OpenMD 3.0
Molecular Dynamics in the Open
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OpenMD::ForceMatrixDecomposition Member List

This is the complete list of members for OpenMD::ForceMatrixDecomposition, including all inherited members.

addForceToAtomColumn(int atom2, Vector3d fg) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
addForceToAtomRow(int atom1, Vector3d fg) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
addToHeatFlux(Vector3d hf) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
atomStorageLayout_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
atypesLocal (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
buildNeighborList(vector< int > &neighborList, vector< int > &point, vector< Vector3d > &savedPositions) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
cellList_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
cellOffsets_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
cgColToGlobal (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecomposition
cgRowToGlobal (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecomposition
checkNeighborList(vector< Vector3d > savedPositions) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
collectData() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
collectIntermediateData() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
collectSelfData()OpenMD::ForceMatrixDecompositionvirtual
cutoffGroupStorageLayout_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
distributeData() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
distributeInitialData()OpenMD::ForceMatrixDecompositionvirtual
distributeIntermediateData() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
excludeAtomPair(int atom1, int atom2)OpenMD::ForceMatrixDecompositionvirtual
excludedPot (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
excludedSelfPot (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
excludesForAtom (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
ff_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
fillInteractionData(InteractionData &idat, int atom1, int atom2, bool newAtom1=true) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
fillPreForceData(SelfData &sdat, int atom) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
fillSelfData(SelfData &sdat, int atom) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
ForceDecomposition(SimInfo *info, InteractionManager *iMan) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecomposition
ForceMatrixDecomposition(SimInfo *info, InteractionManager *iMan) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecomposition
getAtomsInGroupColumn(int cg2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getAtomsInGroupRow(int cg1)OpenMD::ForceMatrixDecompositionvirtual
getAtomToGroupVectorColumn(int atom2, int cg2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getAtomToGroupVectorRow(int atom1, int cg1) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getAtomVelocityColumn(int atom2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getExcludedPotential() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
getExcludedSelfPotential() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
getExcludesForAtom(int atom1) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getGlobalID(int atom1) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getGlobalIDCol(int atom1) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getGlobalIDRow(int atom1) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getGroupVelocityColumn(int cg2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getInteratomicVector(int atom1, int atom2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getIntergroupVector(int cg1, int cg2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getMassFactorColumn(int atom2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getMassFactorRow(int atom1) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getNAtomsInRow() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
getPairwisePotential() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
getSelectedPotential() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
getSelectedSelfPotential() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
getSelfPotential() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
getTopologicalDistance(int atom1, int atom2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
groupList_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
idents (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
info_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
interactionMan_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
massFactors (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
nCells_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
needVelocities_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
pairwisePot (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
rCut_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
regions (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
rigidBodyStorageLayout_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
rList_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
rListSq_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
selectedPot (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
selectedSelfPot (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
selfPot (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
setCutoffRadius(RealType rCut) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecomposition
setHeatFlux(Vector3d hf) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
setSnapshot(Snapshot *snap) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
skinThickness_OpenMD::ForceDecompositionprotected
skipAtomPair(int atom1, int atom2, int cg1, int cg2)OpenMD::ForceMatrixDecompositionvirtual
sman_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
snap_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
topoDist (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
toposForAtomOpenMD::ForceDecompositionprotected
unpackInteractionData(InteractionData &idat, int atom1, int atom2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
unpackPreForceData(SelfData &sdat, int atom) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
unpackPrePairData(InteractionData &idat, int atom1, int atom2) (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
unpackSelfData(SelfData &sdat, int atom) (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionvirtual
usePeriodicBoundaryConditions_ (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositionprotected
zeroWorkArrays() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecompositionvirtual
~ForceDecomposition() (defined in OpenMD::ForceDecomposition)OpenMD::ForceDecompositioninlinevirtual
~ForceMatrixDecomposition() (defined in OpenMD::ForceMatrixDecomposition)OpenMD::ForceMatrixDecomposition