diff --git a/test_problems/cathermo/HMW_test_3/output_noD_blessed.txt b/test_problems/cathermo/HMW_test_3/output_noD_blessed.txt index 937ac3864..ad9c54a6a 100644 --- a/test_problems/cathermo/HMW_test_3/output_noD_blessed.txt +++ b/test_problems/cathermo/HMW_test_3/output_noD_blessed.txt @@ -11,9 +11,9 @@ 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+ 0.10037 0.37071 0.00000 -0.00457 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 @@ -38,16 +38,16 @@ Index Name MoleF MolalityCropped Charge Species Standard chemical potentials (kJ/gmol) ------------------------------------------------------------ H2O(L) -317.175857 - Cl- -186.014783 - H+ 0.0017225 - Na+ -441.615962 - OH- -322.000801 + Cl- -186.016505 + H+ 0 + Na+ -441.617685 + OH- -322.002524 ------------------------------------------------------------ Some DeltaSS values: Delta(mu_0) - NaCl(S): Na+ + Cl- -> NaCl(S): 195.0003 kJ/gmol - : 78.66216 (dimensionless) - : 34.16254 (dimensionless/ln10) - OH-: H2O(L) - H+ -> OH-: -4.823222 kJ/gmol - : -1.945664 (dimensionless) - : -0.8449909 (dimensionless/ln10) + NaCl(S): Na+ + Cl- -> NaCl(S): 195.0038 kJ/gmol + : 78.66355 (dimensionless) + : 34.16315 (dimensionless/ln10) + OH-: H2O(L) - H+ -> OH-: -4.826667 kJ/gmol + : -1.947053 (dimensionless) + : -0.8455945 (dimensionless/ln10) ------------------------------------------------------------