/*---------------------------------------------------------------------------*\ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | Website: https://openfoam.org \\ / A nd | Copyright (C) 2016-2023 OpenFOAM Foundation \\/ M anipulation | ------------------------------------------------------------------------------- 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 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 OpenFOAM. If not, see . \*---------------------------------------------------------------------------*/ #include "moleFractions.H" #include "fluidMulticomponentThermo.H" #include "addToRunTimeSelectionTable.H" // * * * * * * * * * * * * * * Static Data Members * * * * * * * * * * * * * // namespace Foam { namespace functionObjects { defineTypeNameAndDebug(moleFractions, 0); addToRunTimeSelectionTable(functionObject, moleFractions, dictionary); } } // * * * * * * * * * * * * * * * * Constructors * * * * * * * * * * * * * * // Foam::functionObjects::moleFractions::moleFractions ( const word& name, const Time& runTime, const dictionary& dict ) : fvMeshFunctionObject(name, runTime, dict), phaseName_(dict.lookupOrDefault("phase", word::null)), X_() {} // * * * * * * * * * * * * * * * * Destructor * * * * * * * * * * * * * * * // Foam::functionObjects::moleFractions::~moleFractions() {} // * * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * // bool Foam::functionObjects::moleFractions::read(const dictionary& dict) { return true; } bool Foam::functionObjects::moleFractions::execute() { // Lookup or construct a multicomponent thermo. Lookup is likely to be // appropriate if this is being used at run-time. Construction if this is // being called as a one-off post-process. const word thermoName = IOobject::groupName(physicalProperties::typeName, phaseName_); autoPtr thermoPtr ( mesh_.foundObject(thermoName) ? autoPtr(nullptr) : fluidMulticomponentThermo::New(mesh_) ); const fluidMulticomponentThermo& thermo = mesh_.lookupObject(thermoName); // Construct mole fraction fields corresponding to the mass fraction fields const PtrList& Y = thermo.Y(); if (X_.empty()) { X_.setSize(Y.size()); forAll(Y, i) { X_.set ( i, new volScalarField ( IOobject ( "X_" + Y[i].name(), mesh_.time().name(), mesh_ ), mesh_, dimensionedScalar(dimless, 0) ) ); } } // Get the mixture molar mass const volScalarField W(thermo.W()); // Calculate the mole fractions forAll(Y, i) { X_[i] = Y[i]*W/thermo.Wi(i); } return true; } bool Foam::functionObjects::moleFractions::write() { forAll(X_, i) { X_[i].write(); } return true; } // ************************************************************************* //