140 lines
4.4 KiB
C
140 lines
4.4 KiB
C
/*---------------------------------------------------------------------------*\
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Particle(tranDict),
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========= |
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\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
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\\ / O peration |
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\\ / A nd | Copyright (C) 2016 OpenFOAM Foundation
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\\/ M anipulation |
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-------------------------------------------------------------------------------
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License
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This file is part of OpenFOAM.
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OpenFOAM is free software: you can redistribute it and/or modify it
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under the terms of the GNU General Public License as published by
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the Free Software Foundation, either version 3 of the License, or
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(at your option) any later version.
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OpenFOAM is distributed in the hope that it will be useful, but WITHOUT
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ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or
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FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License
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for more details.
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You should have received a copy of the GNU General Public License
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along with OpenFOAM. If not, see <http://www.gnu.org/licenses/>.
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\*---------------------------------------------------------------------------*/
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#include "Neutral.H"
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#include "dictionary.H"
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#include "scalarList.H"
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// * * * * * * * * * * * * * * Static Data Members * * * * * * * * * * * * * //
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// const dataType Foam::Neutral::staticData();
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// * * * * * * * * * * * * * Static Member Functions * * * * * * * * * * * * //
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// * * * * * * * * * * * * * Private Member Functions * * * * * * * * * * * //
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// * * * * * * * * * * * * Protected Member Functions * * * * * * * * * * * //
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// * * * * * * * * * * * * * * * * Constructors * * * * * * * * * * * * * * //
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Foam::Neutral::Neutral(const dictionary& thermoDict, const dictionary& tranDict)
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:
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Particle(thermoDict, tranDict),
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wellDepth_(tranDict.lookupOrDefault("wellDepth", 0.0)),
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diameter_(tranDict.lookupOrDefault("diameter", 0.0)),
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dipoleMoment_(tranDict.lookupOrDefault("dipoleMoment", 0.0)),
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alpha_(tranDict.lookupOrDefault("dipolePolarizability", 0.0)),
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alphaQ_(0.0),
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C6_(tranDict.lookupOrDefault("dispersionCoef", 0.0))
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{
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const entry* entryPtr = tranDict.lookupEntryPtr("tranlib", false, true);
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if (entryPtr)
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{
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scalarList tranlib(entryPtr->stream());
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wellDepth_ = tranlib[1];
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diameter_ = tranlib[2];
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dipoleMoment_ = tranlib[3];
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alpha_ = tranlib[4];
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Zrot_ = tranlib[5];
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tranDict.readIfPresent("wellDepth", wellDepth_);
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tranDict.readIfPresent("diameter", diameter_);
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tranDict.readIfPresent("dipoleMoment", dipoleMoment_);
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tranDict.readIfPresent("dipolePolarizability", alpha_);
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tranDict.readIfPresent("dispersionCoef", C6_);
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tranDict.readIfPresent("rotationalRelaxation", Zrot_);
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}
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else
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{
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wellDepth_ = readScalar(tranDict.lookup("wellDepth"));
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diameter_ = readScalar(tranDict.lookup("diameter"));
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dipoleMoment_ = readScalar(tranDict.lookup("dipoleMoment"));
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alpha_ = readScalar(tranDict.lookup("dipolePolarizability"));
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C6_ = readScalar(tranDict.lookup("dispersionCoef"));
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Zrot_ = readScalar(tranDict.lookup("rotationalRelaxation"));
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}
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if (alpha_ > 0.0)
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{
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C6_ = exp(1.8846 * log(alpha_) - 0.4737); // * sqr(e);
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alphaQ_ = 2 * C6_;
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}
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}
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// * * * * * * * * * * * * * * * * Destructor * * * * * * * * * * * * * * * //
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Foam::Neutral::~Neutral()
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{}
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// * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * * //
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// * * * * * * * * * * * * * * Member Operators * * * * * * * * * * * * * * //
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void Foam::Neutral::operator=(const Neutral& rhs)
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{
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// Check for assignment to self
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if (this == &rhs)
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{
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FatalErrorInFunction
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<< "Attempted assignment to self"
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<< abort(FatalError);
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}
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}
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// * * * * * * * * * * * * * * Friend Functions * * * * * * * * * * * * * * //
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// * * * * * * * * * * * * * * Friend Operators * * * * * * * * * * * * * * //
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Foam::Ostream& Foam::operator<<(Ostream& os, const Neutral& st)
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{
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os << static_cast<const Particle&>(st) << tab
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<< st.wellDepth_ << tab
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<< st.diameter_ << tab
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<< st.dipoleMoment_ << tab
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<< st.alpha_ << tab
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<< st.alphaQ_ << tab
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<< st.C6_ << tab
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<< st.Zrot_;
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os.check("Ostream& operator<<(Ostream& os, const specie& st)");
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return os;
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}
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// ************************************************************************* //
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