opm-simulators/opm/models/io/vtkcompositionmodule.hh

333 lines
12 KiB
C++

// -*- mode: C++; tab-width: 4; indent-tabs-mode: nil; c-basic-offset: 4 -*-
// vi: set et ts=4 sw=4 sts=4:
/*
This file is part of the Open Porous Media project (OPM).
OPM is free software: you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation, either version 2 of the License, or
(at your option) any later version.
OPM is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License
along with OPM. If not, see <http://www.gnu.org/licenses/>.
Consult the COPYING file in the top-level source directory of this
module for the precise wording of the license and the list of
copyright holders.
*/
/*!
* \file
* \copydoc Opm::VtkCompositionModule
*/
#ifndef EWOMS_VTK_COMPOSITION_MODULE_HH
#define EWOMS_VTK_COMPOSITION_MODULE_HH
#include <opm/material/common/MathToolbox.hpp>
#include <opm/models/discretization/common/fvbaseparameters.hh>
#include <opm/models/io/baseoutputmodule.hh>
#include <opm/models/io/vtkmultiwriter.hh>
#include <opm/models/utils/parametersystem.hh>
#include <opm/models/utils/propertysystem.hh>
namespace Opm::Properties::TTag {
// create new type tag for the VTK composition output
struct VtkComposition {};
} // namespace Opm::Properties::TTag
namespace Opm::Parameters {
// create the property tags needed for the composition module
template<class TypeTag, class MyTypeTag>
struct VtkWriteMassFractions { using type = Properties::UndefinedProperty; };
template<class TypeTag, class MyTypeTag>
struct VtkWriteMoleFractions { using type = Properties::UndefinedProperty; };
template<class TypeTag, class MyTypeTag>
struct VtkWriteTotalMassFractions { using type = Properties::UndefinedProperty; };
template<class TypeTag, class MyTypeTag>
struct VtkWriteTotalMoleFractions { using type = Properties::UndefinedProperty; };
template<class TypeTag, class MyTypeTag>
struct VtkWriteMolarities { using type = Properties::UndefinedProperty; };
template<class TypeTag, class MyTypeTag>
struct VtkWriteFugacities { using type = Properties::UndefinedProperty; };
template<class TypeTag, class MyTypeTag>
struct VtkWriteFugacityCoeffs { using type = Properties::UndefinedProperty; };
// set default values for what quantities to output
template<class TypeTag>
struct VtkWriteMassFractions<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = false; };
template<class TypeTag>
struct VtkWriteMoleFractions<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = true; };
template<class TypeTag>
struct VtkWriteTotalMassFractions<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = false; };
template<class TypeTag>
struct VtkWriteTotalMoleFractions<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = false; };
template<class TypeTag>
struct VtkWriteMolarities<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = false; };
template<class TypeTag>
struct VtkWriteFugacities<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = false; };
template<class TypeTag>
struct VtkWriteFugacityCoeffs<TypeTag, Properties::TTag::VtkComposition>
{ static constexpr bool value = false; };
} // namespace Opm::Properties
namespace Opm {
/*!
* \ingroup Vtk
*
* \brief VTK output module for the fluid composition
*
* This module deals with the following quantities:
* - Mole fraction of a component in a fluid phase
* - Mass fraction of a component in a fluid phase
* - Molarity (i.e. molar concentration) of a component in a fluid phase
* - Fugacity of all components
* - FugacityCoefficient of all components in all phases
*/
template <class TypeTag>
class VtkCompositionModule : public BaseOutputModule<TypeTag>
{
using ParentType = BaseOutputModule<TypeTag>;
using Simulator = GetPropType<TypeTag, Properties::Simulator>;
using Scalar = GetPropType<TypeTag, Properties::Scalar>;
using Evaluation = GetPropType<TypeTag, Properties::Evaluation>;
using ElementContext = GetPropType<TypeTag, Properties::ElementContext>;
using GridView = GetPropType<TypeTag, Properties::GridView>;
enum { numPhases = getPropValue<TypeTag, Properties::NumPhases>() };
enum { numComponents = getPropValue<TypeTag, Properties::NumComponents>() };
static const int vtkFormat = getPropValue<TypeTag, Properties::VtkOutputFormat>();
using VtkMultiWriter = ::Opm::VtkMultiWriter<GridView, vtkFormat>;
using ComponentBuffer = typename ParentType::ComponentBuffer;
using PhaseComponentBuffer = typename ParentType::PhaseComponentBuffer;
public:
VtkCompositionModule(const Simulator& simulator)
: ParentType(simulator)
{ }
/*!
* \brief Register all run-time parameters for the Vtk output module.
*/
static void registerParameters()
{
Parameters::registerParam<TypeTag, Parameters::VtkWriteMassFractions>
("Include mass fractions in the VTK output files");
Parameters::registerParam<TypeTag, Parameters::VtkWriteMoleFractions>
("Include mole fractions in the VTK output files");
Parameters::registerParam<TypeTag, Parameters::VtkWriteTotalMassFractions>
("Include total mass fractions in the VTK output files");
Parameters::registerParam<TypeTag, Parameters::VtkWriteTotalMoleFractions>
("Include total mole fractions in the VTK output files");
Parameters::registerParam<TypeTag, Parameters::VtkWriteMolarities>
("Include component molarities in the VTK output files");
Parameters::registerParam<TypeTag, Parameters::VtkWriteFugacities>
("Include component fugacities in the VTK output files");
Parameters::registerParam<TypeTag, Parameters::VtkWriteFugacityCoeffs>
("Include component fugacity coefficients in the VTK output files");
}
/*!
* \brief Allocate memory for the scalar fields we would like to
* write to the VTK file.
*/
void allocBuffers()
{
if (moleFracOutput_())
this->resizePhaseComponentBuffer_(moleFrac_);
if (massFracOutput_())
this->resizePhaseComponentBuffer_(massFrac_);
if (totalMassFracOutput_())
this->resizeComponentBuffer_(totalMassFrac_);
if (totalMoleFracOutput_())
this->resizeComponentBuffer_(totalMoleFrac_);
if (molarityOutput_())
this->resizePhaseComponentBuffer_(molarity_);
if (fugacityOutput_())
this->resizeComponentBuffer_(fugacity_);
if (fugacityCoeffOutput_())
this->resizePhaseComponentBuffer_(fugacityCoeff_);
}
/*!
* \brief Modify the internal buffers according to the intensive quantities relevant
* for an element
*/
void processElement(const ElementContext& elemCtx)
{
using Toolbox = MathToolbox<Evaluation>;
if (!Parameters::get<TypeTag, Parameters::EnableVtkOutput>())
return;
for (unsigned i = 0; i < elemCtx.numPrimaryDof(/*timeIdx=*/0); ++i) {
unsigned I = elemCtx.globalSpaceIndex(i, /*timeIdx=*/0);
const auto& intQuants = elemCtx.intensiveQuantities(i, /*timeIdx=*/0);
const auto& fs = intQuants.fluidState();
for (unsigned phaseIdx = 0; phaseIdx < numPhases; ++phaseIdx) {
for (unsigned compIdx = 0; compIdx < numComponents; ++compIdx) {
if (moleFracOutput_())
moleFrac_[phaseIdx][compIdx][I] = Toolbox::value(fs.moleFraction(phaseIdx, compIdx));
if (massFracOutput_())
massFrac_[phaseIdx][compIdx][I] = Toolbox::value(fs.massFraction(phaseIdx, compIdx));
if (molarityOutput_())
molarity_[phaseIdx][compIdx][I] = Toolbox::value(fs.molarity(phaseIdx, compIdx));
if (fugacityCoeffOutput_())
fugacityCoeff_[phaseIdx][compIdx][I] =
Toolbox::value(fs.fugacityCoefficient(phaseIdx, compIdx));
}
}
for (unsigned compIdx = 0; compIdx < numComponents; ++compIdx) {
if (totalMassFracOutput_()) {
Scalar compMass = 0;
Scalar totalMass = 0;
for (unsigned phaseIdx = 0; phaseIdx < numPhases; ++phaseIdx) {
totalMass += Toolbox::value(fs.density(phaseIdx)) * Toolbox::value(fs.saturation(phaseIdx));
compMass +=
Toolbox::value(fs.density(phaseIdx))
*Toolbox::value(fs.saturation(phaseIdx))
*Toolbox::value(fs.massFraction(phaseIdx, compIdx));
}
totalMassFrac_[compIdx][I] = compMass / totalMass;
}
if (totalMoleFracOutput_()) {
Scalar compMoles = 0;
Scalar totalMoles = 0;
for (unsigned phaseIdx = 0; phaseIdx < numPhases; ++phaseIdx) {
totalMoles +=
Toolbox::value(fs.molarDensity(phaseIdx))
*Toolbox::value(fs.saturation(phaseIdx));
compMoles +=
Toolbox::value(fs.molarDensity(phaseIdx))
*Toolbox::value(fs.saturation(phaseIdx))
*Toolbox::value(fs.moleFraction(phaseIdx, compIdx));
}
totalMoleFrac_[compIdx][I] = compMoles / totalMoles;
}
if (fugacityOutput_())
fugacity_[compIdx][I] = Toolbox::value(intQuants.fluidState().fugacity(/*phaseIdx=*/0, compIdx));
}
}
}
/*!
* \brief Add all buffers to the VTK output writer.
*/
void commitBuffers(BaseOutputWriter& baseWriter)
{
VtkMultiWriter *vtkWriter = dynamic_cast<VtkMultiWriter*>(&baseWriter);
if (!vtkWriter) {
return;
}
if (moleFracOutput_())
this->commitPhaseComponentBuffer_(baseWriter, "moleFrac_%s^%s", moleFrac_);
if (massFracOutput_())
this->commitPhaseComponentBuffer_(baseWriter, "massFrac_%s^%s", massFrac_);
if (molarityOutput_())
this->commitPhaseComponentBuffer_(baseWriter, "molarity_%s^%s", molarity_);
if (totalMassFracOutput_())
this->commitComponentBuffer_(baseWriter, "totalMassFrac^%s", totalMassFrac_);
if (totalMoleFracOutput_())
this->commitComponentBuffer_(baseWriter, "totalMoleFrac^%s", totalMoleFrac_);
if (fugacityOutput_())
this->commitComponentBuffer_(baseWriter, "fugacity^%s", fugacity_);
if (fugacityCoeffOutput_())
this->commitPhaseComponentBuffer_(baseWriter, "fugacityCoeff_%s^%s", fugacityCoeff_);
}
private:
static bool massFracOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteMassFractions>();
return val;
}
static bool moleFracOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteMoleFractions>();
return val;
}
static bool totalMassFracOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteTotalMassFractions>();
return val;
}
static bool totalMoleFracOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteTotalMoleFractions>();
return val;
}
static bool molarityOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteMolarities>();
return val;
}
static bool fugacityOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteFugacities>();
return val;
}
static bool fugacityCoeffOutput_()
{
static bool val = Parameters::get<TypeTag, Parameters::VtkWriteFugacityCoeffs>();
return val;
}
PhaseComponentBuffer moleFrac_;
PhaseComponentBuffer massFrac_;
PhaseComponentBuffer molarity_;
ComponentBuffer totalMassFrac_;
ComponentBuffer totalMoleFrac_;
ComponentBuffer fugacity_;
PhaseComponentBuffer fugacityCoeff_;
};
} // namespace Opm
#endif