basicSpecieMixture.H

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License
    This file is part of OpenFOAM.
 
    OpenFOAM 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 3 of the License, or
    (at your option) any later version.
 
    OpenFOAM is distributed in the hope that it will be useful, but WITHOUT
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    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 OpenFOAM.  If not, see <http://www.gnu.org/licenses/>.
 
Class
    Foam::basicSpecieMixture
 
Description
    Specialisation of basicMixture for a mixture consisting of a number for
    molecular species.
 
SourceFiles
    basicSpecieMixture.C
 
\*---------------------------------------------------------------------------*/
 
#ifndef basicSpecieMixture_H
#define basicSpecieMixture_H
 
#include "volFields.H"
#include "PtrList.H"
#include "basicMixture.H"
#include "speciesTable.H"
 
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
 
namespace Foam
{
 
/*---------------------------------------------------------------------------*\
                     Class basicSpecieMixture Declaration
\*---------------------------------------------------------------------------*/
 
class basicSpecieMixture
:
    public basicMixture
{
 
protected:
 
    // Protected data
 
        //- Phase-name
        const word& phaseName_;
 
        //- Table of specie names
        speciesTable species_;
 
        //- The name of the default specie
        //  The mass fraction of which is derived from the other species
        //  rather than solved.
        //  Also used as the carrier specie in multicomponent diffusion
        word defaultSpecie_;
 
        //- The index of the default specie
        label defaultSpecieIndex_;
 
        //- List of specie active flags
        mutable List<bool> active_;
 
        //- Species mass fractions
        PtrList<volScalarField> Y_;
 
 
    // Protected Member Functions
 
        //- Scale the mass fractions to sum to 1
        void correctMassFractions();
 
 
public:
 
    //- Run time type information
    TypeName("basicSpecieMixture");
 
    //- The base class of the mixture
    typedef basicSpecieMixture basicMixtureType;
 
 
    // Constructors
 
        //- Construct from dictionary, species names, mesh and phase name
        basicSpecieMixture
        (
            const dictionary&,
            const wordList& specieNames,
            const fvMesh&,
            const word&
        );
 
 
    //- Destructor
    virtual ~basicSpecieMixture()
    {}
 
 
    // Member Functions
 
        //- Return the table of species
        inline const speciesTable& species() const;
 
        //- Does the mixture include this specie?
        inline bool contains(const word& specieName) const;
 
        //- Return the index of the default specie
        inline label defaultSpecie() const;
 
        //- Return true for active species
        inline bool active(label speciei) const;
 
        //- Return the bool list of active species
        inline const List<bool>& active() const;
 
        //- Set speciei active
        inline void setActive(label speciei) const;
 
        //- Set speciei inactive
        inline void setInactive(label speciei) const;
 
        //- Return true if the specie should be solved for
        //  i.e. active and not the default specie
        inline bool solve(label speciei) const;
 
        //- Return the mass-fraction fields
        inline PtrList<volScalarField>& Y();
 
        //- Return the const mass-fraction fields
        inline const PtrList<volScalarField>& Y() const;
 
        //- Return the mass-fraction field for a specie given by index
        inline volScalarField& Y(const label i);
 
        //- Return the const mass-fraction field for a specie given by index
        inline const volScalarField& Y(const label i) const;
 
        //- Return the mass-fraction field for a specie given by name
        inline volScalarField& Y(const word& specieName);
 
        //- Return the const mass-fraction field for a specie given by name
        inline const volScalarField& Y(const word& specieName) const;
 
        //- Return the specie index of the given mass-fraction field
        inline label index(const volScalarField& Yi) const;
 
        //- Normalise the mass fractions
        //  by clipping positive
        //  and deriving the default specie mass fraction from the other species
        void normalise();
 
 
        // Specie properties
 
            //- Molecular weight of the given specie [kg/kmol]
            virtual scalar Wi(const label speciei) const = 0;
 
            //- Enthalpy of formation [J/kg]
            virtual scalar Hf(const label speciei) const = 0;
 
 
        // Specie thermo properties
 
            //- Density [kg/m^3]
            virtual scalar rho
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Density [kg/m^3]
            virtual tmp<volScalarField> rho
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
 
            //- Heat capacity at constant pressure [J/kg/K]
            virtual scalar Cp
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Heat capacity at constant pressure [J/kg/K]
            virtual tmp<volScalarField> Cp
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
 
            //- Enthalpy/Internal energy [J/kg]
            virtual scalar HE
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Enthalpy/Internal energy [J/kg]
            virtual tmp<scalarField> HE
            (
                const label speciei,
                const scalarField& p,
                const scalarField& T
            ) const = 0;
 
            //- Enthalpy/Internal energy [J/kg]
            virtual tmp<volScalarField> HE
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
 
            //- Sensible enthalpy [J/kg]
            virtual scalar Hs
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Sensible enthalpy [J/kg]
            virtual tmp<scalarField> Hs
            (
                const label speciei,
                const scalarField& p,
                const scalarField& T
            ) const = 0;
 
            //- Sensible enthalpy [J/kg]
            virtual tmp<volScalarField> Hs
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
 
            //- Absolute enthalpy [J/kg]
            virtual scalar Ha
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Enthalpy/Internal energy [J/kg]
            virtual tmp<scalarField> Ha
            (
                const label speciei,
                const scalarField& p,
                const scalarField& T
            ) const = 0;
 
            //- Absolute enthalpy [J/kg]
            virtual tmp<volScalarField> Ha
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
 
 
        // Specie transport properties
 
            //- Dynamic viscosity [kg/m/s]
            virtual scalar mu
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Dynamic viscosity [kg/m/s]
            virtual tmp<volScalarField> mu
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
 
            //- Thermal conductivity [W/m/K]
            virtual scalar kappa
            (
                const label speciei,
                const scalar p,
                const scalar T
            ) const = 0;
 
            //- Thermal conductivity [W/m/K]
            virtual tmp<volScalarField> kappa
            (
                const label speciei,
                const volScalarField& p,
                const volScalarField& T
            ) const = 0;
};
 
 
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
 
} // End namespace Foam
 
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
 
#include "basicSpecieMixtureI.H"
 
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
 
#endif
 
// ************************************************************************* //