mirror of
https://git.gfz-potsdam.de/naaice/iphreeqc.git
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Merge commit '777e6ee471ada761562a1fecaeaaa0d0f52d9e75'
This commit is contained in:
Darth Vader
commit
0d529e8de7
@ -1,7 +1,9 @@
|
|||||||
cmake_minimum_required (VERSION 3.9)
|
cmake_minimum_required (VERSION 3.9)
|
||||||
|
|
||||||
SET(phreeqc_EXAMPLES
|
SET(phreeqc_EXAMPLES
|
||||||
|
co2.dat
|
||||||
co2.tsv
|
co2.tsv
|
||||||
|
co2_VP.dat
|
||||||
ex1
|
ex1
|
||||||
ex2
|
ex2
|
||||||
ex2b
|
ex2b
|
||||||
@ -112,6 +114,18 @@ configure_file (
|
|||||||
"co2.tsv"
|
"co2.tsv"
|
||||||
)
|
)
|
||||||
|
|
||||||
|
# co2.dat
|
||||||
|
configure_file (
|
||||||
|
"co2.dat"
|
||||||
|
"co2.dat"
|
||||||
|
)
|
||||||
|
|
||||||
|
# co2_VP.dat
|
||||||
|
configure_file (
|
||||||
|
"co2_VP.dat"
|
||||||
|
"co2_VP.dat"
|
||||||
|
)
|
||||||
|
|
||||||
#
|
#
|
||||||
# run examples for testing
|
# run examples for testing
|
||||||
#
|
#
|
||||||
|
|||||||
84
phreeqc3-examples/co2.dat
Normal file
84
phreeqc3-examples/co2.dat
Normal file
@ -0,0 +1,84 @@
|
|||||||
|
P 25.oC 50.oC 75.oC 100oC
|
||||||
|
10.7 0.3000
|
||||||
|
26.3 0.7068
|
||||||
|
35.8 0.9356
|
||||||
|
50.1 1.2051
|
||||||
|
50.1 1.2203
|
||||||
|
75.2 1.3932
|
||||||
|
100.2 1.4186
|
||||||
|
101.4 1.4339
|
||||||
|
136.0 1.4695
|
||||||
|
150.4 1.4695
|
||||||
|
151.6 1.4898
|
||||||
|
176.6 1.5254
|
||||||
|
200.5 1.5203
|
||||||
|
202.9 1.5610
|
||||||
|
249.4 1.5763
|
||||||
|
299.5 1.6220
|
||||||
|
399.8 1.7237
|
||||||
|
9.5 0.1831
|
||||||
|
25.3 0.433
|
||||||
|
40.5 0.612
|
||||||
|
50.6 0.771
|
||||||
|
50.7 0.769
|
||||||
|
60.6 0.908
|
||||||
|
68.2 0.932
|
||||||
|
70.8 0.994
|
||||||
|
75.3 0.989
|
||||||
|
76.0 1.005
|
||||||
|
80.8 1.075
|
||||||
|
87.2 0.999
|
||||||
|
90.9 1.133
|
||||||
|
100.9 1.162
|
||||||
|
101 1.176
|
||||||
|
101.3 1.180
|
||||||
|
101.3 1.143
|
||||||
|
101.3 1.121
|
||||||
|
111.0 1.191
|
||||||
|
121.0 1.214
|
||||||
|
122.1 1.188
|
||||||
|
126.7 1.194
|
||||||
|
141.1 1.231
|
||||||
|
147.5 1.257
|
||||||
|
147.5 1.253
|
||||||
|
152.0 1.234
|
||||||
|
152.0 1.191
|
||||||
|
176.8 1.285
|
||||||
|
200 1.307
|
||||||
|
201 1.334
|
||||||
|
202.7 1.300
|
||||||
|
301 1.431
|
||||||
|
304.0 1.398
|
||||||
|
405.3 1.485
|
||||||
|
500 1.599
|
||||||
|
608 1.639
|
||||||
|
709.3 1.710
|
||||||
|
8.4 0.0864
|
||||||
|
25.1 0.3051
|
||||||
|
51.3 0.5695
|
||||||
|
75.2 0.7576
|
||||||
|
101.4 0.9153
|
||||||
|
150.4 1.0983
|
||||||
|
199.3 1.1898
|
||||||
|
201.7 1.1898
|
||||||
|
299.5 1.3119
|
||||||
|
399.8 1.4237
|
||||||
|
699.3 1.6729
|
||||||
|
3.2 0.025
|
||||||
|
5.9 0.054
|
||||||
|
9.1 0.088
|
||||||
|
11.8 0.116
|
||||||
|
14.3 0.145
|
||||||
|
17.9 0.183
|
||||||
|
22.8 0.231
|
||||||
|
25.0 0.239
|
||||||
|
50.0 0.454
|
||||||
|
75.0 0.637
|
||||||
|
100.0 0.788
|
||||||
|
150.0 1.014
|
||||||
|
197.4 1.133
|
||||||
|
200.0 1.146
|
||||||
|
300.0 1.317
|
||||||
|
400.0 1.445
|
||||||
|
493.5 1.599
|
||||||
|
700.0 1.718
|
||||||
140
phreeqc3-examples/co2_VP.dat
Normal file
140
phreeqc3-examples/co2_VP.dat
Normal file
@ -0,0 +1,140 @@
|
|||||||
|
Vm 25ｺC 50ｺC 100ｺC 150ｺC
|
||||||
|
1.195 18.537
|
||||||
|
0.955 22.572
|
||||||
|
0.796 26.371
|
||||||
|
0.684 29.865
|
||||||
|
0.596 33.307
|
||||||
|
0.528 36.494
|
||||||
|
0.476 39.407
|
||||||
|
0.432 42.170
|
||||||
|
0.490 38.585
|
||||||
|
0.324 50.489
|
||||||
|
0.246 57.871
|
||||||
|
0.200 62.155
|
||||||
|
0.058 74.739
|
||||||
|
0.053 109.870
|
||||||
|
0.049 180.783
|
||||||
|
0.046 308.620
|
||||||
|
0.043 523.452
|
||||||
|
0.040 864.844
|
||||||
|
0.038 1325.170
|
||||||
|
0.188 63.114
|
||||||
|
0.186 63.247
|
||||||
|
0.184 63.403
|
||||||
|
0.180 63.451
|
||||||
|
0.175 63.446
|
||||||
|
0.163 63.450
|
||||||
|
0.119 63.468
|
||||||
|
0.077 63.467
|
||||||
|
0.077 63.456
|
||||||
|
0.062 63.474
|
||||||
|
0.062 63.513
|
||||||
|
0.062 63.593
|
||||||
|
0.062 63.760
|
||||||
|
0.062 64.151
|
||||||
|
0.061 65.259
|
||||||
|
0.061 65.370
|
||||||
|
0.060 67.514
|
||||||
|
0.190 62.946
|
||||||
|
0.186 63.231
|
||||||
|
0.184 63.377
|
||||||
|
0.178 63.450
|
||||||
|
0.114 63.462
|
||||||
|
0.068 63.459
|
||||||
|
0.062 63.550
|
||||||
|
0.062 64.073
|
||||||
|
|
||||||
|
1.195 20.445
|
||||||
|
0.955 25.026
|
||||||
|
0.796 29.397
|
||||||
|
0.684 33.475
|
||||||
|
0.596 37.559
|
||||||
|
0.528 41.400
|
||||||
|
0.476 44.982
|
||||||
|
0.324 59.524
|
||||||
|
0.246 70.782
|
||||||
|
0.200 79.158
|
||||||
|
0.168 85.738
|
||||||
|
0.146 90.682
|
||||||
|
0.132 94.048
|
||||||
|
0.119 97.232
|
||||||
|
0.109 100.111
|
||||||
|
0.109 100.118
|
||||||
|
0.099 103.257
|
||||||
|
0.091 106.665
|
||||||
|
0.084 110.491
|
||||||
|
0.078 115.297
|
||||||
|
0.073 121.776
|
||||||
|
0.068 130.848
|
||||||
|
0.064 142.376
|
||||||
|
0.064 145.229
|
||||||
|
0.058 180.898
|
||||||
|
0.053 245.038
|
||||||
|
0.049 350.279
|
||||||
|
0.046 518.686
|
||||||
|
0.043 781.537
|
||||||
|
0.040 1178.980
|
||||||
|
0.038 1697.790
|
||||||
|
|
||||||
|
1.195 24.2483
|
||||||
|
0.955 29.8914
|
||||||
|
0.796 35.3693
|
||||||
|
0.684 40.5672
|
||||||
|
0.596 45.863
|
||||||
|
0.528 50.959
|
||||||
|
0.476 55.798
|
||||||
|
0.490 54.413
|
||||||
|
0.324 76.745
|
||||||
|
0.246 95.130
|
||||||
|
0.200 110.947
|
||||||
|
0.168 125.564
|
||||||
|
0.146 138.669
|
||||||
|
0.132 149.054
|
||||||
|
0.119 160.256
|
||||||
|
0.109 171.567
|
||||||
|
0.099 184.991
|
||||||
|
0.091 199.951
|
||||||
|
0.084 216.386
|
||||||
|
0.078 235.395
|
||||||
|
0.073 258.216
|
||||||
|
0.068 286.180
|
||||||
|
0.064 317.264
|
||||||
|
0.064 324.641
|
||||||
|
0.058 403.553
|
||||||
|
0.053 522.315
|
||||||
|
0.049 691.824
|
||||||
|
0.043 1289.390
|
||||||
|
0.040 1792.290
|
||||||
|
0.038 2419.970
|
||||||
|
|
||||||
|
1.195 28.031
|
||||||
|
0.955 34.713
|
||||||
|
0.796 41.266
|
||||||
|
0.684 47.547
|
||||||
|
0.596 54.026
|
||||||
|
0.528 60.318
|
||||||
|
0.476 66.370
|
||||||
|
0.490 64.628
|
||||||
|
0.324 93.426
|
||||||
|
0.246 111.587
|
||||||
|
0.200 141.534
|
||||||
|
0.168 164.001
|
||||||
|
0.146 185.206
|
||||||
|
0.132 202.746
|
||||||
|
0.119 222.250
|
||||||
|
0.109 242.450
|
||||||
|
0.109 242.478
|
||||||
|
0.099 266.859
|
||||||
|
0.091 294.204
|
||||||
|
0.084 324.034
|
||||||
|
0.078 357.992
|
||||||
|
0.073 397.723
|
||||||
|
0.068 444.846
|
||||||
|
0.064 495.431
|
||||||
|
0.064 507.212
|
||||||
|
0.058 628.422
|
||||||
|
0.053 799.215
|
||||||
|
0.049 1030.05
|
||||||
|
0.043 1782.41
|
||||||
|
0.040 2384.27
|
||||||
|
0.038 3117.01
|
||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -10,6 +10,7 @@ Reading data base.
|
|||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
PITZER
|
PITZER
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
@ -91,10 +92,10 @@ Initial solution 1. Black Sea water
|
|||||||
|
|
||||||
pH = 8.000
|
pH = 8.000
|
||||||
pe = 4.000
|
pe = 4.000
|
||||||
Specific Conductance (µS/cm, 25°C) = 29777
|
Specific Conductance (µS/cm, 25°C) = 29778
|
||||||
Density (g/cm³) = 1.01091
|
Density (g/cm³) = 1.01091
|
||||||
Volume (L) = 1.00789
|
Volume (L) = 1.00789
|
||||||
Viscosity (mPa s) = 0.92658
|
Viscosity (mPa s) = 0.92655
|
||||||
Activity of water = 0.990
|
Activity of water = 0.990
|
||||||
Ionic strength (mol/kgw) = 3.751e-01
|
Ionic strength (mol/kgw) = 3.751e-01
|
||||||
Mass of water (kg) = 1.000e+00
|
Mass of water (kg) = 1.000e+00
|
||||||
@ -213,10 +214,10 @@ Initial solution 2. Composition during halite precipitation
|
|||||||
|
|
||||||
pH = 5.000
|
pH = 5.000
|
||||||
pe = 4.000
|
pe = 4.000
|
||||||
Specific Conductance (µS/cm, 25°C) = 150248
|
Specific Conductance (µS/cm, 25°C) = 150307
|
||||||
Density (g/cm³) = 1.27237
|
Density (g/cm³) = 1.27237
|
||||||
Volume (L) = 1.13163
|
Volume (L) = 1.13163
|
||||||
Viscosity (mPa s) = 3.75438
|
Viscosity (mPa s) = 3.75254
|
||||||
Activity of water = 0.678
|
Activity of water = 0.678
|
||||||
Ionic strength (mol/kgw) = 1.111e+01
|
Ionic strength (mol/kgw) = 1.111e+01
|
||||||
Mass of water (kg) = 1.000e+00
|
Mass of water (kg) = 1.000e+00
|
||||||
|
|||||||
@ -10,6 +10,7 @@ Reading data base.
|
|||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
PITZER
|
PITZER
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
@ -93,10 +94,10 @@ Initial solution 1. Black Sea water
|
|||||||
|
|
||||||
pH = 8.000
|
pH = 8.000
|
||||||
pe = 4.000
|
pe = 4.000
|
||||||
Specific Conductance (µS/cm, 25°C) = 29777
|
Specific Conductance (µS/cm, 25°C) = 29778
|
||||||
Density (g/cm³) = 1.01091
|
Density (g/cm³) = 1.01091
|
||||||
Volume (L) = 1.00789
|
Volume (L) = 1.00789
|
||||||
Viscosity (mPa s) = 0.92658
|
Viscosity (mPa s) = 0.92655
|
||||||
Activity of water = 0.990
|
Activity of water = 0.990
|
||||||
Ionic strength (mol/kgw) = 3.751e-01
|
Ionic strength (mol/kgw) = 3.751e-01
|
||||||
Mass of water (kg) = 1.000e+00
|
Mass of water (kg) = 1.000e+00
|
||||||
@ -256,10 +257,10 @@ Polyhalite -9.73 -23.47 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 8.000 Charge balance
|
pH = 8.000 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 29777
|
Specific Conductance (µS/cm, 25°C) = 29778
|
||||||
Density (g/cm³) = 1.01091
|
Density (g/cm³) = 1.01091
|
||||||
Volume (L) = 1.00789
|
Volume (L) = 1.00789
|
||||||
Viscosity (mPa s) = 0.92658
|
Viscosity (mPa s) = 0.92655
|
||||||
Activity of water = 0.990
|
Activity of water = 0.990
|
||||||
Ionic strength (mol/kgw) = 3.751e-01
|
Ionic strength (mol/kgw) = 3.751e-01
|
||||||
Mass of water (kg) = 1.000e+00
|
Mass of water (kg) = 1.000e+00
|
||||||
@ -415,10 +416,10 @@ Polyhalite -7.26 -21.00 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.848 Charge balance
|
pH = 7.848 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 73063
|
Specific Conductance (µS/cm, 25°C) = 73067
|
||||||
Density (g/cm³) = 1.03527
|
Density (g/cm³) = 1.03527
|
||||||
Volume (L) = 0.35767
|
Volume (L) = 0.35767
|
||||||
Viscosity (mPa s) = 0.99372
|
Viscosity (mPa s) = 0.99366
|
||||||
Activity of water = 0.972
|
Activity of water = 0.972
|
||||||
Ionic strength (mol/kgw) = 1.065e+00
|
Ionic strength (mol/kgw) = 1.065e+00
|
||||||
Mass of water (kg) = 3.514e-01
|
Mass of water (kg) = 3.514e-01
|
||||||
@ -574,10 +575,10 @@ Polyhalite -6.70 -20.44 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.793 Charge balance
|
pH = 7.793 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 88035
|
Specific Conductance (µS/cm, 25°C) = 88040
|
||||||
Density (g/cm³) = 1.04464
|
Density (g/cm³) = 1.04464
|
||||||
Volume (L) = 0.28547
|
Volume (L) = 0.28547
|
||||||
Viscosity (mPa s) = 1.02215
|
Viscosity (mPa s) = 1.02207
|
||||||
Activity of water = 0.965
|
Activity of water = 0.965
|
||||||
Ionic strength (mol/kgw) = 1.340e+00
|
Ionic strength (mol/kgw) = 1.340e+00
|
||||||
Mass of water (kg) = 2.794e-01
|
Mass of water (kg) = 2.794e-01
|
||||||
@ -733,10 +734,10 @@ Polyhalite -5.93 -19.68 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.710 Charge balance
|
pH = 7.710 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 111017
|
Specific Conductance (µS/cm, 25°C) = 111026
|
||||||
Density (g/cm³) = 1.06016
|
Density (g/cm³) = 1.06016
|
||||||
Volume (L) = 0.21331
|
Volume (L) = 0.21331
|
||||||
Viscosity (mPa s) = 1.07296
|
Viscosity (mPa s) = 1.07286
|
||||||
Activity of water = 0.952
|
Activity of water = 0.952
|
||||||
Ionic strength (mol/kgw) = 1.805e+00
|
Ionic strength (mol/kgw) = 1.805e+00
|
||||||
Mass of water (kg) = 2.073e-01
|
Mass of water (kg) = 2.073e-01
|
||||||
@ -892,10 +893,10 @@ Polyhalite -4.92 -18.67 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.595 Charge balance
|
pH = 7.595 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 149892
|
Specific Conductance (µS/cm, 25°C) = 149908
|
||||||
Density (g/cm³) = 1.09018
|
Density (g/cm³) = 1.09018
|
||||||
Volume (L) = 0.14120
|
Volume (L) = 0.14120
|
||||||
Viscosity (mPa s) = 1.18635
|
Viscosity (mPa s) = 1.18620
|
||||||
Activity of water = 0.923
|
Activity of water = 0.923
|
||||||
Ionic strength (mol/kgw) = 2.742e+00
|
Ionic strength (mol/kgw) = 2.742e+00
|
||||||
Mass of water (kg) = 1.352e-01
|
Mass of water (kg) = 1.352e-01
|
||||||
@ -1051,10 +1052,10 @@ Polyhalite -4.70 -18.44 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.573 Charge balance
|
pH = 7.573 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 163822
|
Specific Conductance (µS/cm, 25°C) = 163840
|
||||||
Density (g/cm³) = 1.10237
|
Density (g/cm³) = 1.10237
|
||||||
Volume (L) = 0.12317
|
Volume (L) = 0.12317
|
||||||
Viscosity (mPa s) = 1.23905
|
Viscosity (mPa s) = 1.23888
|
||||||
Activity of water = 0.909
|
Activity of water = 0.909
|
||||||
Ionic strength (mol/kgw) = 3.136e+00
|
Ionic strength (mol/kgw) = 3.136e+00
|
||||||
Mass of water (kg) = 1.172e-01
|
Mass of water (kg) = 1.172e-01
|
||||||
@ -1210,10 +1211,10 @@ Polyhalite -4.40 -18.15 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.546 Charge balance
|
pH = 7.546 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 180062
|
Specific Conductance (µS/cm, 25°C) = 180084
|
||||||
Density (g/cm³) = 1.11850
|
Density (g/cm³) = 1.11850
|
||||||
Volume (L) = 0.10515
|
Volume (L) = 0.10515
|
||||||
Viscosity (mPa s) = 1.31607
|
Viscosity (mPa s) = 1.31587
|
||||||
Activity of water = 0.890
|
Activity of water = 0.890
|
||||||
Ionic strength (mol/kgw) = 3.673e+00
|
Ionic strength (mol/kgw) = 3.673e+00
|
||||||
Mass of water (kg) = 9.912e-02
|
Mass of water (kg) = 9.912e-02
|
||||||
@ -1369,10 +1370,10 @@ Polyhalite -4.00 -17.74 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.508 Charge balance
|
pH = 7.508 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 198454
|
Specific Conductance (µS/cm, 25°C) = 198480
|
||||||
Density (g/cm³) = 1.14090
|
Density (g/cm³) = 1.14090
|
||||||
Volume (L) = 0.08716
|
Volume (L) = 0.08716
|
||||||
Viscosity (mPa s) = 1.43886
|
Viscosity (mPa s) = 1.43861
|
||||||
Activity of water = 0.861
|
Activity of water = 0.861
|
||||||
Ionic strength (mol/kgw) = 4.446e+00
|
Ionic strength (mol/kgw) = 4.446e+00
|
||||||
Mass of water (kg) = 8.107e-02
|
Mass of water (kg) = 8.107e-02
|
||||||
@ -1528,10 +1529,10 @@ Polyhalite -3.38 -17.12 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.454 Charge balance
|
pH = 7.454 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 217024
|
Specific Conductance (µS/cm, 25°C) = 217055
|
||||||
Density (g/cm³) = 1.17419
|
Density (g/cm³) = 1.17419
|
||||||
Volume (L) = 0.06922
|
Volume (L) = 0.06922
|
||||||
Viscosity (mPa s) = 1.66307
|
Viscosity (mPa s) = 1.66275
|
||||||
Activity of water = 0.811
|
Activity of water = 0.811
|
||||||
Ionic strength (mol/kgw) = 5.663e+00
|
Ionic strength (mol/kgw) = 5.663e+00
|
||||||
Mass of water (kg) = 6.302e-02
|
Mass of water (kg) = 6.302e-02
|
||||||
@ -1687,10 +1688,10 @@ Polyhalite -2.55 -16.29 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.359 Charge balance
|
pH = 7.359 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 226248
|
Specific Conductance (µS/cm, 25°C) = 226285
|
||||||
Density (g/cm³) = 1.21418
|
Density (g/cm³) = 1.21418
|
||||||
Volume (L) = 0.05088
|
Volume (L) = 0.05088
|
||||||
Viscosity (mPa s) = 2.03087
|
Viscosity (mPa s) = 2.03044
|
||||||
Activity of water = 0.739
|
Activity of water = 0.739
|
||||||
Ionic strength (mol/kgw) = 7.301e+00
|
Ionic strength (mol/kgw) = 7.301e+00
|
||||||
Mass of water (kg) = 4.504e-02
|
Mass of water (kg) = 4.504e-02
|
||||||
@ -1846,10 +1847,10 @@ Polyhalite -1.68 -15.43 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.364 Charge balance
|
pH = 7.364 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 214242
|
Specific Conductance (µS/cm, 25°C) = 214294
|
||||||
Density (g/cm³) = 1.21997
|
Density (g/cm³) = 1.21997
|
||||||
Volume (L) = 0.03050
|
Volume (L) = 0.03050
|
||||||
Viscosity (mPa s) = 2.19817
|
Viscosity (mPa s) = 2.19748
|
||||||
Activity of water = 0.729
|
Activity of water = 0.729
|
||||||
Ionic strength (mol/kgw) = 7.901e+00
|
Ionic strength (mol/kgw) = 7.901e+00
|
||||||
Mass of water (kg) = 2.709e-02
|
Mass of water (kg) = 2.709e-02
|
||||||
@ -2005,10 +2006,10 @@ Polyhalite -1.34 -15.08 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.367 Charge balance
|
pH = 7.367 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 207916
|
Specific Conductance (µS/cm, 25°C) = 207974
|
||||||
Density (g/cm³) = 1.22336
|
Density (g/cm³) = 1.22336
|
||||||
Volume (L) = 0.02541
|
Volume (L) = 0.02541
|
||||||
Viscosity (mPa s) = 2.30055
|
Viscosity (mPa s) = 2.29973
|
||||||
Activity of water = 0.724
|
Activity of water = 0.724
|
||||||
Ionic strength (mol/kgw) = 8.219e+00
|
Ionic strength (mol/kgw) = 8.219e+00
|
||||||
Mass of water (kg) = 2.260e-02
|
Mass of water (kg) = 2.260e-02
|
||||||
@ -2164,10 +2165,10 @@ Polyhalite -0.87 -14.62 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.371 Charge balance
|
pH = 7.371 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 197853
|
Specific Conductance (µS/cm, 25°C) = 197917
|
||||||
Density (g/cm³) = 1.22919
|
Density (g/cm³) = 1.22919
|
||||||
Volume (L) = 0.02033
|
Volume (L) = 0.02033
|
||||||
Viscosity (mPa s) = 2.48495
|
Viscosity (mPa s) = 2.48392
|
||||||
Activity of water = 0.714
|
Activity of water = 0.714
|
||||||
Ionic strength (mol/kgw) = 8.723e+00
|
Ionic strength (mol/kgw) = 8.723e+00
|
||||||
Mass of water (kg) = 1.810e-02
|
Mass of water (kg) = 1.810e-02
|
||||||
@ -2323,10 +2324,10 @@ Polyhalite -0.42 -14.16 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.375 Charge balance
|
pH = 7.375 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 186206
|
Specific Conductance (µS/cm, 25°C) = 186274
|
||||||
Density (g/cm³) = 1.23656
|
Density (g/cm³) = 1.23656
|
||||||
Volume (L) = 0.01675
|
Volume (L) = 0.01675
|
||||||
Viscosity (mPa s) = 2.73450
|
Viscosity (mPa s) = 2.73323
|
||||||
Activity of water = 0.702
|
Activity of water = 0.702
|
||||||
Ionic strength (mol/kgw) = 9.307e+00
|
Ionic strength (mol/kgw) = 9.307e+00
|
||||||
Mass of water (kg) = 1.493e-02
|
Mass of water (kg) = 1.493e-02
|
||||||
@ -2482,10 +2483,10 @@ Polyhalite -0.26 -14.00 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.377 Charge balance
|
pH = 7.377 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 181677
|
Specific Conductance (µS/cm, 25°C) = 181746
|
||||||
Density (g/cm³) = 1.23961
|
Density (g/cm³) = 1.23961
|
||||||
Volume (L) = 0.01574
|
Volume (L) = 0.01574
|
||||||
Viscosity (mPa s) = 2.84317
|
Viscosity (mPa s) = 2.84181
|
||||||
Activity of water = 0.697
|
Activity of water = 0.697
|
||||||
Ionic strength (mol/kgw) = 9.534e+00
|
Ionic strength (mol/kgw) = 9.534e+00
|
||||||
Mass of water (kg) = 1.403e-02
|
Mass of water (kg) = 1.403e-02
|
||||||
@ -2641,10 +2642,10 @@ Polyhalite -0.08 -13.82 -13.74 0.000e+00 0 0.000e+00
|
|||||||
|
|
||||||
pH = 7.379 Charge balance
|
pH = 7.379 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 176353
|
Specific Conductance (µS/cm, 25°C) = 176422
|
||||||
Density (g/cm³) = 1.24332
|
Density (g/cm³) = 1.24332
|
||||||
Volume (L) = 0.01472
|
Volume (L) = 0.01472
|
||||||
Viscosity (mPa s) = 2.98015
|
Viscosity (mPa s) = 2.97868
|
||||||
Activity of water = 0.691
|
Activity of water = 0.691
|
||||||
Ionic strength (mol/kgw) = 9.803e+00
|
Ionic strength (mol/kgw) = 9.803e+00
|
||||||
Mass of water (kg) = 1.313e-02
|
Mass of water (kg) = 1.313e-02
|
||||||
@ -2800,10 +2801,10 @@ Polyhalite 0.00 -13.74 -13.74 0.000e+00 2.746e-04 2.746e-04
|
|||||||
|
|
||||||
pH = 7.379 Charge balance
|
pH = 7.379 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 170258
|
Specific Conductance (µS/cm, 25°C) = 170327
|
||||||
Density (g/cm³) = 1.24638
|
Density (g/cm³) = 1.24638
|
||||||
Volume (L) = 0.01369
|
Volume (L) = 0.01369
|
||||||
Viscosity (mPa s) = 3.12540
|
Viscosity (mPa s) = 3.12380
|
||||||
Activity of water = 0.686
|
Activity of water = 0.686
|
||||||
Ionic strength (mol/kgw) = 1.005e+01
|
Ionic strength (mol/kgw) = 1.005e+01
|
||||||
Mass of water (kg) = 1.221e-02
|
Mass of water (kg) = 1.221e-02
|
||||||
@ -2959,10 +2960,10 @@ Polyhalite 0.00 -13.74 -13.74 2.746e-04 7.008e-04 4.262e-04
|
|||||||
|
|
||||||
pH = 7.378 Charge balance
|
pH = 7.378 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 163252
|
Specific Conductance (µS/cm, 25°C) = 163322
|
||||||
Density (g/cm³) = 1.24930
|
Density (g/cm³) = 1.24930
|
||||||
Volume (L) = 0.01264
|
Volume (L) = 0.01264
|
||||||
Viscosity (mPa s) = 3.29229
|
Viscosity (mPa s) = 3.29053
|
||||||
Activity of water = 0.680
|
Activity of water = 0.680
|
||||||
Ionic strength (mol/kgw) = 1.029e+01
|
Ionic strength (mol/kgw) = 1.029e+01
|
||||||
Mass of water (kg) = 1.130e-02
|
Mass of water (kg) = 1.130e-02
|
||||||
@ -3118,10 +3119,10 @@ Polyhalite 0.00 -13.74 -13.74 7.008e-04 9.425e-04 2.417e-04
|
|||||||
|
|
||||||
pH = 7.377 Charge balance
|
pH = 7.377 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 158442
|
Specific Conductance (µS/cm, 25°C) = 158512
|
||||||
Density (g/cm³) = 1.25155
|
Density (g/cm³) = 1.25155
|
||||||
Volume (L) = 0.01201
|
Volume (L) = 0.01201
|
||||||
Viscosity (mPa s) = 3.41850
|
Viscosity (mPa s) = 3.41663
|
||||||
Activity of water = 0.676
|
Activity of water = 0.676
|
||||||
Ionic strength (mol/kgw) = 1.047e+01
|
Ionic strength (mol/kgw) = 1.047e+01
|
||||||
Mass of water (kg) = 1.075e-02
|
Mass of water (kg) = 1.075e-02
|
||||||
@ -3277,10 +3278,10 @@ Polyhalite 0.00 -13.74 -13.74 9.425e-04 1.172e-03 2.296e-04
|
|||||||
|
|
||||||
pH = 7.376 Charge balance
|
pH = 7.376 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 153077
|
Specific Conductance (µS/cm, 25°C) = 153147
|
||||||
Density (g/cm³) = 1.25429
|
Density (g/cm³) = 1.25429
|
||||||
Volume (L) = 0.01139
|
Volume (L) = 0.01139
|
||||||
Viscosity (mPa s) = 3.57162
|
Viscosity (mPa s) = 3.56962
|
||||||
Activity of water = 0.672
|
Activity of water = 0.672
|
||||||
Ionic strength (mol/kgw) = 1.068e+01
|
Ionic strength (mol/kgw) = 1.068e+01
|
||||||
Mass of water (kg) = 1.020e-02
|
Mass of water (kg) = 1.020e-02
|
||||||
@ -3436,10 +3437,10 @@ Polyhalite 0.00 -13.74 -13.74 1.172e-03 1.369e-03 1.969e-04
|
|||||||
|
|
||||||
pH = 7.378 Charge balance
|
pH = 7.378 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 147417
|
Specific Conductance (µS/cm, 25°C) = 147486
|
||||||
Density (g/cm³) = 1.25755
|
Density (g/cm³) = 1.25755
|
||||||
Volume (L) = 0.01081
|
Volume (L) = 0.01081
|
||||||
Viscosity (mPa s) = 3.74839
|
Viscosity (mPa s) = 3.74624
|
||||||
Activity of water = 0.667
|
Activity of water = 0.667
|
||||||
Ionic strength (mol/kgw) = 1.091e+01
|
Ionic strength (mol/kgw) = 1.091e+01
|
||||||
Mass of water (kg) = 9.689e-03
|
Mass of water (kg) = 9.689e-03
|
||||||
@ -3595,10 +3596,10 @@ Polyhalite 0.00 -13.74 -13.74 1.369e-03 1.563e-03 1.942e-04
|
|||||||
|
|
||||||
pH = 7.386 Charge balance
|
pH = 7.386 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 140319
|
Specific Conductance (µS/cm, 25°C) = 140386
|
||||||
Density (g/cm³) = 1.26219
|
Density (g/cm³) = 1.26219
|
||||||
Volume (L) = 0.01020
|
Volume (L) = 0.01020
|
||||||
Viscosity (mPa s) = 3.99402
|
Viscosity (mPa s) = 3.99168
|
||||||
Activity of water = 0.660
|
Activity of water = 0.660
|
||||||
Ionic strength (mol/kgw) = 1.122e+01
|
Ionic strength (mol/kgw) = 1.122e+01
|
||||||
Mass of water (kg) = 9.142e-03
|
Mass of water (kg) = 9.142e-03
|
||||||
@ -3754,10 +3755,10 @@ Polyhalite 0.00 -13.74 -13.74 1.563e-03 1.740e-03 1.768e-04
|
|||||||
|
|
||||||
pH = 7.394 Charge balance
|
pH = 7.394 Charge balance
|
||||||
pe = 4.000 Adjusted to redox equilibrium
|
pe = 4.000 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 132216
|
Specific Conductance (µS/cm, 25°C) = 132282
|
||||||
Density (g/cm³) = 1.26804
|
Density (g/cm³) = 1.26804
|
||||||
Volume (L) = 0.00958
|
Volume (L) = 0.00958
|
||||||
Viscosity (mPa s) = 4.31212
|
Viscosity (mPa s) = 4.30954
|
||||||
Activity of water = 0.652
|
Activity of water = 0.652
|
||||||
Ionic strength (mol/kgw) = 1.158e+01
|
Ionic strength (mol/kgw) = 1.158e+01
|
||||||
Mass of water (kg) = 8.595e-03
|
Mass of water (kg) = 8.595e-03
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -1,58 +1,67 @@
|
|||||||
TITLE Example 22.--Compare experimental CO2 solubilities at high CO2 pressure
|
TITLE Example 22.--Compare experimental CO2 solubilities at high CO2 pressure with
|
||||||
with Peng-Robinson calc'ns with fixed-volume gas_phase, 25, 50, 75, 100 oC.
|
Peng-Robinson calc`ns with fixed-volume gas_phase, 25, 50, 75, 100, 150 oC.
|
||||||
|
#PRINT; -reset false
|
||||||
SOLUTION 1
|
SOLUTION 1
|
||||||
GAS_PHASE 1
|
GAS_PHASE 1
|
||||||
-fixed_volume
|
-fixed_volume
|
||||||
CO2(g) 0
|
CO2(g) 0
|
||||||
H2O(g) 0
|
H2O(g) 0
|
||||||
REACTION
|
REACTION
|
||||||
CO2 1; 0 27*1
|
CO2 1; 0 31*1
|
||||||
INCREMENTAL_REACTIONS true
|
INCREMENTAL_REACTIONS true
|
||||||
|
|
||||||
USER_GRAPH 1 Example 22, CO2 solubility at high pressures, 25 - 100C
|
USER_GRAPH 1 Example 22,
|
||||||
-plot_tsv_file co2.tsv
|
-chart_title "CO2 solubility at high pressures, 25 - 100 ºC"
|
||||||
-axis_titles "Pressure, in atmospheres" \
|
-plot_csv_file co2.dat
|
||||||
"CO2 concentration, in moles per kilogram water"
|
-axis_titles "Pressure / atm" "CO2 / (mol/kgw)"
|
||||||
-axis_scale x_axis 0 500
|
-axis_scale x_axis 0 500
|
||||||
-axis_scale y_axis 0 2
|
-axis_scale y_axis 0 2
|
||||||
-connect_simulations false
|
-connect_simulations false
|
||||||
10 graph_x PR_P("CO2(g)")
|
10 graph_x PR_P("CO2(g)")
|
||||||
20 graph_y TOT("C(4)")
|
20 graph_y TOT("C(4)")
|
||||||
-end
|
-end
|
||||||
USER_GRAPH 2 Example 22, P-Vm of CO2 gas, 25 - 100C
|
USER_GRAPH 2 Example 22, P-Vm of CO2 gas, 25 - 150 ºC
|
||||||
-headings 25C
|
-chart_title "P-Vm of CO2 gas, data from Michels et al., 1935, 1937"
|
||||||
-axis_titles "Molar volume of CO2 gas, in liters per mole" \
|
-plot_csv_file co2_VP.dat
|
||||||
"CO2 pressure, in atmospheres"
|
-axis_titles "molar volume of CO2 gas / (L/mol)" "CO2 pressure / atm"
|
||||||
-axis_scale x_axis 0 1
|
-axis_scale x_axis 0 0.7
|
||||||
-axis_scale y_axis 0 500
|
-axis_scale y_axis 0 700
|
||||||
-connect_simulations false
|
-connect_simulations false
|
||||||
10 plot_xy gas_vm, gas_p symbol = None
|
10 graph_x gas_vm : graph_y gas_p
|
||||||
-end
|
|
||||||
END
|
END
|
||||||
|
|
||||||
USE solution 1
|
USE solution 1
|
||||||
USE gas_phase 1
|
USE gas_phase 1
|
||||||
USE reaction 1
|
REACTION
|
||||||
|
CO2 1; 0 29*1
|
||||||
REACTION_TEMPERATURE 2
|
REACTION_TEMPERATURE 2
|
||||||
50
|
50
|
||||||
USER_GRAPH 2
|
|
||||||
-headings 50C
|
|
||||||
END
|
END
|
||||||
|
|
||||||
USE solution 1
|
USE solution 1
|
||||||
USE gas_phase 1
|
USE gas_phase 1
|
||||||
USE reaction 1
|
REACTION
|
||||||
|
CO2 1; 0 27*1
|
||||||
REACTION_TEMPERATURE 3
|
REACTION_TEMPERATURE 3
|
||||||
75
|
75
|
||||||
USER_GRAPH 2
|
USER_GRAPH 2; -active false
|
||||||
-headings 75C
|
|
||||||
END
|
END
|
||||||
|
|
||||||
USE solution 1
|
USE solution 1
|
||||||
USE gas_phase 1
|
USE gas_phase 1
|
||||||
USE reaction 1
|
REACTION
|
||||||
|
CO2 1; 0 28*1
|
||||||
REACTION_TEMPERATURE 4
|
REACTION_TEMPERATURE 4
|
||||||
100
|
100
|
||||||
USER_GRAPH 2
|
USER_GRAPH 2; -active true
|
||||||
-headings 100C
|
END
|
||||||
|
|
||||||
|
USE solution 1
|
||||||
|
USE gas_phase 1
|
||||||
|
REACTION
|
||||||
|
CO2 1; 0 26*1
|
||||||
|
REACTION_TEMPERATURE 5
|
||||||
|
150
|
||||||
|
USER_GRAPH 1; -active false
|
||||||
|
USER_GRAPH 2; -active true
|
||||||
END
|
END
|
||||||
|
|||||||
File diff suppressed because it is too large
Load Diff
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
@ -618,7 +619,7 @@ Hfo_w
|
|||||||
|
|
||||||
pH = 5.500 Charge balance
|
pH = 5.500 Charge balance
|
||||||
pe = 14.523 Adjusted to redox equilibrium
|
pe = 14.523 Adjusted to redox equilibrium
|
||||||
Specific Conductance (µS/cm, 25°C) = 9914
|
Specific Conductance (µS/cm, 25°C) = 9913
|
||||||
Density (g/cm³) = 1.00265
|
Density (g/cm³) = 1.00265
|
||||||
Volume (L) = 1.00583
|
Volume (L) = 1.00583
|
||||||
Viscosity (mPa s) = 0.89480
|
Viscosity (mPa s) = 0.89480
|
||||||
|
|||||||
@ -9,6 +9,7 @@ Reading data base.
|
|||||||
SOLUTION_MASTER_SPECIES
|
SOLUTION_MASTER_SPECIES
|
||||||
SOLUTION_SPECIES
|
SOLUTION_SPECIES
|
||||||
PHASES
|
PHASES
|
||||||
|
GAS_BINARY_PARAMETERS
|
||||||
EXCHANGE_MASTER_SPECIES
|
EXCHANGE_MASTER_SPECIES
|
||||||
EXCHANGE_SPECIES
|
EXCHANGE_SPECIES
|
||||||
SURFACE_MASTER_SPECIES
|
SURFACE_MASTER_SPECIES
|
||||||
|
|||||||
Loading…
x
Reference in New Issue
Block a user