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Change in ETHETAS calculation

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git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@9801 1feff8c3-07ed-0310-ac33-dd36852eb9cd
This commit is contained in:
David L Parkhurst 2015-06-09 13:38:49 +00:00
parent 1ae8371b64
commit 559b6272ed
17 changed files with 39 additions and 39 deletions
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2
ex1.out
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@ -328,6 +328,6 @@ Reading input data for simulation 2.
------------------------------------
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End of Run after 0.02 Seconds.
End of Run after 0.03 Seconds.
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2
ex10.out
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@ -8417,6 +8417,6 @@ Misc 1: 4.8032e-03
Misc 2: 8.5786e-01
------------------------------
End of Run after 0.36 Seconds.
End of Run after 0.37 Seconds.
------------------------------

6
ex11.out
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@ -211,7 +211,7 @@ Reading input data for simulation 3.
reset false
WARNING: Cell-lengths were read for 1 cells. Last value is used till cell 40.
WARNING: Dispersivities were read for 1 cells. Last value is used till cell 40.
-----------------------------
End of Run after 3.7 Seconds.
-----------------------------
------------------------------
End of Run after 3.69 Seconds.
------------------------------

2
ex12.out
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@ -53,6 +53,6 @@ Reading input data for simulation 1.
WARNING: Cell-lengths were read for 1 cells. Last value is used till cell 60.
WARNING: Dispersivities were read for 1 cells. Last value is used till cell 60.
------------------------------
End of Run after 1.33 Seconds.
End of Run after 1.35 Seconds.
------------------------------

2
ex12a.out
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@ -165,6 +165,6 @@ WARNING: No dispersivities were read; disp = 0 assumed.
8.5000e+00 3.8231e-06 2.9867e-07 -2.2212e-09 -8.8983e-11
------------------------------
End of Run after 1.17 Seconds.
End of Run after 1.16 Seconds.
------------------------------

2
ex15.out
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@ -213,6 +213,6 @@ WARNING: USER_PUNCH: Headings count does not match number of calls to PUNCH.
shifts 110
END
-------------------------------
End of Run after 10.27 Seconds.
End of Run after 10.31 Seconds.
-------------------------------

2
ex15a.out
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@ -190,6 +190,6 @@ WARNING: USER_PUNCH: Headings count does not match number of calls to PUNCH.
shifts 110
END
-------------------------------
End of Run after 10.28 Seconds.
End of Run after 10.35 Seconds.
-------------------------------

6
ex15b.out
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@ -186,7 +186,7 @@ WARNING: Dispersivities were read for 1 cells. Last value is used till cell 20.
TRANSPORT Last 55 hours with background infilling solution
shifts 110
END
-------------------------------
End of Run after 10.24 Seconds.
-------------------------------
------------------------------
End of Run after 10.3 Seconds.
------------------------------

34
ex17b.out
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@ -385,7 +385,7 @@ Phase SI log IAP log K(T, P) Initial Final Delta
Anhydrite -0.77 -5.02 -4.25 0.000e+00 0 0.000e+00
Bischofite -6.95 -2.36 4.59 0.000e+00 0 0.000e+00
CO2(g) -3.50 -4.96 -1.46 1.000e+01 1.000e+01 2.572e-04
Calcite 0.00 -8.50 -8.50 7.051e-06 2.775e-04 2.704e-04
Calcite -0.00 -8.50 -8.50 7.051e-06 2.775e-04 2.704e-04
Carnallite -9.13 -4.71 4.42 0.000e+00 0 0.000e+00
Epsomite -2.50 -4.35 -1.85 0.000e+00 0 0.000e+00
Glauberite -2.83 -8.18 -5.35 0.000e+00 0 0.000e+00
@ -474,7 +474,7 @@ S(6) 4.345e-02
Bloedite -5.12 -7.47 -2.35 Na2Mg(SO4)2:4H2O
Brucite -3.23 -14.11 -10.88 Mg(OH)2
Burkeite -12.18 -12.95 -0.77 Na6CO3(SO4)2
Calcite 0.00 -8.50 -8.50 CaCO3
Calcite -0.00 -8.50 -8.50 CaCO3
Carnallite -9.13 -4.71 4.42 KMgCl3:6H2O
CO2(g) -3.50 -4.96 -1.46 CO2 Pressure 0.0 atm, phi 1.000
Dolomite 0.83 -16.25 -17.08 CaMg(CO3)2
@ -2597,10 +2597,10 @@ Phase SI log IAP log K(T, P) Initial Final Delta
Anhydrite -0.03 -4.28 -4.25 0.000e+00 0 0.000e+00
Bischofite -2.59 2.00 4.59 0.000e+00 0 0.000e+00
CO2(g) -3.50 -4.96 -1.46 1.000e+01 1.000e+01 5.023e-07
Calcite 0.00 -8.50 -8.50 3.397e-04 3.348e-04 -4.890e-06
Calcite -0.00 -8.50 -8.50 3.397e-04 3.348e-04 -4.890e-06
Carnallite -2.14 2.29 4.42 0.000e+00 0 0.000e+00
Epsomite -0.54 -2.39 -1.85 0.000e+00 0 0.000e+00
Glauberite 0.00 -5.35 -5.35 4.521e-03 4.442e-03 -7.969e-05
Glauberite -0.00 -5.35 -5.35 4.521e-03 4.442e-03 -7.969e-05
Gypsum 0.00 -4.60 -4.60 8.816e-04 9.789e-04 9.728e-05
Halite 0.00 1.58 1.58 2.051e-01 2.103e-01 5.263e-03
Hexahydrite -0.66 -2.23 -1.57 0.000e+00 0 0.000e+00
@ -2686,14 +2686,14 @@ S(6) 4.120e-01
Bloedite -0.63 -2.98 -2.35 Na2Mg(SO4)2:4H2O
Brucite -1.12 -12.00 -10.88 Mg(OH)2
Burkeite -6.66 -7.43 -0.77 Na6CO3(SO4)2
Calcite 0.00 -8.50 -8.50 CaCO3
Calcite -0.00 -8.50 -8.50 CaCO3
Carnallite -2.14 2.29 4.42 KMgCl3:6H2O
CO2(g) -3.50 -4.96 -1.46 CO2 Pressure 0.0 atm, phi 1.000
Dolomite 3.09 -13.99 -17.08 CaMg(CO3)2
Epsomite -0.54 -2.39 -1.85 MgSO4:7H2O
Gaylussite -5.18 -14.60 -9.42 CaNa2(CO3)2:5H2O
Glaserite -2.24 -6.04 -3.80 NaK3(SO4)2
Glauberite 0.00 -5.35 -5.35 Na2Ca(SO4)2
Glauberite -0.00 -5.35 -5.35 Na2Ca(SO4)2
Goergeyite 4.14 -25.23 -29.37 K2Ca5(SO4)6H2O
Gypsum 0.00 -4.60 -4.60 CaSO4:2H2O
H2O(g) -1.66 -0.16 1.50 H2O
@ -2763,7 +2763,7 @@ Gypsum 0.00 -4.60 -4.60 9.789e-04 1.003e-03 2.426e-05
Halite 0.00 1.58 1.58 2.103e-01 2.160e-01 5.650e-03
Hexahydrite -0.60 -2.17 -1.57 0.000e+00 0 0.000e+00
Kieserite -1.08 -1.35 -0.27 0.000e+00 0 0.000e+00
Polyhalite -0.00 -13.74 -13.74 0.000e+00 2.764e-04 2.764e-04
Polyhalite 0.00 -13.74 -13.74 0.000e+00 2.764e-04 2.764e-04
-----------------------------Solution composition------------------------------
@ -2874,7 +2874,7 @@ S(6) 4.421e-01
Nesquehonite -0.74 -5.90 -5.17 MgCO3:3H2O
Pentahydrite -0.72 -2.00 -1.28 MgSO4:5H2O
Pirssonite -4.90 -14.13 -9.23 Na2Ca(CO3)2:2H2O
Polyhalite -0.00 -13.74 -13.74 K2MgCa2(SO4)4:2H2O
Polyhalite 0.00 -13.74 -13.74 K2MgCa2(SO4)4:2H2O
Portlandite -9.82 -15.01 -5.19 Ca(OH)2
Schoenite -1.53 -5.85 -4.33 K2Mg(SO4)2:6H2O
Sylvite -0.62 0.28 0.90 KCl
@ -3074,12 +3074,12 @@ CO2(g) -3.50 -4.96 -1.46 1.000e+01 1.000e+01 3.007e-07
Calcite 0.00 -8.50 -8.50 3.250e-04 3.209e-04 -4.125e-06
Carnallite -2.03 2.40 4.42 0.000e+00 0 0.000e+00
Epsomite -0.38 -2.23 -1.85 0.000e+00 0 0.000e+00
Glauberite -0.00 -5.35 -5.35 3.050e-03 2.553e-03 -4.971e-04
Glauberite 0.00 -5.35 -5.35 3.050e-03 2.553e-03 -4.971e-04
Gypsum 0.00 -4.60 -4.60 9.977e-04 1.022e-03 2.423e-05
Halite 0.00 1.58 1.58 2.218e-01 2.253e-01 3.498e-03
Hexahydrite -0.49 -2.06 -1.57 0.000e+00 0 0.000e+00
Kieserite -0.94 -1.21 -0.27 0.000e+00 0 0.000e+00
Polyhalite -0.00 -13.74 -13.74 7.026e-04 9.442e-04 2.417e-04
Polyhalite 0.00 -13.74 -13.74 7.026e-04 9.442e-04 2.417e-04
-----------------------------Solution composition------------------------------
@ -3167,7 +3167,7 @@ S(6) 4.992e-01
Epsomite -0.38 -2.23 -1.85 MgSO4:7H2O
Gaylussite -5.26 -14.68 -9.42 CaNa2(CO3)2:5H2O
Glaserite -2.50 -6.31 -3.80 NaK3(SO4)2
Glauberite -0.00 -5.35 -5.35 Na2Ca(SO4)2
Glauberite 0.00 -5.35 -5.35 Na2Ca(SO4)2
Goergeyite 4.05 -25.31 -29.37 K2Ca5(SO4)6H2O
Gypsum 0.00 -4.60 -4.60 CaSO4:2H2O
H2O(g) -1.67 -0.17 1.50 H2O
@ -3190,7 +3190,7 @@ S(6) 4.992e-01
Nesquehonite -0.63 -5.79 -5.17 MgCO3:3H2O
Pentahydrite -0.61 -1.89 -1.28 MgSO4:5H2O
Pirssonite -4.94 -14.17 -9.23 Na2Ca(CO3)2:2H2O
Polyhalite -0.00 -13.74 -13.74 K2MgCa2(SO4)4:2H2O
Polyhalite 0.00 -13.74 -13.74 K2MgCa2(SO4)4:2H2O
Portlandite -9.83 -15.02 -5.19 Ca(OH)2
Schoenite -1.57 -5.90 -4.33 K2Mg(SO4)2:6H2O
Sylvite -0.70 0.21 0.90 KCl
@ -3395,7 +3395,7 @@ Gypsum -0.00 -4.60 -4.60 1.073e-03 0 -1.073e-03
Halite 0.00 1.58 1.58 2.288e-01 2.321e-01 3.245e-03
Hexahydrite -0.39 -1.96 -1.57 0.000e+00 0 0.000e+00
Kieserite -0.81 -1.08 -0.27 0.000e+00 0 0.000e+00
Polyhalite -0.00 -13.74 -13.74 1.174e-03 1.371e-03 1.974e-04
Polyhalite 0.00 -13.74 -13.74 1.174e-03 1.371e-03 1.974e-04
-----------------------------Solution composition------------------------------
@ -3506,7 +3506,7 @@ S(6) 5.660e-01
Nesquehonite -0.52 -5.68 -5.17 MgCO3:3H2O
Pentahydrite -0.50 -1.79 -1.28 MgSO4:5H2O
Pirssonite -4.97 -14.20 -9.23 Na2Ca(CO3)2:2H2O
Polyhalite -0.00 -13.74 -13.74 K2MgCa2(SO4)4:2H2O
Polyhalite 0.00 -13.74 -13.74 K2MgCa2(SO4)4:2H2O
Portlandite -9.84 -15.03 -5.19 Ca(OH)2
Schoenite -1.62 -5.95 -4.33 K2Mg(SO4)2:6H2O
Sylvite -0.76 0.14 0.90 KCl
@ -3706,7 +3706,7 @@ CO2(g) -3.50 -4.96 -1.46 1.000e+01 1.000e+01 6.913e-07
Calcite 0.00 -8.50 -8.50 2.971e-04 2.814e-04 -1.575e-05
Carnallite -1.94 2.49 4.42 0.000e+00 0 0.000e+00
Epsomite -0.16 -2.01 -1.85 0.000e+00 0 0.000e+00
Glauberite 0.00 -5.35 -5.35 9.580e-04 3.163e-04 -6.417e-04
Glauberite -0.00 -5.35 -5.35 9.580e-04 3.163e-04 -6.417e-04
Gypsum -0.02 -4.62 -4.60 0.000e+00 0 0.000e+00
Halite 0.00 1.58 1.58 2.356e-01 2.392e-01 3.565e-03
Hexahydrite -0.26 -1.83 -1.57 0.000e+00 0 0.000e+00
@ -3799,7 +3799,7 @@ S(6) 6.913e-01
Epsomite -0.16 -2.01 -1.85 MgSO4:7H2O
Gaylussite -5.36 -14.78 -9.42 CaNa2(CO3)2:5H2O
Glaserite -2.98 -6.79 -3.80 NaK3(SO4)2
Glauberite 0.00 -5.35 -5.35 Na2Ca(SO4)2
Glauberite -0.00 -5.35 -5.35 Na2Ca(SO4)2
Goergeyite 3.77 -25.60 -29.37 K2Ca5(SO4)6H2O
Gypsum -0.02 -4.62 -4.60 CaSO4:2H2O
H2O(g) -1.69 -0.19 1.50 H2O
@ -3842,6 +3842,6 @@ Reading input data for simulation 2.
------------------------------------
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End of Run after 0.14 Seconds.
End of Run after 0.13 Seconds.
------------------------------

2
ex19.out
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@ -69,6 +69,6 @@ Reading input data for simulation 1.
PRINT
reset false
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End of Run after 0.03 Seconds.
End of Run after 0.02 Seconds.
------------------------------

6
ex19b.out
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@ -22,7 +22,7 @@ Reading input data for simulation 1.
TITLE Example 19B.--Cd sorption on X, Hfo and OC in loamy soil
PRINT
reset false
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End of Run after 0.1 Seconds.
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End of Run after 0.11 Seconds.
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2
ex2.out
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@ -4354,6 +4354,6 @@ Reading input data for simulation 2.
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End of Run after 0.04 Seconds.
End of Run after 0.05 Seconds.
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2
ex20b.out
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@ -53631,6 +53631,6 @@ Reading input data for simulation 114.
--------------------------------------
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End of Run after 1.27 Seconds.
End of Run after 1.28 Seconds.
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2
ex21.out
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@ -961,6 +961,6 @@ WARNING: No dispersivities were read; disp = 0 assumed.
END
END
-------------------------------
End of Run after 18.18 Seconds.
End of Run after 18.26 Seconds.
-------------------------------

2
ex2b.out
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@ -24,6 +24,6 @@ Reading input data for simulation 1.
PRINT
reset false
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End of Run after 0.03 Seconds.
End of Run after 0.04 Seconds.
------------------------------

2
ex6.out
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@ -3883,6 +3883,6 @@ Reading input data for simulation 12.
-------------------------------------
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End of Run after 0.48 Seconds.
End of Run after 0.47 Seconds.
------------------------------

2
ex9.out
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@ -1355,6 +1355,6 @@ Reading input data for simulation 3.
------------------------------------
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End of Run after 0.04 Seconds.
End of Run after 0.05 Seconds.
------------------------------