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reactingMixture: use the foamChemistryReader directly rather than chemistryReader::New

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This formalises the flexible and extensible OpenFOAM thermodynamics and reaction
format as the direct input to OpenFOAM solvers.  The CHEMKIN format is still
supported by first converting to the OpenFOAM format using the chemkinToFoam
utility.
This commit is contained in:
Henry Weller
2019-08-02 14:47:37 +01:00
parent 50dc057184
commit 4baf73b54d
57 changed files with 82 additions and 438 deletions
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1
tutorials/combustion/chemFoam/gri/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo";

4
tutorials/combustion/chemFoam/h2/Allclean
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@ -6,7 +6,7 @@ cd ${0%/*} || exit 1 # Run from this directory
cleanCase
rm -rf 0 chemFoam.out validation/OF_vs_CHEMKINII.eps validation/chemkinII
rm -rf 0 chemFoam.out constant/reactions constant/thermo \
validation/OF_vs_CHEMKINII.eps validation/chemkinII
#------------------------------------------------------------------------------

4
tutorials/combustion/chemFoam/h2/Allrun
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@ -7,6 +7,10 @@ cd ${0%/*} || exit 1 # Run from this directory
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/chem.inp chemkin/therm.dat chemkin/transportProperties \
constant/reactions constant/thermo
runApplication $application
(cd validation && ./Allrun $*)

5
tutorials/combustion/chemFoam/h2/constant/thermophysicalProperties
View File

@ -26,8 +26,7 @@ thermoType
specie specie;
}
CHEMKINFile "$FOAM_CASE/chemkin/chem.inp";
CHEMKINThermoFile "$FOAM_CASE/chemkin/therm.dat";
CHEMKINTransportFile "$FOAM_CASE/chemkin/transportProperties";
foamChemistryFile "$FOAM_CASE/constant/reactions";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo";
// ************************************************************************* //

4
tutorials/combustion/chemFoam/ic8h18/Allclean
View File

@ -6,7 +6,7 @@ cd ${0%/*} || exit 1 # Run from this directory
cleanCase
rm -rf 0 chemFoam.out validation/OF_vs_CHEMKINII.eps validation/chemkinII
rm -rf 0 chemFoam.out constant/reactions constant/thermo \
validation/OF_vs_CHEMKINII.eps validation/chemkinII
#------------------------------------------------------------------------------

4
tutorials/combustion/chemFoam/ic8h18/Allrun
View File

@ -7,6 +7,10 @@ cd ${0%/*} || exit 1 # Run from this directory
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/chem.inp chemkin/therm.dat chemkin/transportProperties \
constant/reactions constant/thermo
runApplication $application
(cd validation && ./Allrun $*)

5
tutorials/combustion/chemFoam/ic8h18/constant/thermophysicalProperties
View File

@ -26,8 +26,7 @@ thermoType
specie specie;
}
CHEMKINFile "$FOAM_CASE/chemkin/chem.inp";
CHEMKINThermoFile "$FOAM_CASE/chemkin/therm.dat";
CHEMKINTransportFile "$FOAM_CASE/chemkin/transportProperties";
foamChemistryFile "$FOAM_CASE/constant/reactions";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo";
// ************************************************************************* //

3
tutorials/combustion/chemFoam/ic8h18_TDAC/Allclean
View File

@ -6,6 +6,7 @@ cd ${0%/*} || exit 1 # Run from this directory
cleanCase
rm -rf 0 chemFoam.out validation/OF_vs_CHEMKINII.eps validation/chemkinII
rm -rf 0 chemFoam.out constant/reactions constant/thermo \
validation/OF_vs_CHEMKINII.eps validation/chemkinII
#------------------------------------------------------------------------------

4
tutorials/combustion/chemFoam/ic8h18_TDAC/Allrun
View File

@ -7,6 +7,10 @@ cd ${0%/*} || exit 1 # Run from this directory
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/chem.inp chemkin/therm.dat chemkin/transportProperties \
constant/reactions constant/thermo
runApplication $application
(cd validation && ./Allrun $*)

5
tutorials/combustion/chemFoam/ic8h18_TDAC/constant/thermophysicalProperties
View File

@ -26,8 +26,7 @@ thermoType
specie specie;
}
CHEMKINFile "$FOAM_CASE/chemkin/chem.inp";
CHEMKINThermoFile "$FOAM_CASE/chemkin/therm.dat";
CHEMKINTransportFile "$FOAM_CASE/chemkin/transportProperties";
foamChemistryFile "$FOAM_CASE/constant/reactions";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo";
// ************************************************************************* //

4
tutorials/combustion/chemFoam/nc7h16/Allclean
View File

@ -6,7 +6,7 @@ cd ${0%/*} || exit 1 # Run from this directory
cleanCase
rm -rf 0 chemFoam.out validation/OF_vs_CHEMKINII.eps validation/chemkinII
rm -rf 0 chemFoam.out constant/reactions constant/thermo \
validation/OF_vs_CHEMKINII.eps validation/chemkinII
#------------------------------------------------------------------------------

4
tutorials/combustion/chemFoam/nc7h16/Allrun
View File

@ -7,6 +7,10 @@ cd ${0%/*} || exit 1 # Run from this directory
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/chem.inp chemkin/therm.dat chemkin/transportProperties \
constant/reactions constant/thermo
runApplication $application
(cd validation && ./Allrun $*)

5
tutorials/combustion/chemFoam/nc7h16/constant/thermophysicalProperties
View File

@ -26,8 +26,7 @@ thermoType
specie specie;
}
CHEMKINFile "$FOAM_CASE/chemkin/chem.inp";
CHEMKINThermoFile "$FOAM_CASE/chemkin/therm.dat";
CHEMKINTransportFile "$FOAM_CASE/chemkin/transportProperties";
foamChemistryFile "$FOAM_CASE/constant/reactions";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo";
// ************************************************************************* //

1
tutorials/combustion/coldEngineFoam/freePiston/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie air;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/include/reactions.air";

1
tutorials/combustion/fireFoam/LES/flameSpreadWaterSuppressionPanel/constant/pyrolysisRegion/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/pyrolysisRegion/reactions";

1
tutorials/combustion/fireFoam/LES/flameSpreadWaterSuppressionPanel/constant/thermophysicalProperties
View File

@ -30,7 +30,6 @@ inertSpecie N2;
fuel C3H8;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/fireFoam/LES/oppositeBurningPanels/constant/panelRegion/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/panelRegion/reactions";

1
tutorials/combustion/fireFoam/LES/oppositeBurningPanels/constant/thermophysicalProperties
View File

@ -30,7 +30,6 @@ inertSpecie N2;
fuel C3H8;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/fireFoam/LES/smallPoolFire2D/constant/thermophysicalProperties
View File

@ -30,7 +30,6 @@ inertSpecie N2;
fuel CH4;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/fireFoam/LES/smallPoolFire3D/constant/thermophysicalProperties
View File

@ -30,7 +30,6 @@ inertSpecie N2;
fuel CH4;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/reactingFoam/RAS/DLR_A_LTS/constant/thermophysicalProperties
View File

@ -29,7 +29,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactionsGRI";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo.compressibleGasGRI";

1
tutorials/combustion/reactingFoam/RAS/SandiaD_LTS/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactionsGRI";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo.compressibleGasGRI";

1
tutorials/combustion/reactingFoam/RAS/membrane/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/reactingFoam/laminar/counterFlowFlame2D/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/reactingFoam/laminar/counterFlowFlame2DLTS/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/combustion/reactingFoam/laminar/counterFlowFlame2DLTS_GRI_TDAC/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactionsGRI";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo.compressibleGasGRI";

1
tutorials/combustion/reactingFoam/laminar/counterFlowFlame2D_GRI/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactionsGRI";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo.compressibleGasGRI";

1
tutorials/combustion/reactingFoam/laminar/counterFlowFlame2D_GRI_TDAC/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactionsGRI";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo.compressibleGasGRI";

1
tutorials/heatTransfer/chtMultiRegionFoam/reverseBurner/constant/gas/thermophysicalProperties
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@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/gas/reactions";

1
tutorials/lagrangian/coalChemistryFoam/simplifiedSiwek/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryThermoFile "$FOAM_CASE/constant/foam.dat";

1
tutorials/lagrangian/reactingParcelFoam/counterFlowFlame2DLTS/constant/thermophysicalProperties
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie N2;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/lagrangian/reactingParcelFoam/cylinder/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/foam.inp";

1
tutorials/lagrangian/reactingParcelFoam/filter/constant/thermophysicalProperties
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@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/lagrangian/reactingParcelFoam/hotBoxes/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/foam.inp";

1
tutorials/lagrangian/reactingParcelFoam/parcelInBox/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/lagrangian/reactingParcelFoam/rivuletPanel/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/foam.inp";

1
tutorials/lagrangian/reactingParcelFoam/splashPanel/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/foam.inp";

1
tutorials/lagrangian/reactingParcelFoam/verticalChannel/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/lagrangian/reactingParcelFoam/verticalChannelLTS/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

1
tutorials/lagrangian/simpleReactingParcelFoam/verticalChannel/constant/thermophysicalProperties
View File

@ -26,7 +26,6 @@ thermoType
specie specie;
}
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions";

11
tutorials/lagrangian/sprayFoam/aachenBomb/Allclean Executable file
View File

@ -0,0 +1,11 @@
#!/bin/sh
cd ${0%/*} || exit 1 # Run from this directory
# Source tutorial run functions
. $WM_PROJECT_DIR/bin/tools/CleanFunctions
cleanCase
rm -rf constant/reactions constant/thermo
#------------------------------------------------------------------------------

17
tutorials/lagrangian/sprayFoam/aachenBomb/Allrun Executable file
View File

@ -0,0 +1,17 @@
#!/bin/sh
cd ${0%/*} || exit 1 # Run from this directory
# Source tutorial run functions
. $WM_PROJECT_DIR/bin/tools/RunFunctions
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/chem.inp chemkin/therm.dat chemkin/transportProperties \
constant/reactions constant/thermo
runApplication blockMesh
runApplication $application
#------------------------------------------------------------------------------

5
tutorials/lagrangian/sprayFoam/aachenBomb/constant/thermophysicalProperties
View File

@ -26,9 +26,8 @@ thermoType
specie specie;
}
CHEMKINFile "$FOAM_CASE/chemkin/chem.inp";
CHEMKINThermoFile "$FOAM_CASE/chemkin/therm.dat";
CHEMKINTransportFile "$FOAM_CASE/chemkin/transportProperties";
foamChemistryFile "$FOAM_CASE/constant/reactions";
foamChemistryThermoFile "$FOAM_CASE/constant/thermo";
newFormat yes;

1
tutorials/multiphase/reactingTwoPhaseEulerFoam/RAS/bubbleColumnEvaporatingReacting/constant/thermophysicalProperties.gas
View File

@ -28,7 +28,6 @@ thermoType
inertSpecie AIR;
chemistryReader foamChemistryReader;
foamChemistryFile "$FOAM_CASE/constant/reactions.gas";