -37.6248 0.23725E-37 -37.6248 0.10000E+01 0.0000
15 NO2- 0.14312E-33 -33.8443 0.14051E-33 -33.8523 0.98178E+00 -0.0080
16 HNO3,aq 0.18720E-28 -28.7277 0.18720E-28 -28.7277 0.10000E+01 0.0000
17 NO3- 0.38000E-20 -20.4202 0.37308E-20 -20.4282 0.98178E+00 -0.0080
18 N2,aq 0.28849E-53 -53.5399 0.28848E-53 -53.5399 0.99996E+00 0.0000
19 N2O2-2 0.25170-102 -102.5991 0.24672-102 -102.6078 0.98023E+00 -0.0087
20 HN2O2- 0.24986E-98 -98.6023 0.24531E-98 -98.6103 0.98178E+00 -0.0080
21 H2N2O2,aq 0.26867E-98 -98.5708 0.26867E-98 -98.5708 0.10000E+01 0.0000
22 N2H5+ 0.68298-154 -154.1656 0.67054-154 -154.1736 0.98178E+00 -0.0080
23 N2H6+2 0.64654-162 -162.1894 0.63376-162 -162.1981 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34963-158 -158.4564 0.34962-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76363E-70 -70.1171 0.76363E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66306E-65 -65.1784 0.64995E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10675E-64 -64.9716 0.10481E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41349E-25 -25.3835 0.40596E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34718E-46 -46.4594 0.34086E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93163-181 -181.0308 0.91321-181 -181.0394 0.98023E+00 -0.0087
42 HS2O3- 0.45296-186 -186.3439 0.44471-186 -186.3519 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17281-192 -192.7624 0.17281-192 -192.7624 0.10000E+01 0.0000
44 S2O4-2 0.17432-167 -167.7587 0.17087-167 -167.7673 0.98023E+00 -0.0087
45 HS2O4- 0.54470-172 -172.2638 0.53477-172 -172.2718 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12493-178 -178.9033 0.12493-178 -178.9033 0.10000E+01 0.0000
47 S2O5-2 0.17078-134 -134.7676 0.16740-134 -134.7762 0.98023E+00 -0.0087
48 S2O6-2 0.45450-104 -104.3425 0.44551-104 -104.3511 0.98023E+00 -0.0087
49 S2O8-2 0.90725E-79 -79.0423 0.88931E-79 -79.0509 0.98023E+00 -0.0087
Charge balance for all species = -.8147E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.7212
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8287-223 1.0000 0.2861-157 0.2861-157
S2,gas 0.0000E+00 1.0000 0.7680-258 0.7680-258
NO2,gas 0.3922-100 1.0000 0.1354E-34 0.1354E-34
SO3,gas 0.1655-123 1.0000 0.5715E-58 0.5715E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2397-149 1.0000 0.8278E-84 0.8278E-84
N2,gas 0.1285-115 1.0000 0.4437E-50 0.4437E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.65 -34.87 -7.970 0.47570E+05 -34.868
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.04 -84.08 -42.041 0.11471E+06 -84.082
9 N2,gas 2.57 -47.78 -50.35 -6.497 0.68696E+05 -50.353
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.1565E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.1565E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43216E-20 -20.3644 0.42361E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36397-158 -158.4389 0.35734-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.97426E-80 -80.0113 0.95651E-80 -80.0193 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.54602E-82 -82.2628 0.54600E-82 -82.2628 0.99996E+00 0.0000
14 HNO2,aq 0.24973E-37 -37.6025 0.24973E-37 -37.6025 0.10000E+01 0.0000
15 NO2- 0.15065E-33 -33.8220 0.14790E-33 -33.8300 0.98178E+00 -0.0080
16 HNO3,aq 0.19705E-28 -28.7054 0.19705E-28 -28.7054 0.10000E+01 0.0000
17 NO3- 0.40000E-20 -20.3979 0.39271E-20 -20.4059 0.98178E+00 -0.0080
18 N2,aq 0.31966E-53 -53.4953 0.31964E-53 -53.4953 0.99996E+00 0.0000
19 N2O2-2 0.27889-102 -102.5546 0.27338-102 -102.5632 0.98023E+00 -0.0087
20 HN2O2- 0.27685E-98 -98.5578 0.27181E-98 -98.5657 0.98178E+00 -0.0080
21 H2N2O2,aq 0.29769E-98 -98.5262 0.29769E-98 -98.5262 0.10000E+01 0.0000
22 N2H5+ 0.75676-154 -154.1210 0.74298-154 -154.1290 0.98178E+00 -0.0080
23 N2H6+2 0.71639-162 -162.1449 0.70222-162 -162.1535 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34962-158 -158.4564 0.34961-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76361E-70 -70.1171 0.76361E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66305E-65 -65.1785 0.64994E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10675E-64 -64.9716 0.10480E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41348E-25 -25.3835 0.40595E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34718E-46 -46.4594 0.34085E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93159-181 -181.0308 0.91317-181 -181.0394 0.98023E+00 -0.0087
42 HS2O3- 0.45294-186 -186.3440 0.44468-186 -186.3519 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17280-192 -192.7624 0.17280-192 -192.7624 0.10000E+01 0.0000
44 S2O4-2 0.17431-167 -167.7587 0.17086-167 -167.7674 0.98023E+00 -0.0087
45 HS2O4- 0.54467-172 -172.2639 0.53475-172 -172.2719 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12492-178 -178.9034 0.12492-178 -178.9034 0.10000E+01 0.0000
47 S2O5-2 0.17077-134 -134.7676 0.16740-134 -134.7763 0.98023E+00 -0.0087
48 S2O6-2 0.45448-104 -104.3425 0.44549-104 -104.3512 0.98023E+00 -0.0087
49 S2O8-2 0.90721E-79 -79.0423 0.88927E-79 -79.0510 0.98023E+00 -0.0087
Charge balance for all species = -.4455E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.6990
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8287-223 1.0000 0.2861-157 0.2861-157
S2,gas 0.0000E+00 1.0000 0.7680-258 0.7680-258
NO2,gas 0.4129-100 1.0000 0.1426E-34 0.1426E-34
SO3,gas 0.1655-123 1.0000 0.5714E-58 0.5714E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2523-149 1.0000 0.8713E-84 0.8713E-84
N2,gas 0.1424-115 1.0000 0.4917E-50 0.4917E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.67 -34.85 -7.965 0.47540E+05 -34.846
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.02 -84.06 -42.030 0.11468E+06 -84.060
9 N2,gas 2.57 -47.74 -50.31 -6.491 0.68635E+05 -50.308
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.1765E-20
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Merapi workup for air saturated water (ASW). Oxygen part already done in Solveq.
Now add N2
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
Number of loops used = 6 Loop limit = 400
Temperature = 25.00 C Pressure = 1.00 bar Mixer fraction = 0.0000000
Water: Moles liquid = 0.5551E+02 kg liquid = 0.1000E+01
Moles total = 0.5551E+02 kg total = 0.1000E+01 Activity = 1.0000
Stoichiometric ionic strength = .1801000E-03 Osmotic coef. = 0.9898
True ionic strength = .2024437E-06
Chg. balance for total moles = 0.1765E-20 Max. difference allowed = 0.1000E-10
Log Log Log
Species(n) Molality Molality Activity Activity Gamma Gamma
1 H+ 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
2 H2O 0.10000E+01 0.0000 0.10000E+01 0.0000
3 Cl- 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
4 SO4-- 0.43215E-20 -20.3644 0.42360E-20 -20.3730 0.98023E+00 -0.0087
5 HS- 0.36396-158 -158.4389 0.35733-158 -158.4469 0.98178E+00 -0.0080
6 Na+ 0.10000E-06 -7.0000 0.98178E-07 -7.0080 0.98178E+00 -0.0080
7 NH4+ 0.10230E-79 -79.9901 0.10043E-79 -79.9981 0.98178E+00 -0.0080
8 HCl,aq 0.19254E-14 -14.7155 0.19254E-14 -14.7155 0.10000E+01 0.0000
9 HClO,aq 0.42915E-23 -23.3674 0.42915E-23 -23.3674 0.10000E+01 0.0000
10 ClO- 0.12249E-23 -23.9119 0.12026E-23 -23.9199 0.98178E+00 -0.0080
11 HClO2,aq 0.17608E-38 -38.7543 0.17608E-38 -38.7543 0.10000E+01 0.0000
12 H2,aq 0.50573E-44 -44.2961 0.50571E-44 -44.2961 0.99996E+00 0.0000
13 NH3,aq 0.57332E-82 -82.2416 0.57330E-82 -82.2416 0.99996E+00 0.0000
14 HNO2,aq 0.26222E-37 -37.5813 0.26222E-37 -37.5813 0.10000E+01 0.0000
15 NO2- 0.15818E-33 -33.8008 0.15530E-33 -33.8088 0.98178E+00 -0.0080
16 HNO3,aq 0.20690E-28 -28.6842 0.20690E-28 -28.6842 0.10000E+01 0.0000
17 NO3- 0.42000E-20 -20.3768 0.41235E-20 -20.3847 0.98178E+00 -0.0080
18 N2,aq 0.35242E-53 -53.4529 0.35241E-53 -53.4530 0.99996E+00 0.0000
19 N2O2-2 0.30748-102 -102.5122 0.30140-102 -102.5209 0.98023E+00 -0.0087
20 HN2O2- 0.30523E-98 -98.5154 0.29967E-98 -98.5234 0.98178E+00 -0.0080
21 H2N2O2,aq 0.32820E-98 -98.4839 0.32820E-98 -98.4839 0.10000E+01 0.0000
22 N2H5+ 0.83433-154 -154.0787 0.81913-154 -154.0866 0.98178E+00 -0.0080
23 N2H6+2 0.78981-162 -162.1025 0.77420-162 -162.1111 0.98023E+00 -0.0087
24 NaCl,aq 0.16108E-14 -14.7930 0.16108E-14 -14.7930 0.10000E+01 0.0000
25 NaOH,aq 0.60886E-14 -14.2155 0.60886E-14 -14.2155 0.10000E+01 0.0000
26 O2,aq 0.24000E-03 -3.6198 0.23999E-03 -3.6198 0.99996E+00 0.0000
27 OH- 0.10244E-06 -6.9895 0.10058E-06 -6.9975 0.98178E+00 -0.0080
28 HO2- 0.77016E-23 -23.1134 0.75613E-23 -23.1214 0.98178E+00 -0.0080
29 H2O2,aq 0.36736E-18 -18.4349 0.36736E-18 -18.4349 0.10000E+01 0.0000
30 H2S,aq 0.34962-158 -158.4564 0.34960-158 -158.4564 0.99996E+00 0.0000
36 SO2,aq 0.76359E-70 -70.1171 0.76359E-70 -70.1171 0.10000E+01 0.0000
37 SO3-2 0.66303E-65 -65.1785 0.64992E-65 -65.1871 0.98023E+00 -0.0087
38 HSO3- 0.10674E-64 -64.9717 0.10480E-64 -64.9796 0.98178E+00 -0.0080
39 HSO4- 0.41347E-25 -25.3836 0.40594E-25 -25.3915 0.98178E+00 -0.0080
40 HSO5- 0.34717E-46 -46.4595 0.34084E-46 -46.4674 0.98178E+00 -0.0080
41 S2O3-2 0.93154-181 -181.0308 0.91313-181 -181.0395 0.98023E+00 -0.0087
42 HS2O3- 0.45291-186 -186.3440 0.44466-186 -186.3520 0.98178E+00 -0.0080
43 H2S2O3,aq 0.17280-192 -192.7625 0.17280-192 -192.7625 0.10000E+01 0.0000
44 S2O4-2 0.17430-167 -167.7587 0.17086-167 -167.7674 0.98023E+00 -0.0087
45 HS2O4- 0.54464-172 -172.2639 0.53472-172 -172.2719 0.98178E+00 -0.0080
46 H2S2O4,aq 0.12492-178 -178.9034 0.12492-178 -178.9034 0.10000E+01 0.0000
47 S2O5-2 0.17076-134 -134.7676 0.16739-134 -134.7763 0.98023E+00 -0.0087
48 S2O6-2 0.45446-104 -104.3425 0.44547-104 -104.3512 0.98023E+00 -0.0087
49 S2O8-2 0.90716E-79 -79.0423 0.88923E-79 -79.0510 0.98023E+00 -0.0087
Charge balance for all species = 0.2917E-20
Solid products produced: Mass = 0.000000 g Volume = 0.000000 cm3
WARNING: mineral volume may be in error because some mineral densities
were not supplied in SOLTHERM. See mineral list in file Skip_Species.txt.
Reactant consumed: 0.0000000 moles log = -20.6778
Original solution: 0.0000000 g
Original solution / Rock added: 0.00 (Water/Rock Ratio), log = 0.0000
Gas composition at saturation ( 0 iterations)
-------------------------------------------------
Temperature: 25.0000 deg.C
Sat. pressure: 600.0000 bar
Gas Mole fraction phi Fugacity Partial P(bar)
H2O,gas 0.8929E-67 1.0000 0.3083E-01 0.3083E-01
H2,gas 0.1869-106 1.0000 0.6455E-41 0.6455E-41
H2S,gas 0.8287-223 1.0000 0.2861-157 0.2861-157
S2,gas 0.0000E+00 1.0000 0.7680-258 0.7680-258
NO2,gas 0.4335-100 1.0000 0.1497E-34 0.1497E-34
SO3,gas 0.1655-123 1.0000 0.5714E-58 0.5714E-58
O2,gas 0.1000E+01 1.0000 0.3453E+66 0.3453E+66
NH3,gas 0.2650-149 1.0000 0.9149E-84 0.9149E-84
N2,gas 0.1570-115 1.0000 0.5421E-50 0.5421E-50
SO2,gas 0.1495-135 1.0000 0.5163E-70 0.5163E-70
NON-Ideal mixing with H2O, AND ALL Gases
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
The following gases and minerals are presently EXCLUDED from matrix
(Gases and minerals with log(Q/K) less than -5 are not listed below)
Gas or Mineral Log K Log Q Log(Q/K) Log(Q/K)/S Affinity Log Fugacity
1 H2O,gas 1.51 0.00 -1.51 -1.511 0.20614E+04 -1.511
2 H2,gas 8.42 -32.77 -41.19 -23.537 0.56195E+05 -41.190
3 H2S,gas -7.90 -165.44 -157.54 -78.772 0.21493E+06 -157.543
4 S2,gas -7.24 -265.35 -258.11 -39.710 0.35214E+06 -258.115
5 NO2,gas 76.52 41.69 -34.82 -7.960 0.47511E+05 -34.825
6 SO3,gas 23.88 -34.37 -58.24 -14.561 0.79460E+05 -58.243
7 O2,gas 66.26 65.54 -0.72 -0.480 0.98202E+03 -0.720
8 NH3,gas 11.04 -73.00 -84.04 -42.019 0.11465E+06 -84.039
9 N2,gas 2.57 -47.69 -50.27 -6.486 0.68577E+05 -50.266
10 SO2,gas 3.15 -67.14 -70.29 -18.743 0.95892E+05 -70.287
11 HCl,gas 6.31 -14.01 -20.31 -10.156 0.27711E+05 -20.311
Calculations done for 25.0000 Deg. C; 1.0000 bar
Next reactant titration increment of: 0.0000000 MOLES
Current total amount of reactant added: 0.0000000 MOLES
New total amount of reactant added: 0.0000000 MOLES
Solids and gases carried
Charge balance check after fractionation or titration: TBAL = 0.1965E-20
******** WARNING ********
Computational singularity, IV(N) = 0.0