From 8f5e38ac9c9930df342104e2c3e0ded602298ec5 Mon Sep 17 00:00:00 2001 From: graham <g.macpherson@opencfd.co.uk> Date: Wed, 17 Jun 2009 15:11:06 +0100 Subject: [PATCH] Modified copyright years, removed old molConfig. --- .../mdEquilibrationFoam/mdEquilibrationFoam.C | 2 +- .../molecularDynamics/mdFoam/mdFoam.C | 2 +- .../preProcessing/mdInitialise/mdInitialise.C | 2 +- .../mdInitialise/molConfig_old/Make/files | 8 - .../mdInitialise/molConfig_old/Make/options | 17 -- .../molConfig_old/correctVelocities.H | 21 -- .../molConfig_old/createMolecules.C | 253 ------------------ .../molConfig_old/createPositions.H | 26 -- .../molConfig_old/createVelocities.H | 13 - .../mdInitialise/molConfig_old/genMolConfig.C | 129 --------- .../molConfig_old/latticeStructures/BCC.H | 179 ------------- .../molConfig_old/latticeStructures/FCC.H | 217 --------------- .../molConfig_old/latticeStructures/SC.H | 127 --------- .../mdInitialise/molConfig_old/molConfig.C | 50 ---- .../mdInitialise/molConfig_old/molConfig.H | 147 ---------- .../mdInitialise/molConfig_old/molConfigI.H | 98 ------- .../mdInitialise/molConfig_old/origin.H | 49 ---- .../molConfig_old/readZoneSubDict.H | 93 ------- .../molConfig_old/startingPoint.H | 97 ------- .../velocityDistributions/maxwellian.H | 26 -- .../velocityDistributions/uniform.H | 27 -- .../bufferedAccumulator/bufferedAccumulator.C | 2 +- .../bufferedAccumulator/bufferedAccumulator.H | 2 +- .../bufferedAccumulatorI.H | 2 +- .../bufferedAccumulatorIO.C | 2 +- .../correlationFunction/correlationFunction.C | 2 +- .../correlationFunction/correlationFunction.H | 2 +- .../correlationFunctionI.H | 2 +- .../correlationFunctionIO.C | 2 +- .../distribution/distribution.C | 2 +- .../distribution/distribution.H | 2 +- .../distribution/distributionI.H | 2 +- .../distribution/distributionIO.C | 2 +- .../directInteractionList.C | 2 +- .../directInteractionList.H | 2 +- .../directInteractionListI.H | 2 +- .../interactionLists/interactionLists.C | 2 +- .../interactionLists/interactionLists.H | 2 +- .../interactionLists/interactionListsI.H | 2 +- .../referralLists/receivingReferralList.C | 2 +- .../referralLists/receivingReferralList.H | 2 +- .../referralLists/receivingReferralListI.H | 2 +- .../referralLists/sendingReferralList.C | 2 +- .../referralLists/sendingReferralList.H | 2 +- .../referralLists/sendingReferralListI.H | 2 +- .../referredCell/referredCell.C | 2 +- .../referredCell/referredCell.H | 2 +- .../referredCell/referredCellI.H | 2 +- .../referredCellList/referredCellList.C | 2 +- .../referredCellList/referredCellList.H | 2 +- .../referredCellList/referredCellListI.H | 2 +- .../referredMolecule/referredMolecule.C | 2 +- .../referredMolecule/referredMolecule.H | 2 +- .../referredMolecule/referredMoleculeI.H | 2 +- .../calculateAutoCorrelationFunctions.H | 2 +- .../mdTools/calculateTransportProperties.H | 2 +- .../mdTools/createAutoCorrelationFunctions.H | 2 +- .../mdTools/meanMomentumEnergyAndNMols.H | 2 +- .../molecule/mdTools/temperatureAndPressure.H | 2 +- .../mdTools/temperatureAndPressureVariables.H | 2 +- .../mdTools/temperatureEquilibration.H | 2 +- .../molecule/molecule/molecule.C | 2 +- .../molecule/molecule/molecule.H | 2 +- .../molecule/molecule/moleculeI.H | 2 +- .../molecule/molecule/moleculeIO.C | 2 +- .../molecule/moleculeCloud/moleculeCloud.C | 2 +- .../molecule/moleculeCloud/moleculeCloud.H | 2 +- .../molecule/moleculeCloud/moleculeCloudI.H | 2 +- .../molecule/reducedUnits/reducedUnits.C | 2 +- .../molecule/reducedUnits/reducedUnits.H | 2 +- .../molecule/reducedUnits/reducedUnitsI.H | 2 +- .../molecule/reducedUnits/reducedUnitsIO.C | 2 +- .../electrostaticPotential.C | 2 +- .../electrostaticPotential.H | 2 +- .../basic/energyScalingFunction.C | 2 +- .../basic/energyScalingFunction.H | 2 +- .../basic/newEnergyScalingFunction.C | 2 +- .../derived/doubleSigmoid/doubleSigmoid.C | 2 +- .../derived/doubleSigmoid/doubleSigmoid.H | 2 +- .../derived/noScaling/noScaling.C | 2 +- .../derived/noScaling/noScaling.H | 2 +- .../derived/shifted/shifted.C | 2 +- .../derived/shifted/shifted.H | 2 +- .../derived/shiftedForce/shiftedForce.C | 2 +- .../derived/shiftedForce/shiftedForce.H | 2 +- .../derived/sigmoid/sigmoid.C | 2 +- .../derived/sigmoid/sigmoid.H | 2 +- .../pairPotential/basic/newPairPotential.C | 2 +- .../pairPotential/basic/pairPotential.C | 2 +- .../pairPotential/basic/pairPotential.H | 2 +- .../pairPotential/basic/pairPotentialI.H | 2 +- .../pairPotential/basic/pairPotentialIO.C | 2 +- .../pairPotential/derived/azizChen/azizChen.C | 2 +- .../pairPotential/derived/azizChen/azizChen.H | 2 +- .../pairPotential/derived/coulomb/coulomb.C | 2 +- .../pairPotential/derived/coulomb/coulomb.H | 2 +- .../derived/dampedCoulomb/dampedCoulomb.C | 2 +- .../derived/dampedCoulomb/dampedCoulomb.H | 2 +- .../exponentialRepulsion.C | 2 +- .../exponentialRepulsion.H | 2 +- .../derived/lennardJones/lennardJones.C | 2 +- .../derived/lennardJones/lennardJones.H | 2 +- .../derived/maitlandSmith/maitlandSmith.C | 2 +- .../derived/maitlandSmith/maitlandSmith.H | 2 +- .../derived/noInteraction/noInteraction.C | 2 +- .../derived/noInteraction/noInteraction.H | 2 +- .../pairPotentialList/pairPotentialList.C | 2 +- .../pairPotentialList/pairPotentialList.H | 2 +- .../pairPotentialList/pairPotentialListI.H | 2 +- .../potential/potential/potential.C | 2 +- .../potential/potential/potential.H | 2 +- .../potential/potential/potentialI.H | 2 +- .../basic/newTetherPotential.C | 2 +- .../tetherPotential/basic/tetherPotential.C | 2 +- .../tetherPotential/basic/tetherPotential.H | 2 +- .../derived/harmonicSpring/harmonicSpring.C | 2 +- .../derived/harmonicSpring/harmonicSpring.H | 2 +- .../derived/pitchForkRing/pitchForkRing.C | 2 +- .../derived/pitchForkRing/pitchForkRing.H | 2 +- .../restrainedHarmonicSpring.C | 2 +- .../restrainedHarmonicSpring.H | 2 +- .../tetherPotentialList/tetherPotentialList.C | 2 +- .../tetherPotentialList/tetherPotentialList.H | 2 +- .../tetherPotentialListI.H | 2 +- 124 files changed, 106 insertions(+), 1683 deletions(-) delete mode 100755 applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/files delete mode 100755 applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/options delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/correctVelocities.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/createMolecules.C delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/createPositions.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/createVelocities.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/genMolConfig.C delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/BCC.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/FCC.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/SC.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.C delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfigI.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/origin.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/readZoneSubDict.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/startingPoint.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/maxwellian.H delete mode 100644 applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/uniform.H diff --git a/applications/solvers/discreteMethods/molecularDynamics/mdEquilibrationFoam/mdEquilibrationFoam.C b/applications/solvers/discreteMethods/molecularDynamics/mdEquilibrationFoam/mdEquilibrationFoam.C index a124288dc5b..ea10d9129fa 100644 --- a/applications/solvers/discreteMethods/molecularDynamics/mdEquilibrationFoam/mdEquilibrationFoam.C +++ b/applications/solvers/discreteMethods/molecularDynamics/mdEquilibrationFoam/mdEquilibrationFoam.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/applications/solvers/discreteMethods/molecularDynamics/mdFoam/mdFoam.C b/applications/solvers/discreteMethods/molecularDynamics/mdFoam/mdFoam.C index 287065754e3..9fafafe1c9e 100644 --- a/applications/solvers/discreteMethods/molecularDynamics/mdFoam/mdFoam.C +++ b/applications/solvers/discreteMethods/molecularDynamics/mdFoam/mdFoam.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/applications/utilities/preProcessing/mdInitialise/mdInitialise.C b/applications/utilities/preProcessing/mdInitialise/mdInitialise.C index 2f06531e335..ecd0221957f 100644 --- a/applications/utilities/preProcessing/mdInitialise/mdInitialise.C +++ b/applications/utilities/preProcessing/mdInitialise/mdInitialise.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/files b/applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/files deleted file mode 100755 index 6501e684269..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/files +++ /dev/null @@ -1,8 +0,0 @@ -latticeStructures = latticeStructures -velocityDistributions = velocityDistributions - -createMolecules.C -molConfig.C -genMolConfig.C - -EXE = $(FOAM_APPBIN)/molConfig diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/options b/applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/options deleted file mode 100755 index aab9a2ca4f7..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/Make/options +++ /dev/null @@ -1,17 +0,0 @@ -EXE_INC = \ - -I$(latticeStructures) \ - -I$(velocityDistributions) \ - -I$(LIB_SRC)/meshTools/lnInclude \ - -I$(LIB_SRC)/dynamicMesh/lnInclude \ - -I$(LIB_SRC)/lagrangian/molecularDynamics/molecule/lnInclude \ - -I$(LIB_SRC)/lagrangian/molecularDynamics/potential/lnInclude \ - -I$(LIB_SRC)/lagrangian/basic/lnInclude \ - -I$(LIB_SRC)/finiteVolume/lnInclude - -EXE_LIBS = \ - -lmeshTools \ - -ldynamicMesh \ - -lfiniteVolume \ - -llagrangian \ - -lmolecule \ - -lpotential diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/correctVelocities.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/correctVelocities.H deleted file mode 100644 index 0c69f15c7cd..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/correctVelocities.H +++ /dev/null @@ -1,21 +0,0 @@ -for (molN = totalMols; molN < totalMols + totalZoneMols; molN++) -{ - - // Remove bulk momentum introduced by random numbers and add - // desired bulk velocity - - // For systems with molecules of significantly differing masses, this may - // need to be an iterative process or employ a better algorithm for - // removing an appropriate share of the excess momentum from each molecule. - - initialVelocities(molN) += bulkVelocity - momentumSum/totalZoneMols/mass; -} - -// momentumSum = vector::zero; -// -// for (molN = totalMols; molN < totalMols + totalZoneMols; molN++) -// { -// momentumSum += mass*initialVelocities(molN); -// } -// -// Info << "Check momentum adjustment: " << momentumSum << endl; diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/createMolecules.C b/applications/utilities/preProcessing/mdInitialise/molConfig_old/createMolecules.C deleted file mode 100644 index dbb0f680ce2..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/createMolecules.C +++ /dev/null @@ -1,253 +0,0 @@ -/*---------------------------------------------------------------------------*\ - ========= | - \\ / F ield | OpenFOAM: The Open Source CFD Toolbox - \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. - \\/ 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 2 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, write to the Free Software Foundation, - Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA - -\*----------------------------------------------------------------------------*/ - -#include "molConfig.H" - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -void Foam::molConfig::createMolecules() -{ - Info<< nl << "Creating molecules from zone specifications\n" << endl; - - DynamicList<vector> initialPositions(0); - - DynamicList<label> initialIds(0); - - DynamicList<scalar> initialMasses(0); - - DynamicList<label> initialCelli(0); - - DynamicList<vector> initialVelocities(0); - - DynamicList<vector> initialAccelerations(0); - - DynamicList<label> initialTethered(0); - - DynamicList<vector> initialTetherPositions(0); - - label totalMols = 0; - - label idAssign; - - Random rand(clock::getTime()); - -// * * * * * * * * Building the IdList * * * * * * * * * // - -//Notes: - each processor will have an identical idList_. -// - The order of id's inside the idList_ depends on the order -// of subDicts inside the molConigDict. - - Info<< "Building the idList: " ; - - forAll(molConfigDescription_.toc(), cZs) - { - word subDictName (molConfigDescription_.toc()[cZs]); - - word iD (molConfigDescription_.subDict(subDictName).lookup("id")); - - if (findIndex(idList_,iD) == -1) - { - idList_.append(iD); - } - } - - forAll(idList_, i) - { - Info << " " << idList_[i]; - } - - Info << nl << endl; - -// * * * * * * * * Filling the Mesh * * * * * * * * * // - - const cellZoneMesh& cellZoneI = mesh_.cellZones(); - - if (cellZoneI.size()) - { - Info<< "Filling the zones with molecules." << nl << endl; - } - else - { - FatalErrorIn("void createMolecules()\n") - << "No cellZones found in mesh description." - << abort(FatalError); - } - - forAll (cellZoneI, cZ) - { - if (cellZoneI[cZ].size()) - { - if (!molConfigDescription_.found(cellZoneI[cZ].name())) - { - Info << "Zone specification subDictionary: " - << cellZoneI[cZ].name() << " not found." << endl; - } - else - { - label n = 0; - - label totalZoneMols = 0; - - label molsPlacedThisIteration; - -# include "readZoneSubDict.H" - - idAssign = findIndex(idList_,id); - -# include "startingPoint.H" - - // Continue trying to place molecules as long as at - // least one molecule is placed in each iteration. - // The "|| totalZoneMols == 0" condition means that the - // algorithm will continue if the origin is outside the - // zone - it will cause an infinite loop if no molecules - // are ever placed by the algorithm. - - if (latticeStructure != "empty") - { - - while - ( - molsPlacedThisIteration != 0 - || totalZoneMols == 0 - ) - { - molsPlacedThisIteration = 0; - - bool partOfLayerInBounds = false; - -# include "createPositions.H" - - if - ( - totalZoneMols == 0 - && !partOfLayerInBounds - ) - { - WarningIn("molConfig::createMolecules()") - << "A whole layer of unit cells was placed " - << "outside the bounds of the mesh, but no " - << "molecules have been placed in zone '" - << cellZoneI[cZ].name() - << "'. This is likely to be because the zone " - << "has few cells (" - << cellZoneI[cZ].size() - << " in this case) and no lattice position " - << "fell inside them. " - << "Aborting filling this zone." - << endl; - - break; - } - - totalZoneMols += molsPlacedThisIteration; - - n++; - } - - label molN; - - for - ( - molN = totalMols; - molN < totalMols + totalZoneMols; - molN++ - ) - { - initialIds.append(idAssign); - - initialMasses.append(mass); - - initialAccelerations.append(vector::zero); - - if (tethered) - { - initialTethered.append(1); - - initialTetherPositions.append - ( - initialPositions[molN] - ); - } - - else - { - initialTethered.append(0); - - initialTetherPositions.append(vector::zero); - } - } - -# include "createVelocities.H" - -# include "correctVelocities.H" - - } - - totalMols += totalZoneMols; - } - } - } - - idList_.shrink(); - - positions_ = initialPositions; - - positions_.setSize(initialPositions.size()); - - id_ = initialIds; - - id_.setSize(initialIds.size()); - - mass_ = initialMasses; - - mass_.setSize(initialMasses.size()); - - cells_ = initialCelli; - - cells_.setSize(initialCelli.size()); - - U_ = initialVelocities; - - U_.setSize(initialVelocities.size()); - - A_ = initialAccelerations; - - A_.setSize(initialAccelerations.size()); - - tethered_ = initialTethered; - - tethered_.setSize(initialTethered.size()); - - tetherPositions_ = initialTetherPositions; - - tetherPositions_.setSize(initialTetherPositions.size()); - - nMol_ = totalMols; -} - - -// ************************************************************************* // diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/createPositions.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/createPositions.H deleted file mode 100644 index b26486338ca..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/createPositions.H +++ /dev/null @@ -1,26 +0,0 @@ -vector latticePosition; - -vector globalPosition; - -if (latticeStructure == "SC") -{ -# include "SC.H" -} - -else if (latticeStructure == "FCC") -{ -# include "FCC.H" -} - -else if (latticeStructure == "BCC") -{ -# include "BCC.H" -} - -else -{ - FatalErrorIn("createPositions.H\n") - << "latticeStructure " << latticeStructure - << " not supported." - << abort(FatalError); -} diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/createVelocities.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/createVelocities.H deleted file mode 100644 index d014ffd1460..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/createVelocities.H +++ /dev/null @@ -1,13 +0,0 @@ -vector velocity; - -vector momentumSum = vector::zero; - -if (velocityDistribution == "uniform") -{ -# include "uniform.H" -} - -if (velocityDistribution == "maxwellian") -{ -# include "maxwellian.H" -} diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/genMolConfig.C b/applications/utilities/preProcessing/mdInitialise/molConfig_old/genMolConfig.C deleted file mode 100644 index 7df9ce56222..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/genMolConfig.C +++ /dev/null @@ -1,129 +0,0 @@ -/*---------------------------------------------------------------------------*\ - ========= | - \\ / F ield | OpenFOAM: The Open Source CFD Toolbox - \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. - \\/ 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 2 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, write to the Free Software Foundation, - Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA - -\*---------------------------------------------------------------------------*/ - -#include "molConfig.H" -#include "fvCFD.H" - -using namespace Foam; - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // -// Main program: - -int main(int argc, char *argv[]) -{ -# include "setRootCase.H" -# include "createTime.H" -# include "createMesh.H" - - Info<< nl << "Reading molecular configuration description dictionary" - << endl; - - IOobject molConfigDescriptionIOobject - ( - "molConfigDict", - runTime.system(), - runTime, - IOobject::MUST_READ, - IOobject::NO_WRITE, - false - ); - - if (!molConfigDescriptionIOobject.headerOk()) - { - FatalErrorIn(args.executable()) - << "Cannot find molConfig description file " << nl - << args.caseName()/runTime.system()/"molConfig"/"molConfigDict" - << nl << exit(FatalError); - } - - IOdictionary molConfigDescription(molConfigDescriptionIOobject); - - - // Create molCloud, registering object with mesh - - Info<< nl << "Creating molecular configuration" << endl; - - molConfig molecules(molConfigDescription, mesh); - - label totalMolecules = molecules.nMol(); - - if (Pstream::parRun()) - { - reduce(totalMolecules, sumOp<label>()); - } - - Info<< nl << "Total number of molecules added: " << totalMolecules - << nl << endl; - - moleculeCloud molCloud - ( - mesh, - molecules.nMol(), - molecules.id(), - molecules.mass(), - molecules.positions(), - molecules.cells(), - molecules.U(), - molecules.A(), - molecules.tethered(), - molecules.tetherPositions() - ); - - IOdictionary idListDict - ( - IOobject - ( - "idList", - mesh.time().constant(), - mesh, - IOobject::NO_READ, - IOobject::AUTO_WRITE - ) - ); - - idListDict.add("idList", molecules.molIdList()); - - IOstream::defaultPrecision(12); - - Info << nl << "Writing molecular configuration" << endl; - - if (!mesh.write()) - { - FatalErrorIn(args.executable()) - << "Failed writing moleculeCloud." - << nl << exit(FatalError); - } - - Info<< nl << "ClockTime = " << runTime.elapsedClockTime() << " s" - << nl << endl; - - Info << nl << "End\n" << endl; - - return 0; -} - - -// ************************************************************************* // diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/BCC.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/BCC.H deleted file mode 100644 index cd3cbdf100b..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/BCC.H +++ /dev/null @@ -1,179 +0,0 @@ -labelVector iN(0,0,0); - -vector gap = (vector::one)*pow((numberDensity/2.0),-(1.0/3.0)); - -#include "origin.H" - -// Info<< "gap = " << gap << endl; - -// Special treatment is required for the first position, i.e. iteration zero. - -if (n == 0) -{ - latticePosition.x() = (iN.x()*gap.x()); - - latticePosition.y() = (iN.y()*gap.y()); - - latticePosition.z() = (iN.z()*gap.z()); - - // Placing 2 molecules in each unit cell, using the algorithm from - // D. Rapaport, The Art of Molecular Dynamics Simulation, 2nd Ed, p68 - - for (label iU = 0; iU < 2; iU++) - { - vector unitCellLatticePosition = latticePosition; - - if (iU == 1) - { - unitCellLatticePosition += 0.5 * gap; - } - - if (originSpecifies == "corner") - { - unitCellLatticePosition -= 0.25*gap; - } - -// Info << nl << n << ", " << unitCellLatticePosition; - - globalPosition = - origin + transform(latticeToGlobal,unitCellLatticePosition); - - partOfLayerInBounds = mesh_.bounds().contains(globalPosition); - - if - ( - findIndex(mesh_.cellZones()[cZ], mesh_.findCell(globalPosition)) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } -} -else -{ - // Place top and bottom caps. - - for (iN.z() = -n; iN.z() <= n; iN.z() += 2*n) - { - for (iN.y() = -n; iN.y() <= n; iN.y()++) - { - for (iN.x() = -n; iN.x() <= n; iN.x()++) - { - latticePosition.x() = (iN.x() * gap.x()); - - latticePosition.y() = (iN.y() * gap.y()); - - latticePosition.z() = (iN.z() * gap.z()); - - for (label iU = 0; iU < 2; iU++) - { - vector unitCellLatticePosition = latticePosition; - - if (iU == 1) - { - unitCellLatticePosition += 0.5*gap; - } - - if(originSpecifies == "corner") - { - unitCellLatticePosition -= 0.25*gap; - } - -// Info << nl << iN << ", " << unitCellLatticePosition; - - globalPosition = - origin - + transform(latticeToGlobal,unitCellLatticePosition); - - partOfLayerInBounds = - mesh_.bounds().contains(globalPosition); - - if - ( - findIndex - ( - mesh_.cellZones()[cZ], - mesh_.findCell(globalPosition) - ) - != -1) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } - } - } - } - -// Placing sides - - for (iN.z() = -(n-1); iN.z() <= (n-1); iN.z()++) - { - for (label iR = 0; iR <= 2*n -1; iR++) - { - latticePosition.x() = (n*gap.x()); - - latticePosition.y() = ((-n + (iR + 1))*gap.y()); - - latticePosition.z() = (iN.z() * gap.z()); - - for (label iK = 0; iK < 4; iK++) - { - for (label iU = 0; iU < 2; iU++) - { - vector unitCellLatticePosition = latticePosition; - - if (iU == 1) - { - unitCellLatticePosition += 0.5 * gap; - } - - if (originSpecifies == "corner") - { - unitCellLatticePosition -= 0.25*gap; - } - - globalPosition = - origin - + transform(latticeToGlobal,unitCellLatticePosition); - - partOfLayerInBounds = - mesh_.bounds().contains(globalPosition); - - if - ( - findIndex - ( - mesh_.cellZones()[cZ], - mesh_.findCell(globalPosition) - ) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } - - latticePosition = - vector - ( - - latticePosition.y(), - latticePosition.x(), - latticePosition.z() - ); - } - } - } -} diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/FCC.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/FCC.H deleted file mode 100644 index 313ebf96cb8..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/FCC.H +++ /dev/null @@ -1,217 +0,0 @@ -labelVector iN(0,0,0); - -vector gap = (vector::one)*pow((numberDensity/4.0),-(1.0/3.0)); - -#include "origin.H" - -// Info<< "gap = " << gap << endl; - -// Special treatment is required for the first position, i.e. iteration zero. - -if (n == 0) -{ - latticePosition.x() = (iN.x() * gap.x()); - - latticePosition.y() = (iN.y() * gap.y()); - - latticePosition.z() = (iN.z() * gap.z()); - - // Placing 4 molecules in each unit cell, using the algorithm from - // D. Rapaport, The Art of Molecular Dynamics Simulation, 2nd Ed, p68 - - for (label iU = 0; iU < 4; iU++) - { - vector unitCellLatticePosition = latticePosition; - - if (iU != 3) - { - if (iU != 0) - { - unitCellLatticePosition.x() += 0.5 * gap.x(); - } - - if (iU != 1) - { - unitCellLatticePosition.y() += 0.5 * gap.y(); - } - - if (iU != 2) - { - unitCellLatticePosition.z() += 0.5 * gap.z(); - } - } - - if (originSpecifies == "corner") - { - unitCellLatticePosition -= 0.25*gap; - } - -// Info << nl << n << ", " << unitCellLatticePosition; - - globalPosition = - origin + transform(latticeToGlobal,unitCellLatticePosition); - - partOfLayerInBounds = mesh_.bounds().contains(globalPosition); - - if - ( - findIndex(mesh_.cellZones()[cZ], mesh_.findCell(globalPosition)) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } -} -else -{ - // Place top and bottom caps. - - for (iN.z() = -n; iN.z() <= n; iN.z() += 2*n) - { - for (iN.y() = -n; iN.y() <= n; iN.y()++) - { - for (iN.x() = -n; iN.x() <= n; iN.x()++) - { - latticePosition.x() = (iN.x() * gap.x()); - - latticePosition.y() = (iN.y() * gap.y()); - - latticePosition.z() = (iN.z() * gap.z()); - - for (label iU = 0; iU < 4; iU++) - { - vector unitCellLatticePosition = latticePosition; - - if (iU != 3) - { - if (iU != 0) - { - unitCellLatticePosition.x() += 0.5 * gap.x(); - } - - if (iU != 1) - { - unitCellLatticePosition.y() += 0.5 * gap.y(); - } - - if (iU != 2) - { - unitCellLatticePosition.z() += 0.5 * gap.z(); - } - } - - if (originSpecifies == "corner") - { - unitCellLatticePosition -= 0.25*gap; - } - - globalPosition = - origin - + transform(latticeToGlobal,unitCellLatticePosition); - - partOfLayerInBounds = - mesh_.bounds().contains(globalPosition); - - if - ( - findIndex - ( - mesh_.cellZones()[cZ], - mesh_.findCell(globalPosition) - ) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } - } - } - } - -// Placing sides - - for (iN.z() = -(n-1); iN.z() <= (n-1); iN.z()++) - { - for (label iR = 0; iR <= 2*n -1; iR++) - { - latticePosition.x() = (n * gap.x()); - - latticePosition.y() = ((-n + (iR + 1)) * gap.y()); - - latticePosition.z() = (iN.z() * gap.z()); - - for (label iK = 0; iK < 4; iK++) - { - for (label iU = 0; iU < 4; iU++) - { - vector unitCellLatticePosition = latticePosition; - - if (iU != 3) - { - if (iU != 0) - { - unitCellLatticePosition.x() += 0.5 * gap.x(); - } - - if (iU != 1) - { - unitCellLatticePosition.y() += 0.5 * gap.y(); - } - - if (iU != 2) - { - unitCellLatticePosition.z() += 0.5 * gap.z(); - } - } - - if (originSpecifies == "corner") - { - unitCellLatticePosition -= 0.25*gap; - } - - globalPosition = - origin - + transform(latticeToGlobal,unitCellLatticePosition); - - partOfLayerInBounds = - mesh_.bounds().contains(globalPosition); - - if - ( - findIndex - ( - mesh_.cellZones()[cZ], - mesh_.findCell(globalPosition) - ) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } - - latticePosition = - vector - ( - - latticePosition.y(), - latticePosition.x(), - latticePosition.z() - ); - } - } - } -} diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/SC.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/SC.H deleted file mode 100644 index dd0ff7c00f6..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/latticeStructures/SC.H +++ /dev/null @@ -1,127 +0,0 @@ -labelVector iN(0,0,0); - -vector gap = (vector::one)*pow(numberDensity, -(1.0/3.0)); - -#include "origin.H" - -// Info<< "gap = " << gap << endl; - -// Special treatment is required for the first position, i.e. iteration zero. - -if (n == 0) -{ - latticePosition = vector::zero; - - if (originSpecifies == "corner") - { - latticePosition += 0.5*gap; - } - - globalPosition = origin + transform(latticeToGlobal,latticePosition); - - partOfLayerInBounds = mesh_.bounds().contains(globalPosition); - - if (findIndex(mesh_.cellZones()[cZ], mesh_.findCell(globalPosition)) != -1) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } -} -else -{ - for (iN.z() = -n; iN.z() <= n; iN.z() += 2*n) - { - for (iN.y() = -n; iN.y() <= n; iN.y()++) - { - for (iN.x() = -n; iN.x() <= n; iN.x()++) - { - latticePosition.x() = (iN.x() * gap.x()); - - latticePosition.y() = (iN.y() * gap.y()); - - latticePosition.z() = (iN.z() * gap.z()); - - if (originSpecifies == "corner") - { - latticePosition += 0.5*gap; - } - - globalPosition = - origin + transform(latticeToGlobal,latticePosition); - - partOfLayerInBounds = mesh_.bounds().contains(globalPosition); - - if - ( - findIndex - ( - mesh_.cellZones()[cZ], - mesh_.findCell(globalPosition) - ) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - } - } - } - - tensor quarterRotate(EulerCoordinateRotation(-90, 0, 0, true).R()); - - iN.x() = n; - for (iN.z() = -(n-1); iN.z() <= (n-1); iN.z()++) - { - for (iN.y() = -(n-1); iN.y() <= n; iN.y()++) - { - latticePosition.x() = (iN.x()*gap.x()); - - latticePosition.y() = (iN.y()*gap.y()); - - latticePosition.z() = (iN.z()*gap.z()); - - for (label iR = 0; iR < 4; iR++) - { - vector offsetCorrectedLatticePosition = latticePosition; - - if (originSpecifies == "corner") - { - offsetCorrectedLatticePosition += 0.5*gap; - } - - globalPosition = - origin - + transform(latticeToGlobal,offsetCorrectedLatticePosition); - - partOfLayerInBounds = mesh_.bounds().contains(globalPosition); - - if - ( - findIndex - ( - mesh_.cellZones()[cZ], - mesh_.findCell(globalPosition) - ) - != -1 - ) - { - molsPlacedThisIteration++; - - initialPositions.append(globalPosition); - - initialCelli.append(mesh_.findCell(globalPosition)); - } - - latticePosition = transform(quarterRotate,latticePosition); - } - } - } -} - diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.C b/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.C deleted file mode 100644 index e81c24ca6a3..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.C +++ /dev/null @@ -1,50 +0,0 @@ -/*---------------------------------------------------------------------------*\ - ========= | - \\ / F ield | OpenFOAM: The Open Source CFD Toolbox - \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. - \\/ 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 2 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, write to the Free Software Foundation, - Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA - -\*---------------------------------------------------------------------------*/ - -#include "molConfig.H" - -// * * * * * * * * * * * * * * * * Constructor * * * * * * * * * * * * * * * // - -Foam::molConfig::molConfig -( - IOdictionary& molConfigDescription, - const polyMesh& mesh -) -: - molConfigDescription_(molConfigDescription), - mesh_(mesh) -{ - createMolecules(); -} - - -// * * * * * * * * * * * * * * * * Destructor * * * * * * * * * * * * * * * // - -Foam::molConfig::~molConfig() -{} - - -// ************************************************************************* // diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.H deleted file mode 100644 index 3b0ba8fd504..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfig.H +++ /dev/null @@ -1,147 +0,0 @@ -/*---------------------------------------------------------------------------*\ - ========= | - \\ / F ield | OpenFOAM: The Open Source CFD Toolbox - \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. - \\/ 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 2 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, write to the Free Software Foundation, - Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA - -Class - Foam::molConfig - -Description - -SourceFiles - molConfigI.H - molConfig.C - molConfigIO.C - -\*---------------------------------------------------------------------------*/ - -#ifndef molConfig_H -#define molConfig_H - -#include "labelVector.H" -#include "scalar.H" -#include "vector.H" -#include "labelField.H" -#include "scalarField.H" -#include "vectorField.H" -#include "IOField.H" -#include "EulerCoordinateRotation.H" -#include "Random.H" - -#include "Time.H" -#include "IOdictionary.H" -#include "IOstreams.H" -#include "moleculeCloud.H" - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -namespace Foam -{ - -/*---------------------------------------------------------------------------*\ - Class molConfig Declaration -\*---------------------------------------------------------------------------*/ - -class molConfig -{ - // Private data - - const IOdictionary& molConfigDescription_; - - const polyMesh& mesh_; - - DynamicList<word> idList_; - - labelField id_; - - scalarField mass_; - - vectorField positions_; - - labelField cells_; - - vectorField U_; - - vectorField A_; - - labelField tethered_; - - vectorField tetherPositions_; - - label nMol_; - - -public: - - // Constructors - - //- Construct from IOdictionary and mesh - molConfig(IOdictionary&, const polyMesh&); - - - // Destructor - - ~molConfig(); - - - // Member Functions - - void createMolecules(); - - - // Access - - inline const List<word>& molIdList() const; - - inline const labelField& id() const; - - inline const scalarField& mass() const; - - inline const vectorField& positions() const; - - inline const labelField& cells() const; - - inline const vectorField& U() const; - - inline const vectorField& A() const; - - inline const labelField& tethered() const; - - inline const vectorField& tetherPositions() const; - - inline label nMol() const; -}; - - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -} // End namespace Foam - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -#include "molConfigI.H" - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -#endif - -// ************************************************************************* // diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfigI.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfigI.H deleted file mode 100644 index 2cfd5bf57bc..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/molConfigI.H +++ /dev/null @@ -1,98 +0,0 @@ -/*---------------------------------------------------------------------------*\ - ========= | - \\ / F ield | OpenFOAM: The Open Source CFD Toolbox - \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. - \\/ 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 2 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, write to the Free Software Foundation, - Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA - -\*---------------------------------------------------------------------------*/ - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -namespace Foam -{ - -// * * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * // - -inline const List<word>& molConfig::molIdList() const -{ - return idList_; -} - - -inline const labelField& molConfig::id() const -{ - return id_; -} - - -inline const scalarField& molConfig::mass() const -{ - return mass_; -} - - -inline const vectorField& molConfig::positions() const -{ - return positions_; -} - - -inline const labelField& molConfig::cells() const -{ - return cells_; -} - - -inline const vectorField& molConfig::U() const -{ - return U_; -} - - -inline const vectorField& molConfig::A() const -{ - return A_; -} - - -inline const labelField& molConfig::tethered() const -{ - return tethered_; -} - - -inline const vectorField& molConfig::tetherPositions() const -{ - return tetherPositions_; -} - - -inline label molConfig::nMol() const -{ - return nMol_; -} - - -// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // - -} // End namespace Foam - -// ************************************************************************* // diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/origin.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/origin.H deleted file mode 100644 index 24bc994d34f..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/origin.H +++ /dev/null @@ -1,49 +0,0 @@ -// Please refer to notes - -// 1. Determine the unit cell dimensions: xU, yU and zU - -const scalar xU = gap.x(); -const scalar yU = gap.y(); -const scalar zU = gap.z(); - -// 2. Determine the anchorPoint co-ordinates: xA, yA and zA - -const scalar xA = anchorPoint.x(); -const scalar yA = anchorPoint.y(); -const scalar zA = anchorPoint.z(); - -// 3. Determine the vector rAB from global co-ordinate system: - -const vector rAB((xMid - xA), (yMid - yA), (zMid - zA)); - -// 4. Transform vector rAS into lattice co-ordinate system: - -const vector rASTransf = transform(latticeToGlobal.T(), rAB); - -// Info << "The vector rAS = " << rAS << endl; -// Info << "The vector rAStransf = " << rAStransf << endl; - -// 5. Calculate the integer values: ni, nj and nk -scalar nIscalar = rASTransf.x()/xU; -scalar nJscalar = rASTransf.y()/yU; -scalar nKscalar = rASTransf.z()/zU; - -// Info << "The nI, nJ, nK values before are: " << nIscalar <<" "<< nJscalar <<" "<< nKscalar << endl; - -label nI = label(nIscalar + 0.5*sign(nIscalar)); -label nJ = label(nJscalar + 0.5*sign(nJscalar)); -label nK = label(nKscalar + 0.5*sign(nKscalar)); - -// Info << "The nI, nJ, nK values after are: " << nI <<" "<< nJ <<" "<< nK << endl; - -// 6. Calculate the corrected starting point, rAC (in the lattice co-ordinate system): -const vector rAC((nI*xU), (nJ*yU), (nK*zU)); - -// 7. Transform the corrected starting point in the global co-ordinate system, rC: -const vector rC = anchorPoint + transform(latticeToGlobal, rAC); - - -const vector& origin = rC; - -// Pout << "The Corrected Starting Point: " << origin << endl; - diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/readZoneSubDict.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/readZoneSubDict.H deleted file mode 100644 index 72705c761e2..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/readZoneSubDict.H +++ /dev/null @@ -1,93 +0,0 @@ - -// Info << "Zone description subDict " << cZ <<": " << cellZoneI[cZ].name() << endl; - -const dictionary& subDictI = - molConfigDescription_.subDict(cellZoneI[cZ].name()); - -const scalar temperature(readScalar(subDictI.lookup("temperature"))); - -const word velocityDistribution(subDictI.lookup("velocityDistribution")); - -const vector bulkVelocity(subDictI.lookup("bulkVelocity")); - -const word id(subDictI.lookup("id")); - -const scalar mass(readScalar(subDictI.lookup("mass"))); - -scalar numberDensity_read(0.0); - -if (subDictI.found("numberDensity")) -{ - numberDensity_read = readScalar(subDictI.lookup("numberDensity")); -} -else if (subDictI.found("massDensity")) -{ - numberDensity_read = readScalar(subDictI.lookup("massDensity"))/mass; -} -else -{ - FatalErrorIn("readZoneSubDict.H\n") - << "massDensity or numberDensity not specified " << nl - << abort(FatalError); -} - -const scalar numberDensity(numberDensity_read); - -const word latticeStructure(subDictI.lookup("latticeStructure")); - -const vector anchorPoint(subDictI.lookup("anchor")); - -const word originSpecifies(subDictI.lookup("anchorSpecifies")); - -if -( - originSpecifies != "corner" - && originSpecifies != "molecule" -) -{ - FatalErrorIn("readZoneSubDict.H\n") - << "anchorSpecifies must be either 'corner' or 'molecule', found " - << originSpecifies << nl - << abort(FatalError); -} - -bool tethered = false; - -if (subDictI.found("tethered")) -{ - tethered = Switch(subDictI.lookup("tethered")); -} - -const vector orientationAngles(subDictI.lookup("orientationAngles")); - -scalar phi(orientationAngles.x()*mathematicalConstant::pi/180.0); -scalar theta(orientationAngles.y()*mathematicalConstant::pi/180.0); -scalar psi(orientationAngles.z()*mathematicalConstant::pi/180.0); - -const tensor latticeToGlobal -( - cos(psi)*cos(phi) - cos(theta)*sin(phi)*sin(psi), - cos(psi)*sin(phi) + cos(theta)*cos(phi)*sin(psi), - sin(psi)*sin(theta), - - sin(psi)*cos(phi) - cos(theta)*sin(phi)*cos(psi), - - sin(psi)*sin(phi) + cos(theta)*cos(phi)*cos(psi), - cos(psi)*sin(theta), - sin(theta)*sin(phi), - - sin(theta)*cos(phi), - cos(theta) -); - -// Info << "\tcells: " << cellZoneI[cZ].size() << endl; -// Info << "\tnumberDensity: " << numberDensity << endl; -// Info << "\ttemperature: " << temperature << endl; -// Info << "\tvelocityDistribution: " << velocityDistribution << endl; -// Info << "\tbulkVelocity: " << bulkVelocity << endl; -// Info << "\tid: " << id << endl; -// Info << "\tmass: " << mass << endl; -// Info << "\tlatticeStructure: " << latticeStructure << endl; -// Info << "\tanchor: " << anchorPoint << endl; -// Info << "\toriginSpecifies: " << originSpecifies << endl; -// Info << "\ttethered: " << tethered << endl; -// Info << "\torientationAngles: " << orientationAngles << endl; -// Info << "\tlatticeToGlobal: " << latticeToGlobal << endl; - diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/startingPoint.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/startingPoint.H deleted file mode 100644 index 6ae01c83f11..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/startingPoint.H +++ /dev/null @@ -1,97 +0,0 @@ -scalar xMax = 0; - -scalar yMax = 0; - -scalar zMax = 0; - -scalar xMin = 0; - -scalar yMin = 0; - -scalar zMin = 0; - -label xMaxPtLabel = 0; - -label yMaxPtLabel = 0; - -label zMaxPtLabel = 0; - -label xMinPtLabel = 0; - -label yMinPtLabel = 0; - -label zMinPtLabel = 0; - -forAll (cellZoneI[cZ], nC) -{ - const labelList& cellPointsJ = mesh_.cellPoints()[cellZoneI[cZ][nC]]; - - forAll(cellPointsJ, nP) - { - const point& ptI = mesh_.points()[cellPointsJ[nP]]; - - const label& ptILabel = cellPointsJ[nP]; - - if (ptI.x() > xMax || nC == 0) - { - xMax = ptI.x(); - xMaxPtLabel = ptILabel; - } - if (ptI.y() > yMax || nC == 0) - { - yMax = ptI.y(); - yMaxPtLabel = ptILabel; - } - if (ptI.z() > zMax || nC == 0) - { - zMax = ptI.z(); - zMaxPtLabel = ptILabel; - } - if (ptI.x() < xMin || nC == 0) - { - xMin = ptI.x(); - xMinPtLabel = ptILabel; - } - if (ptI.y() < yMin || nC == 0) - { - yMin = ptI.y(); - yMinPtLabel = ptILabel; - } - if (ptI.z() < zMin || nC == 0) - { - zMin = ptI.z(); - zMinPtLabel = ptILabel; - } - } -} - -// Info << "Xmax: label = " << xMaxPtLabel2 << "; vector = " <<mesh_.points()[xMaxPtLabel2] -// <<"; x-component = " << mesh_.points()[xMaxPtLabel2].x() << endl; -// Info << "Ymax: label = " << yMaxPtLabel2 << "; vector = " <<mesh_.points()[yMaxPtLabel2] -// <<"; y-component = " << mesh_.points()[yMaxPtLabel2].y() << endl; -// Info << "Zmax: label = " << zMaxPtLabel2 << "; vector = " <<mesh_.points()[zMaxPtLabel2] -// <<"; z-component = " << mesh_.points()[zMaxPtLabel2].z() << endl; -// -// Info << "Xmin: label = " << xMinPtLabel << "; vector = " <<mesh_.points()[xMinPtLabel] -// <<"; x-component = " << mesh_.points()[xMinPtLabel].x() << endl; -// Info << "Ymin: label = " << yMinPtLabel << "; vector = " <<mesh_.points()[yMinPtLabel] -// <<"; y-component = " << mesh_.points()[yMinPtLabel].y() << endl; -// Info << "Zmin: label = " << zMinPtLabel << "; vector = " <<mesh_.points()[zMinPtLabel] -// <<"; z-component = " << mesh_.points()[zMinPtLabel].z() << endl; - -scalar xMid = - (mesh_.points()[xMaxPtLabel].x() - + mesh_.points()[xMinPtLabel].x()) / 2; - -scalar yMid = - (mesh_.points()[yMaxPtLabel].y() - + mesh_.points()[yMinPtLabel].y()) / 2; - -scalar zMid = - (mesh_.points()[zMaxPtLabel].z() - + mesh_.points()[zMinPtLabel].z()) / 2; - -vector rS(xMid, yMid, zMid); - -// Info << "\t The Estimated Starting Point: " << rS << endl; - diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/maxwellian.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/maxwellian.H deleted file mode 100644 index 01c3ff87168..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/maxwellian.H +++ /dev/null @@ -1,26 +0,0 @@ -scalar velCmptMag = sqrt(moleculeCloud::kb*temperature/mass); - -for (molN = totalMols; molN < totalMols + totalZoneMols; molN++) -{ - // Assign velocity: random direction, magnitude determined by desired - // maxwellian distribution at temperature - - // Temperature gradients could be created by specifying a gradient in the - // zone subDict, or by reading a field from a mesh. - - // The velocities are treated on a zone-by-zone basis for the purposes of - // removal of bulk momentum - hence nMols becomes totalZoneMols - - velocity = vector - ( - velCmptMag*rand.GaussNormal(), - velCmptMag*rand.GaussNormal(), - velCmptMag*rand.GaussNormal() - ); - - momentumSum += mass*velocity; - - initialVelocities.append(velocity); -} - - diff --git a/applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/uniform.H b/applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/uniform.H deleted file mode 100644 index 9c178af262a..00000000000 --- a/applications/utilities/preProcessing/mdInitialise/molConfig_old/velocityDistributions/uniform.H +++ /dev/null @@ -1,27 +0,0 @@ -scalar initVelMag = - sqrt - ( - 3.0*(1.0 - 1.0 / totalZoneMols) - *moleculeCloud::kb*temperature - /mass - ); - -for (molN = totalMols; molN < totalMols + totalZoneMols; molN++) -{ - // Assign velocity: random direction, magnitude determined by desired - // temperature - - // Temperature gradients could be created by specifying a gradient in the - // zone subDict, or by reading a field from a mesh. - - // The velocities are treated on a zone-by-zone basis for the purposes of - // removal of bulk momentum - hence nMols becomes totalZoneMols - - velocity = (2.0*rand.vector01() - vector::one); - - velocity *= initVelMag/mag(velocity); - - momentumSum += mass*velocity; - - initialVelocities.append(velocity); -} diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.C b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.C index 18d46cb90a7..80c930bb028 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.C +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.H b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.H index 53b8f9371dd..ed8afa21158 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.H +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulator.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorI.H b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorI.H index 96531509c8e..28bcde97a99 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorI.H +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorIO.C b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorIO.C index 8e5d7c9d729..2de8ccfb119 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorIO.C +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/bufferedAccumulator/bufferedAccumulatorIO.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.C b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.C index eca654aa2dd..adad29b3f11 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.C +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.H b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.H index 2b8753676c5..b751d044f75 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.H +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunction.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionI.H b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionI.H index d07d54eca0a..adbf7050599 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionI.H +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionIO.C b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionIO.C index 7dcbcc1eda1..b1532271884 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionIO.C +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/correlationFunction/correlationFunctionIO.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.C b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.C index a4a08b08fa6..8c666939e85 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.C +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.H b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.H index 597d2eedb08..363f68a6cfb 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.H +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distribution.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionI.H b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionI.H index 988d76de31c..4bc3596a509 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionI.H +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionIO.C b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionIO.C index 65743800e84..7e5a0118f07 100644 --- a/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionIO.C +++ b/src/lagrangian/molecularDynamics/molecularMeasurements/distribution/distributionIO.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.C index a28d5300150..6af4e7d5bf3 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.H index 3777b0b098e..04a957170ce 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionList.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionListI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionListI.H index 7c1ded995b3..26529babb6a 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionListI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/directInteractionList/directInteractionListI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.C index 411d6dbfba2..10985a4cc27 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.H index a8d28133eb7..a8eeb55ddfa 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionLists.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionListsI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionListsI.H index 6749e05be01..7c5c4ec1227 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionListsI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/interactionListsI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.C index db0831eaee8..e2db2ae6d72 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.H index b7ec5a26fac..91ebe8eb32c 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralList.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralListI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralListI.H index 48b11405b4d..56134aca58f 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralListI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/receivingReferralListI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.C index bb0b3b1e529..e0a77379107 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.H index 30afadebee5..b7b9bf082cc 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralList.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralListI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralListI.H index 51c569cfd20..c6479a14cf6 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralListI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referralLists/sendingReferralListI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.C index 194caa11e2c..d2a0ecd475e 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.H index 789c9e4d414..7f2e5bdbe74 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCell.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCellI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCellI.H index a7427c141da..bd3954e83cd 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCellI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCell/referredCellI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.C index fbc5c1740be..373385ae4dc 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.H index e323a9dcb66..54c137ed538 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellList.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellListI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellListI.H index a81d6cf8e83..588bf94eabb 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellListI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredCellList/referredCellListI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.C b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.C index 3db08989c32..1b19d21d7f5 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.C +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.H index 13fd0983d74..45d342d2edf 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMolecule.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMoleculeI.H b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMoleculeI.H index 102bd5e30fb..1b9666f20ea 100644 --- a/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMoleculeI.H +++ b/src/lagrangian/molecularDynamics/molecule/interactionLists/referredMolecule/referredMoleculeI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/calculateAutoCorrelationFunctions.H b/src/lagrangian/molecularDynamics/molecule/mdTools/calculateAutoCorrelationFunctions.H index ce0113352e3..bc5848475d3 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/calculateAutoCorrelationFunctions.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/calculateAutoCorrelationFunctions.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/calculateTransportProperties.H b/src/lagrangian/molecularDynamics/molecule/mdTools/calculateTransportProperties.H index 1ffbcc15b79..74f1db9da7f 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/calculateTransportProperties.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/calculateTransportProperties.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/createAutoCorrelationFunctions.H b/src/lagrangian/molecularDynamics/molecule/mdTools/createAutoCorrelationFunctions.H index 6821055ae00..ab2d593cc68 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/createAutoCorrelationFunctions.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/createAutoCorrelationFunctions.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/meanMomentumEnergyAndNMols.H b/src/lagrangian/molecularDynamics/molecule/mdTools/meanMomentumEnergyAndNMols.H index be97a829c18..827ff3ffc26 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/meanMomentumEnergyAndNMols.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/meanMomentumEnergyAndNMols.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressure.H b/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressure.H index 0718750e531..cd02fcce08a 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressure.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressure.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressureVariables.H b/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressureVariables.H index 196299e7938..9856c9d4da8 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressureVariables.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureAndPressureVariables.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureEquilibration.H b/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureEquilibration.H index 1d924db4b49..b1ac5d4230e 100644 --- a/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureEquilibration.H +++ b/src/lagrangian/molecularDynamics/molecule/mdTools/temperatureEquilibration.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C b/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C index ac45040c096..ef5e4b0250c 100644 --- a/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C +++ b/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/molecule/molecule.H b/src/lagrangian/molecularDynamics/molecule/molecule/molecule.H index 6734671596f..13111e5ac4f 100644 --- a/src/lagrangian/molecularDynamics/molecule/molecule/molecule.H +++ b/src/lagrangian/molecularDynamics/molecule/molecule/molecule.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/molecule/moleculeI.H b/src/lagrangian/molecularDynamics/molecule/molecule/moleculeI.H index 824a8acf80a..743d45b7f9b 100644 --- a/src/lagrangian/molecularDynamics/molecule/molecule/moleculeI.H +++ b/src/lagrangian/molecularDynamics/molecule/molecule/moleculeI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/molecule/moleculeIO.C b/src/lagrangian/molecularDynamics/molecule/molecule/moleculeIO.C index a01458e1772..f43b4aac6e2 100644 --- a/src/lagrangian/molecularDynamics/molecule/molecule/moleculeIO.C +++ b/src/lagrangian/molecularDynamics/molecule/molecule/moleculeIO.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.C b/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.C index da2cb8c0f09..e69f1dfa5d4 100644 --- a/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.C +++ b/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.H b/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.H index 48eb999a684..719605a89cc 100644 --- a/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.H +++ b/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloud.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloudI.H b/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloudI.H index c4b8e5d89c7..acc33480440 100644 --- a/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloudI.H +++ b/src/lagrangian/molecularDynamics/molecule/moleculeCloud/moleculeCloudI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.C b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.C index e9b048507bd..6836c2bc277 100644 --- a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.C +++ b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.H b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.H index 294aa7770e6..cce0c725f18 100644 --- a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.H +++ b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnits.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsI.H b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsI.H index 8f3ae51b16a..72ff2437764 100644 --- a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsI.H +++ b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsIO.C b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsIO.C index 175a2aa4899..03b4489ec5a 100644 --- a/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsIO.C +++ b/src/lagrangian/molecularDynamics/molecule/reducedUnits/reducedUnitsIO.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.C b/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.C index 17fe776235a..bc0f50a9442 100644 --- a/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.C +++ b/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.H b/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.H index 0bc0e0d4d04..cee15d771bd 100644 --- a/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.H +++ b/src/lagrangian/molecularDynamics/potential/electrostaticPotential/electrostaticPotential.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.C index c06f90ea27e..2110ca84281 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.H b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.H index 4473fe2bb04..5055db985f3 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.H +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/energyScalingFunction.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/newEnergyScalingFunction.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/newEnergyScalingFunction.C index 92166f86321..e9c03e78c08 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/newEnergyScalingFunction.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/basic/newEnergyScalingFunction.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.C index 6ca0fff321c..6c43a1d63e7 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.H b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.H index 6144bc388d3..b2b9e189e96 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.H +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/doubleSigmoid/doubleSigmoid.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.C index ea4ec88ed43..4b89cb174e7 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.H b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.H index 845634d7be8..ea2ad62aef1 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.H +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/noScaling/noScaling.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.C index 90eccc9b802..9b4c5a4b9ce 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.H b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.H index 1aeca9e87fd..1177a35febc 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.H +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shifted/shifted.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.C index dec8729fae9..da2b2baaf04 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.H b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.H index 5f908854819..2ae26169ab5 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.H +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/shiftedForce/shiftedForce.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.C b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.C index 43483221ae5..443fbb0ade9 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.C +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.H b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.H index 81a6e31261a..8a37ad86003 100644 --- a/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.H +++ b/src/lagrangian/molecularDynamics/potential/energyScalingFunction/derived/sigmoid/sigmoid.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/newPairPotential.C b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/newPairPotential.C index b5251d733c8..d9092c1a24f 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/newPairPotential.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/newPairPotential.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.C b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.C index 0d42b0b2f96..b3e609f4e77 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.H b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.H index c8040303071..e1ddc7b5448 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotential.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialI.H b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialI.H index f39140c38bb..4c2ef76b8e5 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialI.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialIO.C b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialIO.C index 5c0893045a4..dffe4233b40 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialIO.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/basic/pairPotentialIO.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.C index 0327f163d56..2d990c110b9 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.H index e7904674ddf..5af682d87a6 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/azizChen/azizChen.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.C index d7a87238f07..21444b215f1 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.H index 115884990b8..cb3eada59e5 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/coulomb/coulomb.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.C index ca1038350cc..711c2a45112 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.H index 625d9a90813..eb44399dbe6 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/dampedCoulomb/dampedCoulomb.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.C index ccd54ec787d..a303935b1e8 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.H index e579c7e5937..148ea002cfd 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/exponentialRepulsion/exponentialRepulsion.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.C index 9c93f3a70e0..4e3e6349305 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.H index 829827120b5..92dc4b5f558 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/lennardJones/lennardJones.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.C index a813495f267..6ae3c92add6 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.H index d2097b42fe9..37468b2daf5 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/maitlandSmith/maitlandSmith.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.C b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.C index ca43080d748..d3c08871eb2 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.H b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.H index d4d7a9f208d..938f2a30a9c 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/derived/noInteraction/noInteraction.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.C b/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.C index 4baf91932f7..0172cf94c07 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.C +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.H b/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.H index a70179fc78b..19e678eb229 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialList.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialListI.H b/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialListI.H index 844f641ca14..0e296697f10 100644 --- a/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialListI.H +++ b/src/lagrangian/molecularDynamics/potential/pairPotential/pairPotentialList/pairPotentialListI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/potential/potential.C b/src/lagrangian/molecularDynamics/potential/potential/potential.C index 506b3be2a74..5532c2f105c 100644 --- a/src/lagrangian/molecularDynamics/potential/potential/potential.C +++ b/src/lagrangian/molecularDynamics/potential/potential/potential.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/potential/potential.H b/src/lagrangian/molecularDynamics/potential/potential/potential.H index 77fca79f5f6..5c8569cb0cc 100644 --- a/src/lagrangian/molecularDynamics/potential/potential/potential.H +++ b/src/lagrangian/molecularDynamics/potential/potential/potential.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/potential/potentialI.H b/src/lagrangian/molecularDynamics/potential/potential/potentialI.H index f0cd7de3dad..0b72556152c 100644 --- a/src/lagrangian/molecularDynamics/potential/potential/potentialI.H +++ b/src/lagrangian/molecularDynamics/potential/potential/potentialI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/newTetherPotential.C b/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/newTetherPotential.C index 4caba50778c..d8c4e575326 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/newTetherPotential.C +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/newTetherPotential.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.C b/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.C index 462be334561..4c4708ba96a 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.C +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.H b/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.H index 19a9cddb777..a70da011778 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.H +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/basic/tetherPotential.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.C b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.C index 453d5898ab8..1edcc70a155 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.C +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.H b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.H index 5ecb91023c9..90b3251c171 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.H +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/harmonicSpring/harmonicSpring.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.C b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.C index 7e12f9ab74e..8a3a081f6fc 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.C +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.H b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.H index f1c734a14f3..f78a3aa7c26 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.H +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/pitchForkRing/pitchForkRing.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.C b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.C index 45a48a4c623..289190798f0 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.C +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.H b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.H index 5680437bd30..028809010ab 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.H +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/derived/restrainedHarmonicSpring/restrainedHarmonicSpring.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.C b/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.C index 9d52d49c060..d0b514b9b59 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.C +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.C @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.H b/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.H index a48cc21edec..cb9bf9633b1 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.H +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialList.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License diff --git a/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialListI.H b/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialListI.H index 67b1e4dbe62..73834281efd 100644 --- a/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialListI.H +++ b/src/lagrangian/molecularDynamics/potential/tetherPotential/tetherPotentialList/tetherPotentialListI.H @@ -2,7 +2,7 @@ ========= | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox \\ / O peration | - \\ / A nd | Copyright (C) 1991-2009 OpenCFD Ltd. + \\ / A nd | Copyright (C) 2008-2009 OpenCFD Ltd. \\/ M anipulation | ------------------------------------------------------------------------------- License -- GitLab