From 1f34b14e8d3ca7504a147ca1093730980d7411a3 Mon Sep 17 00:00:00 2001 From: Harry Moffat Date: Sun, 19 Apr 2009 02:51:53 +0000 Subject: [PATCH] Fixed the no-debug solution. it was out of sync. --- .../HMW_test_1/output_noD_blessed.txt | 34 +++++++++---------- 1 file changed, 17 insertions(+), 17 deletions(-) diff --git a/test_problems/cathermo/HMW_test_1/output_noD_blessed.txt b/test_problems/cathermo/HMW_test_1/output_noD_blessed.txt index 086f9a8a3..966d76de0 100644 --- a/test_problems/cathermo/HMW_test_1/output_noD_blessed.txt +++ b/test_problems/cathermo/HMW_test_1/output_noD_blessed.txt @@ -8,9 +8,9 @@ Index Name MoleF MolalityCropped Charge Species Species beta0MX beta1MX beta2MX CphiMX alphaMX thetaij Cl- H+ 0.17750 0.29450 0.00000 0.00080 2.00000 0.00000 Cl- Na+ 0.07650 0.26640 0.00000 0.00127 2.00000 0.00000 - Cl- OH- 0.00000 0.00000 0.00000 0.00000 0.00000 -0.05000 - H+ Na+ 0.00000 0.00000 0.00000 0.00000 0.00000 0.03600 - H+ OH- 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 + Cl- OH- 0.00000 0.00000 0.00000 0.00000 2.00000 -0.05000 + H+ Na+ 0.00000 0.00000 0.00000 0.00000 2.00000 0.03600 + H+ OH- 0.00000 0.00000 0.00000 0.00000 2.00000 0.00000 Na+ OH- 0.08640 0.25300 0.00000 0.00440 2.00000 0.00000 Species Species Species psi @@ -37,22 +37,22 @@ a2 = 3.04284e-10 Species Standard chemical potentials (kJ/gmol) ------------------------------------------------------------ H2O(L) -306.685777 - Cl- -131.064852 - H+ 0.0017225 - Na+ -311.160543 - OH- -226.880122 + Cl- -131.066575 + H+ 0 + Na+ -311.162266 + OH- -226.881844 ------------------------------------------------------------ Some DeltaSS values: Delta(mu_0) - NaCl(S): Na+ + Cl- -> NaCl(S): 9.594995 kJ/gmol - : 3.870573 (dimensionless) - : 1.680969 (dimensionless/ln10) + NaCl(S): Na+ + Cl- -> NaCl(S): 9.59844 kJ/gmol + : 3.871963 (dimensionless) + : 1.681572 (dimensionless/ln10) G0(NaCl(S)) = -432.6304 (fixed) - G0(Na+) = -311.1605 - G0(Cl-) = -131.0649 - OH-: H2O(L) - H+ -> OH-: 79.80738 kJ/gmol - : 32.1939 (dimensionless) - : 13.98163 (dimensionless/ln10) - G0(OH-) = -226.8801 - G0(H+) = 0.0017225 + G0(Na+) = -311.1623 + G0(Cl-) = -131.0666 + OH-: H2O(L) - H+ -> OH-: 79.80393 kJ/gmol + : 32.19251 (dimensionless) + : 13.98103 (dimensionless/ln10) + G0(OH-) = -226.8818 + G0(H+) = 0 G0(H2O(L)) = -306.6858 ------------------------------------------------------------