ChemistryLib::ChemicalSolverInterface Class Reference

Detailed Description

Definition at line 28 of file ChemicalSolverInterface.h.

#include <ChemicalSolverInterface.h>

Inheritance diagram for ChemistryLib::ChemicalSolverInterface:

Collaboration diagram for ChemistryLib::ChemicalSolverInterface:

Public Member Functions
	ChemicalSolverInterface (GlobalLinearSolver &linear_solver_)
virtual void	initialize ()
virtual void	initializeChemicalSystemConcrete (std::vector< double > const &, GlobalIndexType const &, MaterialPropertyLib::Medium const &, ParameterLib::SpatialPosition const &, double const)
virtual void	setChemicalSystemConcrete (std::vector< double > const &, GlobalIndexType const &, MaterialPropertyLib::Medium const *, MaterialPropertyLib::VariableArray const &, ParameterLib::SpatialPosition const &, double const, double const)
virtual void	setAqueousSolutionsPrevFromDumpFile ()
virtual void	executeSpeciationCalculation (double const dt)=0
virtual std::vector< GlobalVector * >	getIntPtProcessSolutions () const =0
virtual double	getConcentration (int const, GlobalIndexType const) const
virtual std::vector< std::string > const	getComponentList () const
virtual void	updateVolumeFractionPostReaction (GlobalIndexType const &, MaterialPropertyLib::Medium const &, ParameterLib::SpatialPosition const &, double const, double const, double const)
virtual void	updatePorosityPostReaction (GlobalIndexType const &, MaterialPropertyLib::Medium const &, double &)
virtual void	computeSecondaryVariable (std::size_t const, std::vector< GlobalIndexType > const &)
virtual	~ChemicalSolverInterface ()=default

Public Attributes
std::vector< GlobalIndexType >	chemical_system_index_map
GlobalLinearSolver &	linear_solver

Constructor & Destructor Documentation

ChemicalSolverInterface()

ChemistryLib::ChemicalSolverInterface::ChemicalSolverInterface ( GlobalLinearSolver &  linear_solver_ )

inline

Definition at line 31 of file ChemicalSolverInterface.h.

        : linear_solver(linear_solver_)
    {
    }

~ChemicalSolverInterface()

virtual ChemistryLib::ChemicalSolverInterface::~ChemicalSolverInterface ( )

virtualdefault

Member Function Documentation

computeSecondaryVariable()

virtual void ChemistryLib::ChemicalSolverInterface::computeSecondaryVariable ( std::size_t const  , std::vector< GlobalIndexType > const &    )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 89 of file ChemicalSolverInterface.h.

    {
    }

Referenced by ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::computeSecondaryVariableConcrete().

executeSpeciationCalculation()

virtual void ChemistryLib::ChemicalSolverInterface::executeSpeciationCalculation ( double const  dt )

pure virtual

Implemented in ChemistryLib::PhreeqcKernelData::PhreeqcKernel, and ChemistryLib::PhreeqcIOData::PhreeqcIO.

getComponentList()

virtual std::vector<std::string> const ChemistryLib::ChemicalSolverInterface::getComponentList ( ) const

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 69 of file ChemicalSolverInterface.h.

    {
        return {};
    }

getConcentration()

virtual double ChemistryLib::ChemicalSolverInterface::getConcentration ( int const  , GlobalIndexType const    ) const

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 62 of file ChemicalSolverInterface.h.

    {
        return std::numeric_limits<double>::quiet_NaN();
    }

Referenced by ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::assembleReactionEquationConcrete().

getIntPtProcessSolutions()

virtual std::vector<GlobalVector*> ChemistryLib::ChemicalSolverInterface::getIntPtProcessSolutions ( ) const

pure virtual

Implemented in ChemistryLib::PhreeqcKernelData::PhreeqcKernel, and ChemistryLib::PhreeqcIOData::PhreeqcIO.

initialize()

virtual void ChemistryLib::ChemicalSolverInterface::initialize ( )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 36 of file ChemicalSolverInterface.h.

{}

initializeChemicalSystemConcrete()

virtual void ChemistryLib::ChemicalSolverInterface::initializeChemicalSystemConcrete ( std::vector< double > const &  , GlobalIndexType const &  , MaterialPropertyLib::Medium const &  , ParameterLib::SpatialPosition const &  , double const    )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 38 of file ChemicalSolverInterface.h.

    {
    }

Referenced by ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::initializeChemicalSystemConcrete().

setAqueousSolutionsPrevFromDumpFile()

virtual void ChemistryLib::ChemicalSolverInterface::setAqueousSolutionsPrevFromDumpFile ( )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 56 of file ChemicalSolverInterface.h.

{}

setChemicalSystemConcrete()

virtual void ChemistryLib::ChemicalSolverInterface::setChemicalSystemConcrete ( std::vector< double > const &  , GlobalIndexType const &  , MaterialPropertyLib::Medium const *  , MaterialPropertyLib::VariableArray const &  , ParameterLib::SpatialPosition const &  , double const  , double const    )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 46 of file ChemicalSolverInterface.h.

    {
    }

Referenced by ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::setChemicalSystemConcrete().

updatePorosityPostReaction()

virtual void ChemistryLib::ChemicalSolverInterface::updatePorosityPostReaction ( GlobalIndexType const &  , MaterialPropertyLib::Medium const &  , double &    )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 82 of file ChemicalSolverInterface.h.

    {
    }

Referenced by ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::computeSecondaryVariableConcrete(), and ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::postSpeciationCalculation().

updateVolumeFractionPostReaction()

virtual void ChemistryLib::ChemicalSolverInterface::updateVolumeFractionPostReaction ( GlobalIndexType const &  , MaterialPropertyLib::Medium const &  , ParameterLib::SpatialPosition const &  , double const  , double const  , double const    )

inlinevirtual

Reimplemented in ChemistryLib::PhreeqcIOData::PhreeqcIO.

Definition at line 74 of file ChemicalSolverInterface.h.

    {
    }

Referenced by ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::postSpeciationCalculation().

Member Data Documentation

chemical_system_index_map

std::vector<GlobalIndexType> ChemistryLib::ChemicalSolverInterface::chemical_system_index_map

Definition at line 98 of file ChemicalSolverInterface.h.

Referenced by ChemistryLib::PhreeqcIOData::PhreeqcIO::initialize(), and ProcessLib::ComponentTransport::LocalAssemblerData< ShapeFunction, IntegrationMethod, GlobalDim >::setChemicalSystemID().

linear_solver

GlobalLinearSolver& ChemistryLib::ChemicalSolverInterface::linear_solver

specify the linear solver used to solve the linearized reaction equation.

Definition at line 101 of file ChemicalSolverInterface.h.

Referenced by ProcessLib::ComponentTransport::ComponentTransportProcess::solveReactionEquation().

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The documentation for this class was generated from the following file:

• ChemistryLib/ChemicalSolverInterface.h