research/cantera
1
0
Fork 0
Code Issues Pull requests Projects Releases Packages Wiki Activity Actions

Rebaselined test problem.

Browse source
This commit is contained in:
Harry Moffat 2008-06-26 17:49:59 +00:00
parent d16c113e55
commit 4e051200f8
2 changed files with 34 additions and 32 deletions
Show stats Download patch file Download diff file Expand all files Collapse all files

33
test_problems/VCSnonideal/NaCl_equil/good_dout.txt
View file

@ -485,9 +485,10 @@ VCS CALCULATION METHOD
MultiPhase Object
13 SPECIES 11 ELEMENTS 7 COMPONENTS
5 PHASE1 SPECIES 7 PHASE2 SPECIES 1 SINGLE SPECIES PHASES
13 SPECIES
11 ELEMENTS
7 COMPONENTS
3 PHASES
PRESSURE 101325 Pa
TEMPERATURE 298.150 K
PHASE1 INERTS 0.000
@ -513,19 +514,19 @@ VCS CALCULATION METHOD
SPECIES FORMULA VECTOR STAN_CHEM_POT EQUILIBRIUM_EST. Species_Type
O H C N Na Cl cn Fe E Si Ca SI(I)
Na+ 0 0 0 0 1 0 1 0 -1 0 0 1 -2.57752E+08 5.00000E+00 Mol_Num
Cl- 0 0 0 0 0 1 -1 0 1 0 0 1 -1.83974E+08 5.00000E+00 Mol_Num
N2 0 0 0 2 0 0 0 0 0 0 0 2 -5.71282E+07 4.00000E+00 Mol_Num
H2O(L) 1 2 0 0 0 0 0 0 -0 0 0 1 -3.06686E+08 1.87965E+00 Mol_Num
OH- 1 1 0 0 0 0 -1 0 1 0 0 1 -2.26784E+08 1.20348E-01 Mol_Num
CO2 2 0 1 0 0 0 0 0 0 0 0 2 -4.57249E+08 0.00000E+00 Mol_Num
H2 0 2 0 0 0 0 0 0 0 0 0 2 -3.89624E+07 1.86050E-14 Mol_Num
H+ 0 1 0 0 0 0 1 0 -1 0 0 1 0.00000E+00 1.20348E-01 Mol_Num
H2O 1 2 0 0 0 0 0 0 0 0 0 2 -2.98124E+08 2.25617E-20 Mol_Num
NaCl 0 0 0 0 1 1 0 0 0 0 0 2 -2.49904E+08 3.54670E-44 Mol_Num
O2 2 0 0 0 0 0 0 0 0 0 0 2 -6.11650E+07 1.54458E-41 Mol_Num
NaCl(S) 0 0 0 0 1 1 0 0 0 0 0 0 -4.32620E+08 0.00000E+00 Mol_Num
OH 1 1 0 0 0 0 0 0 0 0 0 2 -2.26793E+08 3.72100E-14 Mol_Num
Na+ 0 0 0 0 1 0 1 0 -1 0 0 0 -2.57752E+08 5.00000E+00 Mol_Num
Cl- 0 0 0 0 0 1 -1 0 1 0 0 0 -1.83974E+08 5.00000E+00 Mol_Num
N2 0 0 0 2 0 0 0 0 0 0 0 1 -5.71282E+07 4.00000E+00 Mol_Num
H2O(L) 1 2 0 0 0 0 0 0 -0 0 0 0 -3.06686E+08 1.87965E+00 Mol_Num
OH- 1 1 0 0 0 0 -1 0 1 0 0 0 -2.26784E+08 1.20348E-01 Mol_Num
CO2 2 0 1 0 0 0 0 0 0 0 0 1 -4.57249E+08 0.00000E+00 Mol_Num
H2 0 2 0 0 0 0 0 0 0 0 0 1 -3.89624E+07 1.86050E-14 Mol_Num
H+ 0 1 0 0 0 0 1 0 -1 0 0 0 0.00000E+00 1.20348E-01 Mol_Num
H2O 1 2 0 0 0 0 0 0 0 0 0 1 -2.98124E+08 2.25617E-20 Mol_Num
NaCl 0 0 0 0 1 1 0 0 0 0 0 1 -2.49904E+08 3.54670E-44 Mol_Num
O2 2 0 0 0 0 0 0 0 0 0 0 1 -6.11650E+07 1.54458E-41 Mol_Num
NaCl(S) 0 0 0 0 1 1 0 0 0 0 0 2 -4.32620E+08 0.00000E+00 Mol_Num
OH 1 1 0 0 0 0 0 0 0 0 0 1 -2.26793E+08 3.72100E-14 Mol_Num
--- Subroutine vcs_dfe called for all species
-----------------------------------------------------------------------------
--- Subroutine BASOPT called to reevaluate the components

33
test_problems/VCSnonideal/NaCl_equil/good_out.txt
View file

@ -132,9 +132,10 @@ VCS CALCULATION METHOD
MultiPhase Object
13 SPECIES 11 ELEMENTS 7 COMPONENTS
5 PHASE1 SPECIES 7 PHASE2 SPECIES 1 SINGLE SPECIES PHASES
13 SPECIES
11 ELEMENTS
7 COMPONENTS
3 PHASES
PRESSURE 101325 Pa
TEMPERATURE 298.150 K
PHASE1 INERTS 0.000
@ -160,19 +161,19 @@ VCS CALCULATION METHOD
SPECIES FORMULA VECTOR STAN_CHEM_POT EQUILIBRIUM_EST. Species_Type
O H C N Na Cl cn Fe E Si Ca SI(I)
Na+ 0 0 0 0 1 0 1 0 -1 0 0 1 -2.57752E+08 5.00000E+00 Mol_Num
Cl- 0 0 0 0 0 1 -1 0 1 0 0 1 -1.83974E+08 5.00000E+00 Mol_Num
N2 0 0 0 2 0 0 0 0 0 0 0 2 -5.71282E+07 4.00000E+00 Mol_Num
H2O(L) 1 2 0 0 0 0 0 0 -0 0 0 1 -3.06686E+08 1.87965E+00 Mol_Num
OH- 1 1 0 0 0 0 -1 0 1 0 0 1 -2.26784E+08 1.20348E-01 Mol_Num
CO2 2 0 1 0 0 0 0 0 0 0 0 2 -4.57249E+08 0.00000E+00 Mol_Num
H2 0 2 0 0 0 0 0 0 0 0 0 2 -3.89624E+07 1.86050E-14 Mol_Num
H+ 0 1 0 0 0 0 1 0 -1 0 0 1 0.00000E+00 1.20348E-01 Mol_Num
H2O 1 2 0 0 0 0 0 0 0 0 0 2 -2.98124E+08 2.25617E-20 Mol_Num
NaCl 0 0 0 0 1 1 0 0 0 0 0 2 -2.49904E+08 3.54670E-44 Mol_Num
O2 2 0 0 0 0 0 0 0 0 0 0 2 -6.11650E+07 1.54458E-41 Mol_Num
NaCl(S) 0 0 0 0 1 1 0 0 0 0 0 0 -4.32620E+08 0.00000E+00 Mol_Num
OH 1 1 0 0 0 0 0 0 0 0 0 2 -2.26793E+08 3.72100E-14 Mol_Num
Na+ 0 0 0 0 1 0 1 0 -1 0 0 0 -2.57752E+08 5.00000E+00 Mol_Num
Cl- 0 0 0 0 0 1 -1 0 1 0 0 0 -1.83974E+08 5.00000E+00 Mol_Num
N2 0 0 0 2 0 0 0 0 0 0 0 1 -5.71282E+07 4.00000E+00 Mol_Num
H2O(L) 1 2 0 0 0 0 0 0 -0 0 0 0 -3.06686E+08 1.87965E+00 Mol_Num
OH- 1 1 0 0 0 0 -1 0 1 0 0 0 -2.26784E+08 1.20348E-01 Mol_Num
CO2 2 0 1 0 0 0 0 0 0 0 0 1 -4.57249E+08 0.00000E+00 Mol_Num
H2 0 2 0 0 0 0 0 0 0 0 0 1 -3.89624E+07 1.86050E-14 Mol_Num
H+ 0 1 0 0 0 0 1 0 -1 0 0 0 0.00000E+00 1.20348E-01 Mol_Num
H2O 1 2 0 0 0 0 0 0 0 0 0 1 -2.98124E+08 2.25617E-20 Mol_Num
NaCl 0 0 0 0 1 1 0 0 0 0 0 1 -2.49904E+08 3.54670E-44 Mol_Num
O2 2 0 0 0 0 0 0 0 0 0 0 1 -6.11650E+07 1.54458E-41 Mol_Num
NaCl(S) 0 0 0 0 1 1 0 0 0 0 0 2 -4.32620E+08 0.00000E+00 Mol_Num
OH 1 1 0 0 0 0 0 0 0 0 0 1 -2.26793E+08 3.72100E-14 Mol_Num