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ENH: Updated chemistry solvers

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This commit is contained in:
andy
2011-06-02 18:34:38 +01:00
parent a1e86f73ba
commit bbd0a8e0c0
7 changed files with 102 additions and 72 deletions
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12
src/thermophysicalModels/chemistryModel/chemistryModel/ODEChemistryModel/ODEChemistryModel.C
View File

@ -848,11 +848,13 @@ Foam::scalar Foam::ODEChemistryModel<CompType, ThermoType>::solve
notImplemented
(
"ODEChemistryModel::solve"
"scalarField&, "
"const scalar, "
"const scalar, "
"const scalar, "
"const scalar"
"("
"scalarField&, "
"const scalar, "
"const scalar, "
"const scalar, "
"const scalar"
")"
);
return (0);

14
src/thermophysicalModels/chemistryModel/chemistryModel/makeChemistryModel.H
View File

@ -48,13 +48,6 @@ namespace Foam
SS##Comp##Thermo, \
#SS"<"#Comp","#Thermo">", \
0 \
); \
\
addToRunTimeSelectionTable \
( \
Comp, \
SS##Comp##Thermo, \
fvMesh \
);
@ -67,13 +60,6 @@ namespace Foam
SS##Comp##SThermo##GThermo, \
#SS"<"#Comp","#SThermo","#GThermo">", \
0 \
); \
\
addToRunTimeSelectionTable \
( \
Comp, \
SS##Comp##SThermo##GThermo, \
fvMesh \
);

68
src/thermophysicalModels/chemistryModel/chemistryModel/psiChemistryModel/psiChemistryModelNew.C
View File

@ -2,7 +2,7 @@
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration |
\\ / A nd | Copyright (C) 2009-2010 OpenCFD Ltd.
\\ / A nd | Copyright (C) 2009-2011 OpenCFD Ltd.
\\/ M anipulation |
-------------------------------------------------------------------------------
License
@ -32,24 +32,40 @@ Foam::autoPtr<Foam::psiChemistryModel> Foam::psiChemistryModel::New
const fvMesh& mesh
)
{
// get model name, but do not register the dictionary
// otherwise it is registered in the database twice
const word userModel
IOdictionary chemistryPropertiesDict
(
IOdictionary
IOobject
(
IOobject
(
"chemistryProperties",
mesh.time().constant(),
mesh,
IOobject::MUST_READ_IF_MODIFIED,
IOobject::NO_WRITE,
false
)
).lookup("psiChemistryModel")
"chemistryProperties",
mesh.time().constant(),
mesh,
IOobject::MUST_READ,
IOobject::NO_WRITE,
false
)
);
const word solver(chemistryPropertiesDict.lookup("chemistrySolver"));
wordList models = fvMeshConstructorTablePtr_->sortedToc();
wordHashSet validModels;
forAll(models, i)
{
label delim = models[i].find('<');
validModels.insert(models[i](0, delim));
}
wordHashSet::iterator solverIter = validModels.find(solver);
if (solverIter == validModels.end())
{
FatalErrorIn("psiChemistryModel::New(const fvMesh&)")
<< "Valid chemistrySolver types are:" << validModels
<< exit(FatalError);
}
const word userModel(chemistryPropertiesDict.lookup("psiChemistryModel"));
// construct chemistry model type name by inserting first template argument
const label tempOpen = userModel.find('<');
const label tempClose = userModel.find('>');
@ -59,7 +75,7 @@ Foam::autoPtr<Foam::psiChemistryModel> Foam::psiChemistryModel::New
userModel(tempOpen + 1, tempClose - tempOpen - 1);
const word modelType =
className + '<' + typeName + ',' + thermoTypeName + '>';
solver + '<' + className + '<' + typeName + ',' + thermoTypeName + ">>";
if (debug)
{
@ -77,7 +93,7 @@ Foam::autoPtr<Foam::psiChemistryModel> Foam::psiChemistryModel::New
{
if (debug)
{
FatalErrorIn("psiChemistryModelBase::New(const mesh&)")
FatalErrorIn("psiChemistryModel::New(const mesh&)")
<< "Unknown psiChemistryModel type "
<< modelType << nl << nl
<< "Valid psiChemistryModel types are:" << nl
@ -86,16 +102,22 @@ Foam::autoPtr<Foam::psiChemistryModel> Foam::psiChemistryModel::New
}
else
{
wordList models = fvMeshConstructorTablePtr_->sortedToc();
forAll(models, i)
wordList allModels(fvMeshConstructorTablePtr_->sortedToc());
wordHashSet models;
forAll(allModels, i)
{
models[i] = models[i].replace(typeName + ',', "");
const label tempOpen = allModels[i].find('<');
const label tempClose = allModels[i].rfind('>');
word modelName =
allModels[i](tempOpen + 1, tempClose - tempOpen - 1);
modelName = modelName.replace(typeName + ',', "");
models.insert(modelName);
}
FatalErrorIn("psiChemistryModelBase::New(const mesh&)")
FatalErrorIn("psiChemistryModel::New(const mesh&)")
<< "Unknown psiChemistryModel type " << userModel
<< nl << nl << "Valid psiChemistryModel types are:" << nl
<< models << nl << exit(FatalError);
<< nl << nl << "Valid psiChemistryModel types are:"
<< models << exit(FatalError);
}
}

72
src/thermophysicalModels/chemistryModel/chemistryModel/rhoChemistryModel/rhoChemistryModelNew.C
View File

@ -2,7 +2,7 @@
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration |
\\ / A nd | Copyright (C) 2009-2010 OpenCFD Ltd.
\\ / A nd | Copyright (C) 2009-2011 OpenCFD Ltd.
\\/ M anipulation |
-------------------------------------------------------------------------------
License
@ -32,24 +32,40 @@ Foam::autoPtr<Foam::rhoChemistryModel> Foam::rhoChemistryModel::New
const fvMesh& mesh
)
{
// get model name, but do not register the dictionary
// otherwise it is registered in the database twice
const word userModel
IOdictionary chemistryPropertiesDict
(
IOdictionary
IOobject
(
IOobject
(
"chemistryProperties",
mesh.time().constant(),
mesh,
IOobject::MUST_READ_IF_MODIFIED,
IOobject::NO_WRITE,
false
)
).lookup("rhoChemistryModel")
"chemistryProperties",
mesh.time().constant(),
mesh,
IOobject::MUST_READ,
IOobject::NO_WRITE,
false
)
);
const word solver(chemistryPropertiesDict.lookup("chemistrySolver"));
wordList models = fvMeshConstructorTablePtr_->sortedToc();
wordHashSet validModels;
forAll(models, i)
{
label delim = models[i].find('<');
validModels.insert(models[i](0, delim));
}
wordHashSet::iterator solverIter = validModels.find(solver);
if (solverIter == validModels.end())
{
FatalErrorIn("rhoChemistryModel::New(const fvMesh&)")
<< "Valid chemistrySolver types are:" << validModels
<< exit(FatalError);
}
const word userModel(chemistryPropertiesDict.lookup("rhoChemistryModel"));
// construct chemistry model type name by inserting first template argument
const label tempOpen = userModel.find('<');
const label tempClose = userModel.find('>');
@ -59,7 +75,7 @@ Foam::autoPtr<Foam::rhoChemistryModel> Foam::rhoChemistryModel::New
userModel(tempOpen + 1, tempClose - tempOpen - 1);
const word modelType =
className + '<' + typeName + ',' + thermoTypeName + '>';
solver + '<' + className + '<' + typeName + ',' + thermoTypeName + ">>";
if (debug)
{
@ -77,7 +93,7 @@ Foam::autoPtr<Foam::rhoChemistryModel> Foam::rhoChemistryModel::New
{
if (debug)
{
FatalErrorIn("rhoChemistryModelBase::New(const mesh&)")
FatalErrorIn("rhoChemistryModel::New(const mesh&)")
<< "Unknown rhoChemistryModel type "
<< modelType << nl << nl
<< "Valid rhoChemistryModel types are:" << nl
@ -86,18 +102,22 @@ Foam::autoPtr<Foam::rhoChemistryModel> Foam::rhoChemistryModel::New
}
else
{
wordList models = fvMeshConstructorTablePtr_->sortedToc();
forAll(models, i)
wordList allModels(fvMeshConstructorTablePtr_->sortedToc());
wordHashSet models;
forAll(allModels, i)
{
models[i] = models[i].replace(typeName + ',', "");
const label tempOpen = allModels[i].find('<');
const label tempClose = allModels[i].rfind('>');
word modelName =
allModels[i](tempOpen + 1, tempClose - tempOpen - 1);
modelName = modelName.replace(typeName + ',', "");
models.insert(modelName);
}
FatalErrorIn("rhoChemistryModelBase::New(const mesh&)")
<< "Unknown rhoChemistryModel type "
<< userModel << nl << nl
<< "Valid rhoChemistryModel types are:" << nl
<< models << nl
<< exit(FatalError);
FatalErrorIn("rhoChemistryModel::New(const mesh&)")
<< "Unknown rhoChemistryModel type " << userModel
<< nl << nl << "Valid rhoChemistryModel types are:"
<< models << exit(FatalError);
}
}

2
src/thermophysicalModels/chemistryModel/chemistrySolver/EulerImplicit/EulerImplicit.C
View File

@ -38,7 +38,7 @@ Foam::EulerImplicit<ODEChemistryType>::EulerImplicit
)
:
chemistrySolver<ODEChemistryType>(mesh, ODEModelName, thermoType),
coeffsDict_(this->subDict(ODEModelName + "Coeffs")),
coeffsDict_(this->subDict("EulerImplicitCoeffs")),
cTauChem_(readScalar(coeffsDict_.lookup("cTauChem"))),
eqRateLimiter_(coeffsDict_.lookup("equilibriumRateLimiter"))
{}

4
src/thermophysicalModels/chemistryModel/chemistrySolver/ode/ode.C
View File

@ -37,8 +37,8 @@ Foam::ode<ODEChemistryType>::ode
)
:
chemistrySolver<ODEChemistryType>(mesh, ODEModelName, thermoType),
coeffsDict_(this->subDict(ODEModelName + "Coeffs")),
solverName_(coeffsDict_.lookup("ODESolver")),
coeffsDict_(this->subDict("odeCoeffs")),
solverName_(coeffsDict_.lookup("solver")),
odeSolver_(ODESolver::New(solverName_, *this)),
eps_(readScalar(coeffsDict_.lookup("eps")))
{}

2
src/thermophysicalModels/chemistryModel/chemistrySolver/sequential/sequential.C
View File

@ -37,7 +37,7 @@ Foam::sequential<ODEChemistryType>::sequential
)
:
chemistrySolver<ODEChemistryType>(mesh, ODEModelName, thermoType),
coeffsDict_(this->subDict(ODEModelName + "Coeffs")),
coeffsDict_(this->subDict("sequentialCoeffs")),
cTauChem_(readScalar(coeffsDict_.lookup("cTauChem"))),
eqRateLimiter_(coeffsDict_.lookup("equilibriumRateLimiter"))
{}