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ENH: line lengths.
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@ -65,7 +65,11 @@ Foam::tensor Foam::polyatomic::rotationTensorZ(scalar phi) const
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// * * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * //
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bool Foam::polyatomic::move(polyatomic::trackingData& td, const scalar trackTime)
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bool Foam::polyatomic::move
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(
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polyatomic::trackingData& td,
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const scalar trackTime
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)
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{
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td.switchProcessor = false;
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td.keepParticle = true;
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@ -449,7 +449,7 @@ inline Foam::label Foam::polyatomic::constantProperties::nSites() const
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}
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// * * * * * * * * * * * * polyatomic Member Functions * * * * * * * * * * * * //
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// * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * * //
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inline const Foam::tensor& Foam::polyatomic::Q() const
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{
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@ -480,7 +480,8 @@ void Foam::polyatomicCloud::initialiseMolecules
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)
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{
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Info<< nl
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<< "Initialising polyatomics in each zone specified in mdInitialiseDict."
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<< "Initialising polyatomics in each zone specified in "
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<< mdInitialiseDict.name()
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<< endl;
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const cellZoneMesh& cellZones = mesh_.cellZones();
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@ -570,7 +571,10 @@ void Foam::polyatomicCloud::initialiseMolecules
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{
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label id = findIndex(pot_.idList(), latticeIds[i]);
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const polyatomic::constantProperties& cP(constProps(id));
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const polyatomic::constantProperties& cP
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(
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constProps(id)
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);
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unitCellMass += cP.mass();
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}
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@ -965,7 +969,10 @@ void Foam::polyatomicCloud::initialiseMolecules
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&& !partOfLayerInBounds
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)
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{
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WarningIn("Foam::polyatomicCloud::initialiseMolecules()")
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WarningIn
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(
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"Foam::polyatomicCloud::initialiseMolecules()"
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)
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<< "A whole layer of unit cells was placed "
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<< "outside the bounds of the mesh, but no "
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<< "polyatomics have been placed in zone '"
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@ -1234,7 +1241,8 @@ void Foam::polyatomicCloud::writeXYZ(const fileName& fName) const
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{
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OFstream os(fName);
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os << nSites() << nl << "polyatomicCloud site positions in angstroms" << nl;
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os << nSites() << nl
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<< "polyatomicCloud site positions in angstroms" << nl;
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forAllConstIter(polyatomicCloud, *this, mol)
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{
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@ -189,7 +189,8 @@ public:
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inline const InteractionLists<polyatomic>& il() const;
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inline const List<polyatomic::constantProperties> constProps() const;
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inline const List<polyatomic::constantProperties>
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constProps() const;
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inline const polyatomic::constantProperties&
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constProps(label id) const;
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