Here is a list of all class members with links to the classes they belong to:

- d -

• d_A : dftfe::MixingScheme
• d_adaptiveMixingParameterDecAllIterations : dftfe::MixingScheme
• d_adaptiveMixingParameterDecLastIteration : dftfe::MixingScheme
• d_adaptiveMixingParameterIncAllIterations : dftfe::MixingScheme
• d_adaptMixingParameter : dftfe::MixingScheme
• d_affineTransformMesh : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_allowGaussianOverlapOnAtoms : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_allOwnedRanges : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_AllReduceCompleted : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_alpha : dftfe::LBFGSNonLinearSolver, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_alphaChk : dftfe::cgPRPNonLinearSolver
• d_angleTol : dftfe::GaussianBasis, dftfe::SlaterBasis
• d_anyMixingParameterAdaptive : dftfe::MixingScheme
• d_AtomCenteredFnIdsNumberingMapCurrentProcess : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_atomCenteredKpointIndexedSphericalFnQuadValues : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_atomCenteredKpointTimesSphericalFnTimesDistFromAtomQuadValues : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_atomCenteredOrbitalsPostProcessingPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomCenteredSphericalFunctionContainer : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_atomCoordinates : dftfe::dispersionCorrection
• d_atomCoords : dftfe::AtomCenteredSphericalFunctionContainer
• d_atomFractionalunwrapped : dftfe::molecularDynamicsClass
• d_atomicBasisData : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_atomicBasisPtr : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_atomicCoords : dftfe::hubbard< ValueType, memorySpace >
• d_atomicCoreDensityVector : dftfe::oncvClass< ValueType, memorySpace >
• d_atomicLocalPotVector : dftfe::oncvClass< ValueType, memorySpace >
• d_atomicNonLocalPseudoPotentialConstants : dftfe::oncvClass< ValueType, memorySpace >
• d_atomicNumbers : dftfe::AtomCenteredSphericalFunctionContainer, dftfe::dispersionCorrection
• d_atomicOrbitalFnsContainer : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >
• d_atomicOrbitalFnsMap : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >
• d_atomicProjectorFnsContainer : dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_atomicProjectorFnsMap : dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_atomicProjectorFnsVector : dftfe::oncvClass< ValueType, memorySpace >
• d_atomicRhoScalingFac : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomicValenceDensityVector : dftfe::oncvClass< ValueType, memorySpace >
• d_atomicWaveFnsVector : dftfe::oncvClass< ValueType, memorySpace >
• d_AtomIdBinIdLocalDofHandler : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_AtomIdBinIdLocalDofHandlerElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomIdBinIdMapLocalAllImages : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_atomIdPseudopotentialInterestToGlobalId : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_AtomIdsInCurrentProcess : dftfe::AtomCenteredSphericalFunctionContainer
• d_AtomIdsInElement : dftfe::AtomCenteredSphericalFunctionContainer
• d_atomIdToNonTrivialSphericalFnCellStartIndex : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_atomLocations : dftfe::oncvClass< ValueType, memorySpace >, dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_atomLocationsAutoMesh : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomLocationsInitial : dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_atomLocationsInterestPseudopotential : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomNodeIdToChargeMap : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomOrbitalMaxLength : dftfe::hubbard< ValueType, memorySpace >
• d_atomPositions : dftfe::triangulationManager
• d_atomsDisplacementsGaussianRead : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomsForceDofs : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomsForceDofsElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_atomsInBin : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_atomsPtr : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_atomStartIndexGlobal : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_atomSymbolsAndCoords : dftfe::GaussianBasis, dftfe::SlaterBasis
• d_atomToContractedGaussiansPtr : dftfe::GaussianBasis
• d_atomToSlaterPrimitivesPtr : dftfe::SlaterBasis
• d_atomTypeAtributes : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_atomTypeCoreFlagMap : dftfe::oncvClass< ValueType, memorySpace >
• d_atomTypes : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_atomTypesList : dftfe::oncvClass< ValueType, memorySpace >
• d_autoMesh : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_autoMeshMaxJacobianRatio : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_auxDensityMatrixXCInPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_auxDensityMatrixXCOutPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_AxCellLLevelNodalData : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_bandGroupLowHighPlusOneIndices : dftfe::hubbard< ValueType, memorySpace >
• d_barrierRequest : dftfe::utils::mpi::MPIRequestersNBX
• d_baseDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_basisGradValues : dftfe::AtomicBasisData
• d_basisLaplacianValues : dftfe::AtomicBasisData
• d_basisOperationsPtr : dftfe::kerkerSolverProblem< FEOrderElectro >, dftfe::KohnShamHamiltonianOperator< memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_basisOperationsPtrElectroHost : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_basisOperationsPtrHost : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_BasisOperatorHostPtr : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_BasisOperatorMemPtr : dftfe::hubbard< ValueType, memorySpace >
• d_basisOperatorPtr : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_basisValues : dftfe::AtomicBasisData
• d_basisWFCInnerProducts : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_bCellNonTrivialAtomIds : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_bCellNonTrivialAtomIdsBins : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_bCellNonTrivialAtomImageIds : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_bCellNonTrivialAtomImageIdsBins : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_beta : dftfe::cgPRPNonLinearSolver, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_bins : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_binsImages : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_binsStartDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_BLASWrapperHostPtr : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_BLASWrapperMemPtr : dftfe::hubbard< ValueType, memorySpace >
• d_BLASWrapperPtr : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::InterpolateFromCellToLocalPoints< memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_BLASWrapperPtrHost : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_blockedNDBCPtr : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_blockedXPtr : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_blockSize : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_boundaryFlag : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_boundaryFlagOnlyChargeId : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_bQuadAtomIdsAllAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_bQuadAtomIdsAllAtomsImages : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_bQuadValuesAllAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_c : dftfe::MixingScheme
• d_cellBlockSize : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_cellDofIndexToProcessDofIndexMap : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellFacesVselfBallSurfacesDofHandler : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellFacesVselfBallSurfacesDofHandlerElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellFacesVselfBallSurfacesDofHandlerForce : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellFacesVselfBallSurfacesDofHandlerForceElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellHamiltonianMatrix : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellHamiltonianMatrixExtPot : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellHamiltonianMatrixSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellIdToActiveCellIteratorMapDofHandlerRhoNodalElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellIdToAtomIdsLocalCompactSupportMap : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_cellIdToCellIndexMap : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellIndexToCellIdMap : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellIndexToCellIteratorMap : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseMassVectorBasisTypeSinglePrec : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseSqrtMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseSqrtMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseSqrtStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseSqrtStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellInverseStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellLevelParentNodalMemSpace : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_cellMassMatrixBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellMassMatrixCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellPointStartIndex : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_cellsBlockSize : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellsBlockSizeApply : dftfe::hubbard< ValueType, memorySpace >
• d_cellsBlockSizeHamiltonianConstruction : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellsBlockSizeHX : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellShapeFuncStartIndex : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_cellShapeFunctionGradientIntegral : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_cellShapeFunctionGradientIntegralFlattened : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_cellShapeFunctionJxW : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_cellSqrtMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellSqrtMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellSqrtStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellSqrtStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellStiffnessMatrixBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellStiffnessMatrixCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellStiffnessMatrixPtr : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_cellStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_cellsVselfBallsClosestAtomIdDofHandler : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellsVselfBallsClosestAtomIdDofHandlerElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellsVselfBallsDofHandler : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellsVselfBallsDofHandlerElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellsVselfBallsDofHandlerForce : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellsVselfBallsDofHandlerForceElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_cellWaveFunctionMatrixDst : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellWaveFunctionMatrixDstSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellWaveFunctionMatrixSrc : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cellWaveFunctionMatrixSrcSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_cFinal : dftfe::MixingScheme
• d_charspernum : dftfe::dftUtils::NodalData, dftfe::dftUtils::QuadDataCompositeWrite
• d_closestAtomBin : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_closestTriaVertexToAtomsLocation : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_CMatrixEntries : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_CMatrixEntriesConjugate : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_CMatrixEntriesTranspose : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_CMatrixGlobal : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_columnIdsGlobal : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_columnIdsLocal : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_columnValues : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_comm : dftfe::utils::mpi::MPIRequestersNBX
• d_commPrecision : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_commProtocol : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_computeSphericalFnTimesX : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_configForceVectorLinFE : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_configForceVectorLinFEElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_confiningPotential : dftfe::expConfiningPotential
• d_conjugateDirection : dftfe::cgPRPNonLinearSolver
• d_constraintInfo : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_constraintMatrixPRefinedPtr : dftfe::kerkerSolverProblem< FEOrderElectro >
• d_constraintMatrixPtr : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_constraintsForHelmholtzRhoNodal : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsForPhiPrimeElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsForTotalPotentialElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsInfo : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_constraintsMoveMesh : dftfe::meshMovementClass
• d_constraintsNoneForce : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsNoneForceElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsOnlyHangingInfo : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_constraintsPRefined : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsPRefinedOnlyHanging : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsRhoNodal : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsRhoNodalInfo : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsRhoNodalOnlyHanging : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsVector : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_constraintsVectorElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_contiguousRanges : dftfe::utils::OptimizedIndexSet< T >
• d_controlPointLocationsCurrentMove : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_coordinatesFileNEB : dftfe::nudgedElasticBandClass
• d_countrelaxationFlags : dftfe::nudgedElasticBandClass
• d_couplingMatrixEntries : dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_couplingMatrixEntriesSinglePrec : dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_cumulativeDofs : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_cutOff : dftfe::AtomCenteredSphericalFunctionBase
• d_cycle : dftfe::geometryOptimizationClass
• d_data : dftfe::utils::MemoryStorage< ValueType, memorySpace >
• d_DataPresent : dftfe::AtomCenteredSphericalFunctionBase
• d_dealiiFECellIter : dftfe::utils::FECell< dim >
• d_debugLevel : dftfe::nonLinearSolver
• d_deformationGradient : dftfe::meshMovementAffineTransform
• d_deltaGq : dftfe::LBFGSNonLinearSolver
• d_deltaMid : dftfe::cgPRPNonLinearSolver
• d_deltaNew : dftfe::cgPRPNonLinearSolver
• d_deltaOld : dftfe::cgPRPNonLinearSolver
• d_deltaX : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_deltaXNew : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_deltaXq : dftfe::LBFGSNonLinearSolver
• d_densityDescriptorAttributesList : dftfe::ExcSSDFunctionalBaseClass< memorySpace >
• d_densityDofHandlerIndex : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityFamilyType : dftfe::ExcSSDFunctionalBaseClass< memorySpace >
• d_densityInNodalValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityInQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityMatDerFermiEnergy : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityOutNodalValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityOutQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityQuadratureID : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_densityQuadratureId : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_densityQuadratureIdElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_densityResidualNodalValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityResidualQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityTotalInValuesLpspQuad : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityTotalOutValuesLpspQuad : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_densityValsSpinDownAllQuads : dftfe::AuxDensityMatrixFE< memorySpace >
• d_densityValsSpinUpAllQuads : dftfe::AuxDensityMatrixFE< memorySpace >
• d_densityValsTotalAllQuads : dftfe::AuxDensityMatrixFE< memorySpace >
• d_dftfeBasePtr : dftfe::dftfeWrapper
• d_dftfeParamsPtr : dftfe::dftfeWrapper
• d_dftfeScratchFolderName : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_dftfeWrapper : dftfe::geometryOptimizationClass, dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass
• d_dftParams : dftfe::chebyshevOrthogonalizedSubspaceIterationSolver, dftfe::dispersionCorrection, dftfe::energyCalculator< memorySpace >, dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::meshMovementClass, dftfe::triangulationManager, dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_dftParamsPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_dftPtr : dftfe::geometryOptimizationClass, dftfe::geoOptCell, dftfe::geoOptIon, dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass
• d_diagonalA : dftfe::kerkerSolverProblem< FEOrderElectro >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_diagonalSqrtA : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_dipole : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_dispClosestTriaVerticesToAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_dispersionCorr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_DM : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_dofClosestChargeLocationMap : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_dofHandler : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_dofHandlerForce : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_dofHandlerForceElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_dofHandlerID : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_dofHandlerMoveMesh : dftfe::meshMovementClass
• d_dofHandlerPRefined : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_dofHandlerPRefinedPtr : dftfe::kerkerSolverProblem< FEOrderElectro >
• d_dofHandlerRhoNodal : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_domainBoundaries : dftfe::hubbard< ValueType, memorySpace >
• d_domainBoundingVectors : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::meshMovementClass, dftfe::triangulationManager
• d_domainLength : dftfe::molecularDynamicsClass
• d_domainVectorsFileNEB : dftfe::nudgedElasticBandClass
• d_domainVolume : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_domainVolumeInitial : dftfe::geoOptCell
• d_dotProductAtomicWaveInputWaveTemp : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_dstNonLocalTemp : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_dstNonLocalTempSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_eigenDofHandlerIndex : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_eigenVectorsDensityMatrixPrimeHost : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_eigenVectorsFlattenedHost : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_eigenVectorsFlattenedMemSpacePtr : dftfe::AuxDensityMatrixFE< memorySpace >
• d_elementIdsInAtomCompactSupport : dftfe::AtomCenteredSphericalFunctionContainer
• d_elementIndexesInAtomCompactSupport : dftfe::AtomCenteredSphericalFunctionContainer
• d_elementOneFieldIteratorsInAtomCompactSupport : dftfe::AtomCenteredSphericalFunctionContainer
• d_elpaAutoTuneHandle : dftfe::elpaScalaManager
• d_elpaHandle : dftfe::elpaScalaManager
• d_elpaHandlePartialEigenVec : dftfe::elpaScalaManager
• d_elpaScala : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_energyDispersion : dftfe::dispersionCorrection
• d_entropicEnergy : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_eta : dftfe::cgPRPNonLinearSolver
• d_etaAlphaZeroChk : dftfe::cgPRPNonLinearSolver
• d_etaChk : dftfe::cgPRPNonLinearSolver
• d_etaPChk : dftfe::cgPRPNonLinearSolver
• d_ExcFamilyType : dftfe::ExcSSDFunctionalBaseClass< memorySpace >
• d_excManagerPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_excObj : dftfe::excManager< memorySpace >
• d_excSSDObjPtr : dftfe::ExcDFTPlusU< ValueType, memorySpace >
• d_expConfiningPot : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_expectationOfHubbardPotential : dftfe::hubbard< ValueType, memorySpace >
• d_externalForceOnAtom : dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_extrapDensity_t0 : dftfe::molecularDynamicsClass
• d_extrapDensity_tmin1 : dftfe::molecularDynamicsClass
• d_extrapDensity_tmin2 : dftfe::molecularDynamicsClass
• d_extrapDensity_tp1 : dftfe::molecularDynamicsClass
• d_feCell : dftfe::utils::FECell< dim >
• d_FEOrder : dftfe::triangulationManager
• d_feOrderPlusOneQuadratureID : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_feOrderPlusOneQuadratureId : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_flattenedCellDofIndexToProcessDofIndexMap : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_flattenedLocalGhostIndices : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_flattenedLocalTargetIndices : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_flattenedNonLocalCellDofIndexToProcessDofIndexMap : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_flattenedNonLocalCellDofIndexToProcessDofIndexVector : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_flatTopWidthsAutoMeshMove : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_floatingNuclearCharges : dftfe::oncvClass< ValueType, memorySpace >
• d_forceAtomsFloating : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_forceDispersion : dftfe::dispersionCorrection
• d_forceDofHandlerIndex : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_forceDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_fracOccupancy : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_fractionalOccupancies : dftfe::AuxDensityMatrixFE< memorySpace >
• d_freeEnergy : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_freeEnergyInitial : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_funcCPtr : dftfe::excDensityGGAClass< memorySpace >, dftfe::excDensityLDAClass< memorySpace >, dftfe::excDensityLLMGGAClass< memorySpace >, dftfe::excManager< memorySpace >
• d_functionalValueAfterAlphUpdateChk : dftfe::cgPRPNonLinearSolver
• d_functionValueChk : dftfe::cgPRPNonLinearSolver
• d_funcXPtr : dftfe::excDensityGGAClass< memorySpace >, dftfe::excDensityLDAClass< memorySpace >, dftfe::excDensityLLMGGAClass< memorySpace >, dftfe::excManager< memorySpace >
• d_fValues : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_fvcontainerVals : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_fvSpin0containerVals : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_fvSpin1containerVals : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gamma : dftfe::kerkerSolverProblem< FEOrderElectro >
• d_gaussianBasisInfo : dftfe::GaussianBasis
• d_gaussianConstantsAutoMesh : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gaussianConstantsForce : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gaussianMovementAtomsNetDisplacements : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gaussianMovePar : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gaussianWeightsVecAtoms : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_generatorFlatTopWidths : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_geoOptCellPtr : dftfe::geometryOptimizationClass
• d_geoOptIonPtr : dftfe::geometryOptimizationClass
• d_ghostAtomCenteredFnIdsCurrentProcess : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_ghostDataCopySinglePrec : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_ghostGlobalIds : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_ghostIndices : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_ghostIndicesOptimizedIndexSet : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_ghostIndicesSetSTL : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_ghostProcIds : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_ghostSize : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >, dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_ghostSphericalFunctionIdsCurrentProcess : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_gllQuadratureId : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_globalAtomsForces : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_globalChargeIdToImageIdMap : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_globalChargeIdToImageIdMapTrunc : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_globalSize : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >
• d_globalTimer : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradbQuadValuesAllAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradDensityInQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradDensityOutQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradDensityResidualQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradDensityTotalInValuesLpspQuad : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradDensityTotalOutValuesLpspQuad : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradDensityValsSpinDownAllQuads : dftfe::AuxDensityMatrixFE< memorySpace >
• d_gradDensityValsSpinUpAllQuads : dftfe::AuxDensityMatrixFE< memorySpace >
• d_gradient : dftfe::BFGSNonLinearSolver, dftfe::cgPRPNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_gradientNew : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_gradMax : dftfe::cgPRPNonLinearSolver
• d_gradPhiInQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradPhiOutQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradPhiResQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradRhoAtomsValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradRhoAtomsValuesSeparate : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradRhoCore : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_gradRhoCoreAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_groundStateDensityHistory : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_groundStateEnergy : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_HamiltonianCouplingMatrixEntriesUpdated : dftfe::oncvClass< ValueType, memorySpace >
• d_HamiltonianCouplingMatrixSinglePrecEntriesUpdated : dftfe::oncvClass< ValueType, memorySpace >
• d_HamiltonianIndex : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_helmholtzDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_hessian : dftfe::BFGSNonLinearSolver
• d_hessianRhoAtomsValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_hessianRhoAtomsValuesSeparate : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_hessianRhoCore : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_hessianRhoCoreAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_hessianScaled : dftfe::BFGSNonLinearSolver
• d_highestStateForResidualComputation : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_hubbardClassPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::ExcDFTPlusU< ValueType, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_hubbardEnergy : dftfe::hubbard< ValueType, memorySpace >
• d_hubbardSpeciesData : dftfe::hubbard< ValueType, memorySpace >
• d_hubbNonLocalProjectorTimesVectorBlock : dftfe::hubbard< ValueType, memorySpace >
• d_hubbNonLocalProjectorTimesVectorBlockSinglePrec : dftfe::hubbard< ValueType, memorySpace >
• d_hubbOccMatAfterMixing : dftfe::hubbard< ValueType, memorySpace >
• d_iElemNonLocalToElemIndexMap : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_imageAtomPositions : dftfe::triangulationManager
• d_imageCharges : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_imageChargesTrunc : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_ImageError : dftfe::nudgedElasticBandClass
• d_imageFreeze : dftfe::nudgedElasticBandClass
• d_imageIds : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >, dftfe::triangulationManager
• d_imageIdsTrunc : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_imagePositions : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_imagePositionsAutoMesh : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_imagePositionsTrunc : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_inc : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_incrementalDisplacement : dftfe::meshMovementClass
• d_inhomogenities : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_initialAtomicSpin : dftfe::hubbard< ValueType, memorySpace >
• d_interpolateLocalObj : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_inverseJacobianBasisData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseJacobianData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseMassVectorBasisTypeSinglePrec : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseSqrtMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseSqrtMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseSqrtStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseSqrtStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_inverseStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_invJacderExcWithSigmaTimesGradRhoJxW : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_invJacKPointTimesJxW : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_ionRelaxFlagsFile : dftfe::nudgedElasticBandClass
• d_isAtomsGaussianDisplacementsReadFromFile : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_isCGRestartDueToLargeIncrement : dftfe::cgPRPNonLinearSolver
• d_isComputeDiagonalA : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_isCurvatureOnlyLineSearchStoppingCondition : dftfe::BFGSNonLinearSolver, dftfe::cgPRPNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_isDeviceToMPITaskBindingSetInternally : dftfe::dftfeWrapper
• d_isExternalPotCorrHamiltonianComputed : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_isFastConstraintsInitialized : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_isFirstFilteringCall : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_isGradSmearedChargeRhs : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_isMallocCalled : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_isMeanValueConstraintComputed : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_isParallelMesh : dftfe::meshMovementClass
• d_iSpin : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_isReset : dftfe::BFGSNonLinearSolver
• d_isRestart : dftfe::geometryOptimizationClass, dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_isRestartGroundStateCalcFromChk : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_isReuseSmearedChargeRhs : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_isScfRestart : dftfe::geoOptCell, dftfe::geoOptIon
• d_isStoreSmearedChargeRhs : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_iter : dftfe::BFGSNonLinearSolver, dftfe::cgPRPNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_JxWBasisData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_JxWData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_kmax : dftfe::nudgedElasticBandClass
• d_kmin : dftfe::nudgedElasticBandClass
• d_kohnShamDFTOperatorPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_kohnShamDFTOperatorsInitialized : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_kPointCoordinates : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_kPointIndex : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_kPointWeights : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_latticeVectors : dftfe::dispersionCorrection
• d_Length : dftfe::nudgedElasticBandClass
• d_lineSearchDampingParameter : dftfe::cgPRPNonLinearSolver
• d_lineSearchMaxIterations : dftfe::cgPRPNonLinearSolver
• d_lineSearchRestartIterChk : dftfe::cgPRPNonLinearSolver
• d_lineSearchTolerance : dftfe::cgPRPNonLinearSolver
• d_listOfiAtomInSpecies : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_localContributionQuadratureId : dftfe::oncvClass< ValueType, memorySpace >
• d_localGhostIndicesRanges : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_localIndexMapUnflattenedToFlattened : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_locally_owned_dofs : dftfe::meshMovementClass
• d_locally_owned_dofsForce : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_locally_owned_dofsForceElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_locally_relevant_dofs : dftfe::meshMovementClass
• d_locally_relevant_dofsForce : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_locally_relevant_dofsForceElectro : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_locallyOwnedAtomCenteredFnIdsCurrentProcess : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_locallyOwnedCells : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_locallyOwnedRange : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_locallyOwnedSize : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_locallyOwnedSphericalFunctionIdsCurrentProcess : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_locallyRelevantDofsPRefined : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_locallyRelevantDofsRhoNodal : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_localRange : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_localSize : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >
• d_localVselfs : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_lowerBoundUnWantedSpectrum : dftfe::chebyshevOrthogonalizedSubspaceIterationSolver
• d_lowerBoundWantedSpectrum : dftfe::chebyshevOrthogonalizedSubspaceIterationSolver
• d_lowerLeft : dftfe::utils::Cell< dim >, dftfe::utils::FECell< dim >
• d_lpspQuadratureID : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_lpspQuadratureId : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_lpspQuadratureIdElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_lQuantumNumber : dftfe::AtomCenteredSphericalFunctionBase, dftfe::AtomPseudoWavefunctions
• d_magInNodalValuesRead : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_mapAtomIdToSpeciesIndex : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_mapAtomToAtomicNumber : dftfe::hubbard< ValueType, memorySpace >
• d_mapAtomToHubbardIds : dftfe::hubbard< ValueType, memorySpace >
• d_mapCellLocalToProcLocal : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_mapHubbardAtomToGlobalAtomId : dftfe::hubbard< ValueType, memorySpace >
• d_mapIAtomicNumToDotProd : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_mapiAtomToDotProd : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_mapiAtomToSpeciesIndex : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_mapiAtomTosphFuncWaveStart : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_mapNodeIdToProcId : dftfe::KohnShamHamiltonianOperator< memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_mappingQ1 : dftfe::utils::FECell< dim >
• d_mapPoints : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_mapPointToProcLocalMemSpace : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_mapQuadIdToProcId : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_massVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_massVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_matrixFreeDataPRefined : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_matrixFreeDataPRefinedPtr : dftfe::kerkerSolverProblem< FEOrderElectro >
• d_matrixFreeDataPtr : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_matrixFreeMesh1Ptr : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_matrixFreeMesh1QuadratureComponent : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_matrixFreeMesh1VectorComponent : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_matrixFreeMesh2Ptr : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_matrixFreeMesh2QuadratureComponent : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_matrixFreeMesh2VectorComponent : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_matrixFreeQuadratureComponent : dftfe::kerkerSolverProblem< FEOrderElectro >
• d_matrixFreeQuadratureComponentAX : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_matrixFreeQuadratureComponentRhs : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_matrixFreeQuadratureComponentRhsDensity : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_matrixFreeVectorComponent : dftfe::kerkerSolverProblem< FEOrderElectro >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_max_refinement_steps : dftfe::triangulationManager
• d_maxDerOrder : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_maximumAtomForceToBeRelaxed : dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_maximumNEBIteration : dftfe::nudgedElasticBandClass
• d_maxNumberIterations : dftfe::nonLinearSolver
• d_maxNumPastSteps : dftfe::LBFGSNonLinearSolver
• d_maxOccMatSizePerAtom : dftfe::hubbard< ValueType, memorySpace >
• d_maxSingleAtomContribution : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_maxSolutionIncrementLinf : dftfe::cgPRPNonLinearSolver
• d_maxStepLength : dftfe::LBFGSNonLinearSolver
• d_MaxWallTime : dftfe::molecularDynamicsClass
• d_MDstartWallTime : dftfe::molecularDynamicsClass
• d_meanValueConstraintNodeId : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_meanValueConstraintProcId : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_meanValueConstraintVec : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_memOpt : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_memoryOptMode : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_mesh : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_mesh1toMesh2 : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_mesh2toMesh1 : dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >
• d_meshSizes : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::triangulationManager
• d_minDist : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_mixingHistory : dftfe::MixingScheme
• d_mixingParameter : dftfe::MixingScheme
• d_mixingScheme : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_monopole : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_mpi_comm_domain : dftfe::hubbard< ValueType, memorySpace >, dftfe::MixingScheme
• d_mpi_comm_interBand : dftfe::hubbard< ValueType, memorySpace >
• d_mpi_comm_interPool : dftfe::hubbard< ValueType, memorySpace >
• d_mpi_comm_parent : dftfe::dftfeWrapper, dftfe::hubbard< ValueType, memorySpace >, dftfe::MixingScheme
• d_mpi_communicator : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::elpaScalaManager
• d_mpi_parent : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_mpiComm : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >, dftfe::TransferDataBetweenMeshesIncompatiblePartitioning< memorySpace >, dftfe::utils::MapPointsToCells< dim, M >, dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_mpiCommDomain : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_mpiCommP2PPtr : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_mpiCommParent : dftfe::chebyshevOrthogonalizedSubspaceIterationSolver, dftfe::dealiiLinearSolver, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::energyCalculator< memorySpace >, dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::geometryOptimizationClass, dftfe::kerkerSolverProblem< FEOrderElectro >, dftfe::KohnShamHamiltonianOperator< memorySpace >, dftfe::meshMovementClass, dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass, dftfe::oncvClass< ValueType, memorySpace >, dftfe::symmetryClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::triangulationManager, dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_mpiCommParentPostProcessing : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >
• d_mpiCommPtrMemSpace : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_mpiCommunicator : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_mpiCommunicatorP2P : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >
• d_mpiInterCommKpts : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_mpiP2PPtrMemSpace : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_mpiPatternP2P : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >, dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_mpiPatternP2PPtr : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_myRank : dftfe::utils::mpi::MPIPatternP2P< memorySpace >, dftfe::utils::mpi::MPIRequestersNBX
• d_n_mpi_processes : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_natoms : dftfe::dispersionCorrection
• d_nBasis : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_nCells : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_nDofsPerCell : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_nearestAtomDistances : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::triangulationManager
• d_nearestAtomIds : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_NEBImageno : dftfe::nudgedElasticBandClass
• d_negScalarCoeffAlpha : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_netFloatingDispSinceLastBinsUpdate : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_netFloatingDispSinceLastCheckForSmearedChargeOverlaps : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_nGlobalIndices : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_nlPSPCutOff : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_nlpspQuadratureId : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_NNGGAPtr : dftfe::excDensityGGAClass< memorySpace >
• d_NNLDAPtr : dftfe::excDensityLDAClass< memorySpace >
• d_NNLLMGGAPtr : dftfe::excDensityLLMGGAClass< memorySpace >
• d_noConstraints : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_noHistory : dftfe::LBFGSNonLinearSolver
• d_nOMPThreads : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_nonAtomicWaveFunctions : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_nonLinearSolverPtr : dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_nonlocalElemIdToCellIdVector : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_nonLocalOperator : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_nonLocalOperatorSinglePrec : dftfe::hubbard< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_nonLocalPseudoPotentialConstants : dftfe::oncvClass< ValueType, memorySpace >
• d_nonPeriodicDensityDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_nonTrivialAllCellsSphericalFnAlphaToElemIdMap : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_nonTrivialSphericalFnPerCell : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_nonTrivialSphericalFnsCellStartIndex : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_noOfSpin : dftfe::hubbard< ValueType, memorySpace >
• d_NormalizationConstant : dftfe::AtomCenteredSphericalFunctionBessel, dftfe::AtomCenteredSphericalFunctionGaussian, dftfe::AtomCenteredSphericalFunctionSinc
• d_normDeltaXnew : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_noSpecies : dftfe::hubbard< ValueType, memorySpace >
• d_nprocs : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_nQuad : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_nQuadsPerCell : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_nQuantumNumber : dftfe::AtomPseudoWavefunctions
• d_nSpin : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_nuclearChargeQuadratureIdElectro : dftfe::oncvClass< ValueType, memorySpace >
• d_numberCellsAccumNonLocalAtoms : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_numberCellsForEachAtom : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_numberDofsPerElement : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_numberGlobalCharges : dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass
• d_numberNodesPerElement : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_numberOfImages : dftfe::nudgedElasticBandClass
• d_numberofSteps : dftfe::molecularDynamicsClass
• d_numberUnknowns : dftfe::BFGSNonLinearSolver, dftfe::cgPRPNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_numberWaveFunctions : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::hubbard< ValueType, memorySpace >
• d_numCells : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_numContiguousRanges : dftfe::utils::OptimizedIndexSet< T >
• d_numDofsPerElement : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_numEigenValues : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_numEntriesBefore : dftfe::utils::OptimizedIndexSet< T >
• d_numGhostIndices : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_numGhostIndicesInGhostProcs : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_numGhostProcs : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_numKPoints : dftfe::hubbard< ValueType, memorySpace >
• d_numLocallyOwnedIndices : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_numLocalPtsSze : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_numMPIRank : dftfe::utils::MapPointsToCells< dim, M >
• d_numNodes : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_numOwnedIndicesForTargetProcs : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_numPastSteps : dftfe::LBFGSNonLinearSolver
• d_numPoints : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_numPointsInCell : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_numPointsLocal : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_numProcessors : dftfe::utils::mpi::MPIRequestersNBX
• d_numRadialSphericalFunctions : dftfe::AtomCenteredSphericalFunctionContainer
• d_numSphericalFunctions : dftfe::AtomCenteredSphericalFunctionContainer
• d_numSpins : dftfe::hubbard< ValueType, memorySpace >
• d_numTargetProcs : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_numTotalOccMatrixEntriesPerSpin : dftfe::hubbard< ValueType, memorySpace >
• d_numVectors : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >
• d_numVectorsInternal : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_nVectors : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_nWFC : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_OccMatrixEntryStartForAtom : dftfe::hubbard< ValueType, memorySpace >
• d_occupationMatrix : dftfe::hubbard< ValueType, memorySpace >
• d_offsetLocation : dftfe::AtomCenteredSphericalFunctionContainer
• d_oncvClassPtr : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_ONCVnonLocalOperator : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_ONCVnonLocalOperatorSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_ONCVNonLocalProjectorTimesVectorBlock : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_ONCVNonLocalProjectorTimesVectorBlockSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_optimizationSolver : dftfe::nudgedElasticBandClass
• d_optimizermaxIonUpdateStep : dftfe::nudgedElasticBandClass
• d_optimizertolerance : dftfe::nudgedElasticBandClass
• d_optMode : dftfe::geometryOptimizationClass
• d_OwnedAtomIdsInCurrentProcessor : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_parallelTriaCurrentRefinement : dftfe::triangulationManager
• d_parallelTriangulationMoved : dftfe::triangulationManager
• d_parallelTriangulationUnmoved : dftfe::triangulationManager
• d_paramCoordinates : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_partialOccupancies : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_performMixing : dftfe::MixingScheme
• d_performMPIReduce : dftfe::MixingScheme
• d_periodicImageCoord : dftfe::AtomCenteredSphericalFunctionContainer
• d_periodicImagesCoords : dftfe::hubbard< ValueType, memorySpace >
• d_periodicity_vector : dftfe::meshMovementClass
• d_phiExt : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiExtDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiInQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiOutQuadValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiPrime : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiPrimeDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiPrimeSolverProblem : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiTotalSolverProblem : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiTotAXQuadratureIdElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiTotDofHandlerIndexElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiTotRhoIn : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_phiTotRhoOut : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_pointsFoundInProc : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_preconditioner : dftfe::LBFGSNonLinearSolver
• d_preCondTotalDensityResidualVector : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_processGridCommunicatorActive : dftfe::elpaScalaManager
• d_processGridCommunicatorActivePartial : dftfe::elpaScalaManager
• d_processGridDftfeWrapper : dftfe::elpaScalaManager
• d_procLocalAtomId : dftfe::hubbard< ValueType, memorySpace >
• d_pseudoVLoc : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_pseudoVLocAtoms : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_pspCutOff : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_pspCutOffTrunc : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_quadPoints : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_quadPointsAll : dftfe::AuxDensityMatrixFE< memorySpace >
• d_quadratureID : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_quadratureIDsVector : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_quadratureIndex : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_quadrupole : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_quadWeightsAll : dftfe::AuxDensityMatrixFE< memorySpace >
• d_radialSplineObject : dftfe::AtomCenteredSphericalFunctionSpline, dftfe::AtomPseudoWavefunctions
• d_rankCurrentLRD : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_Rc : dftfe::AtomCenteredSphericalFunctionBessel, dftfe::AtomCenteredSphericalFunctionGaussian, dftfe::AtomCenteredSphericalFunctionSinc
• d_reciprocalLatticeVectors : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_recvBuffers : dftfe::utils::mpi::MPIRequestersNBX
• d_recvRequests : dftfe::utils::mpi::MPIRequestersNBX
• d_relativeErrorJacInvApproxPrevScfLRD : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_relaxationFlags : dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_reproducible_output : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_requestingProcesses : dftfe::utils::mpi::MPIRequestersNBX
• d_requestsAccumulateAddLocallyOwned : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_requestsAccumulateInsertLocallyOwned : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_requestsUpdateGhostValues : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_residualNormPredicted : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_residualPredicted : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_residualQuadValuesPtr : dftfe::kerkerSolverProblem< FEOrderElectro >
• d_restartFilesPath : dftfe::geometryOptimizationClass, dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass
• d_restartFlag : dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass
• d_restartPath : dftfe::geoOptCell, dftfe::geoOptIon
• d_rhoAtomsValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoAtomsValuesSeparate : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoCore : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoInNodalValuesRead : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoNodalFieldRefined : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoOutNodalValuesDistributed : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoOutNodalValuesSplit : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_rhoq : dftfe::LBFGSNonLinearSolver
• d_rhoValuesPtr : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_rhsQuadDataPtr : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_rhsSmearedCharge : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_rhsVec : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_rMin : dftfe::AtomCenteredSphericalFunctionSpline, dftfe::AtomCenteredSphericalFunctionZOverR, dftfe::AtomPseudoWavefunctions
• d_rMinVal : dftfe::AtomCenteredSphericalFunctionBessel, dftfe::AtomCenteredSphericalFunctionGaussian, dftfe::AtomCenteredSphericalFunctionSinc
• d_rowIdsGlobal : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_rowIdsLocal : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_rowSizes : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• d_rTol : dftfe::GaussianBasis, dftfe::SlaterBasis
• d_rtree : dftfe::utils::RTreeBox< dim, M >
• d_rtreePtr : dftfe::utils::RTreePoint< dim, M >
• d_scalapackBlockSize : dftfe::elpaScalaManager
• d_scalarCoeffAlpha : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_scratchFolderName : dftfe::dftfeWrapper
• d_sendBuffers : dftfe::utils::mpi::MPIRequestersNBX
• d_sendRecvBuffer : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_sendRecvBufferSinglePrec : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_sendRequests : dftfe::utils::mpi::MPIRequestersNBX
• d_serialTriaCurrentRefinement : dftfe::triangulationManager
• d_serialTriangulationUnmoved : dftfe::triangulationManager
• d_setOfAtomicNumber : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_shapeFunctionBasisData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionBasisDataTranspose : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionDataTranspose : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionGradientBasisData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionGradientBasisDataTranspose : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionGradientData : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionGradientDataInternalLayout : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionGradientDataTranspose : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_shapeFunctionValue : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_shapeValuesHost : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_shapeValuesMemSpace : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_singlePrecNonLocalOperator : dftfe::oncvClass< ValueType, memorySpace >
• d_size : dftfe::utils::MemoryStorage< ValueType, memorySpace >
• d_slaterBasisInfo : dftfe::SlaterBasis
• d_SMatrix : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_SMatrixInv : dftfe::AuxDensityMatrixAtomicBasis< memorySpace >
• d_smearedChargeGradientComponentId : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_smearedChargeMoments : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_smearedChargeMomentsComputed : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_smearedChargeQuadratureId : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_smearedChargeQuadratureIdElectro : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_smearedChargeScaling : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_smearedChargeValuesPtr : dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_smearedChargeWidthMin : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_smearedChargeWidths : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_solver : dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_solverRestart : dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_solverRestartPath : dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_spacingFDStencil : dftfe::excDensityGGAClass< memorySpace >, dftfe::excDensityLLMGGAClass< memorySpace >
• d_sparsityPattern : dftfe::AtomCenteredSphericalFunctionContainer
• d_sparsityPatternQuadratureId : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_sphericalFnTimesVectorFlattenedVectorLocalIds : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_sphericalFnTimesWavefunMatrix : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_sphericalFunctionIdsNumberingMapCurrentProcess : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_SphericalFunctionKetTimesVectorPar : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_sphericalFunctionsContainer : dftfe::AtomCenteredSphericalFunctionContainer
• d_spinIndex : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_spinPolarizedFactor : dftfe::hubbard< ValueType, memorySpace >
• d_sqrtMassVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_sqrtMassVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_sqrtStiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_sqrtStiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_srcCell : dftfe::InterpolateFromCellToLocalPoints< memorySpace >
• d_srcNonLocalTemp : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_srcNonLocalTempSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_Srfo : dftfe::BFGSNonLinearSolver
• d_startingTemperature : dftfe::molecularDynamicsClass
• d_startingTimeStep : dftfe::molecularDynamicsClass
• d_startStep : dftfe::nudgedElasticBandClass
• d_status : dftfe::geometryOptimizationClass
• d_steepestDirectionOld : dftfe::cgPRPNonLinearSolver
• d_stepAccepted : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_stiffnessVectorBasisType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_stiffnessVectorCoeffType : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_storage : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >
• d_storedAdaptiveBallRadius : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_strainEpsilon : dftfe::geoOptCell
• d_stress : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_stressDispersion : dftfe::dispersionCorrection
• d_stressKPoints : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• d_subspaceIterationSolver : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_sumNonTrivialSphericalFnOverAllCells : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_supportPoints : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_supportPointsEigen : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_supportPointsPRefined : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_targetIDs : dftfe::utils::mpi::MPIRequestersNBX
• d_targetProcIds : dftfe::utils::mpi::MPIPatternP2P< memorySpace >
• d_tempBlockVectorOverlapInvX : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_tempBlockVectorOverlapInvXSinglePrec : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_tempDoubleImagArrayForAtomics : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_tempDoubleRealArrayForAtomics : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_tempEigenVec : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_tempFloatImagArrayForAtomics : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_tempFloatRealArrayForAtomics : dftfe::utils::mpi::MPICommunicatorP2P< ValueType, memorySpace >
• d_tempOutputMemSpace : dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >
• d_ThermostatTimeConstant : dftfe::molecularDynamicsClass
• d_ThermostatType : dftfe::molecularDynamicsClass
• d_this_mpi_process : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >, dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass, dftfe::oncvClass< ValueType, memorySpace >
• d_thisRank : dftfe::utils::MapPointsToCells< dim, M >
• d_TimeIndex : dftfe::molecularDynamicsClass
• d_TimeStep : dftfe::molecularDynamicsClass
• d_tolerance : dftfe::nonLinearSolver
• d_tolReached : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_totalAtomsInCurrentProc : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_totalLocallyOwnedNodes : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_totalNonlocalElems : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_totalNonLocalEntries : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_totalNumHubbAtoms : dftfe::hubbard< ValueType, memorySpace >
• d_totalNumSphericalFunctionsGlobal : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_totalSphericalFunctionIndexStart : dftfe::AtomCenteredSphericalFunctionContainer
• d_totalUpdateCalls : dftfe::geoOptCell, dftfe::geoOptIon, dftfe::nudgedElasticBandClass
• d_transA : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_transB : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_triaPtr : dftfe::meshMovementClass
• d_triaPtrSerial : dftfe::meshMovementClass
• d_trustRadius : dftfe::BFGSNonLinearSolver
• d_trustRadiusInitial : dftfe::BFGSNonLinearSolver
• d_trustRadiusMax : dftfe::BFGSNonLinearSolver
• d_trustRadiusMin : dftfe::BFGSNonLinearSolver
• d_type : dftfe::dealiiLinearSolver
• d_unknownCountFlag : dftfe::cgPRPNonLinearSolver
• d_updateFlags : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >
• d_updateVector : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_upperBoundUnWantedSpectrum : dftfe::chebyshevOrthogonalizedSubspaceIterationSolver
• d_upperBoundUnwantedSpectrumValues : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_upperRight : dftfe::utils::Cell< dim >, dftfe::utils::FECell< dim >
• d_useDevice : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::oncvClass< ValueType, memorySpace >
• d_useGlobalCMatrix : dftfe::AtomicCenteredNonLocalOperator< ValueType, memorySpace >
• d_useHubbard : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_usePreconditioner : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_useRFOStep : dftfe::BFGSNonLinearSolver
• d_useSingleAtomSolutionsInitialGuess : dftfe::BFGSNonLinearSolver, dftfe::cgPRPNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_useSinglePrec : dftfe::hubbard< ValueType, memorySpace >
• d_vals : dftfe::dftUtils::NodalData, dftfe::dftUtils::QuadDataCompositeWrite
• d_value : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_valueNew : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_variableHistoryIn : dftfe::MixingScheme
• d_variableHistoryResidual : dftfe::MixingScheme
• d_vcontainerVals : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_vectorDotProductWeights : dftfe::MixingScheme
• d_VeffExtPotJxW : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_VeffJxW : dftfe::KohnShamHamiltonianOperator< memorySpace >
• d_verbosity : dftfe::atomCenteredOrbitalsPostProcessing< ValueType, memorySpace >, dftfe::geometryOptimizationClass, dftfe::hubbard< ValueType, memorySpace >, dftfe::InterpolateCellWiseDataToPoints< T, memorySpace >, dftfe::MixingScheme, dftfe::molecularDynamicsClass, dftfe::nudgedElasticBandClass, dftfe::oncvClass< ValueType, memorySpace >, dftfe::utils::MapPointsToCells< dim, M >
• d_vselfBinConstraintMatrices : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_vselfBinField : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_vselfBinsManager : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_vselfFieldBins : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_vselfFieldDerRBins : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_vselfFieldGateauxDerStrainFDBins : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_vselfFieldPerturbedBins : dftfe::vselfBinsManager< FEOrder, FEOrderElectro >
• d_vSpin0containerVals : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_vSpin1containerVals : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_vxcDivergenceTermFDStencilSize : dftfe::excDensityGGAClass< memorySpace >, dftfe::excDensityLLMGGAClass< memorySpace >
• d_wfcInitTruncation : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• d_wolfeCurvature : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_wolfeSatisfied : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_wolfeSufficientDec : dftfe::BFGSNonLinearSolver, dftfe::LBFGSNonLinearSolver
• d_xCellLLevelNodalData : dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >
• d_xPtr : dftfe::kerkerSolverProblem< FEOrderElectro >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• d_Zval : dftfe::AtomCenteredSphericalFunctionZOverR
• data() : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >, dftfe::utils::MemoryStorage< ValueType, memorySpace >
• dc_d3ATM : dftfe::dftParameters
• dc_d3cutoff2 : dftfe::dftParameters
• dc_d3cutoff3 : dftfe::dftParameters
• dc_d3cutoffCN : dftfe::dftParameters
• dc_d3dampingtype : dftfe::dftParameters
• dc_d4MBD : dftfe::dftParameters
• dc_dampingParameterFilename : dftfe::dftParameters
• dc_dispersioncorrectiontype : dftfe::dftParameters
• dealIICellId : dftfe::symmetryClass< FEOrder, FEOrderElectro, memorySpace >
• DealiiFECellIterator : dftfe::utils::FECell< dim >
• dealiiLinearSolver() : dftfe::dealiiLinearSolver
• dealiiLinearSolverProblem() : dftfe::dealiiLinearSolverProblem
• deallocate() : dftfe::utils::MemoryManager< ValueType, memorySpace >, dftfe::utils::MemoryManager< ValueType, MemorySpace::HOST >
• deformCell() : dftfe::dftfeWrapper
• deformDomain() : dftfe::dftBase, dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• DensityExtrapolation() : dftfe::molecularDynamicsClass
• DensitySplitExtrapolation() : dftfe::molecularDynamicsClass
• descriptor : dftfe::ScaLAPACKMatrix< NumberType >
• determineAtomsOfInterstPseudopotential() : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• determineOrbitalFilling() : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• deviceFineGrainedTimings : dftfe::dftParameters
• dftClass() : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• dftClass< FEOrder, FEOrderElectro, memorySpace > : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::symmetryClass< FEOrder, FEOrderElectro, memorySpace >
• dftfe::ScaLAPACKMatrix : dftfe::ProcessGrid
• dftfeWrapper() : dftfe::dftfeWrapper
• dftParameters() : dftfe::dftParameters
• dftPtr : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >, dftfe::symmetryClass< FEOrder, FEOrderElectro, memorySpace >
• diracDeltaKernelScalingConstant : dftfe::dftParameters
• dispersionCorrection() : dftfe::dispersionCorrection
• distribute() : dftfe::basis::FEBasisOperations< ValueTypeBasisCoeff, ValueTypeBasisData, memorySpace >, dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• distribute_slave_to_master() : dftfe::dftUtils::constraintMatrixInfo< memorySpace >
• distributeForceContributionFnlGammaAtoms() : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• distributeForceContributionFPSPLocalGammaAtoms() : dftfe::forceClass< FEOrder, FEOrderElectro, memorySpace >
• distributeX() : dftfe::dealiiLinearSolverProblem, dftfe::kerkerSolverProblem< FEOrderElectro >, dftfe::MultiVectorLinearSolverProblem< memorySpace >, dftfe::MultiVectorPoissonLinearSolverProblem< memorySpace >, dftfe::poissonSolverProblem< FEOrder, FEOrderElectro >
• dofHandler : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• dofHandlerEigen : dftfe::dftClass< FEOrder, FEOrderElectro, memorySpace >
• domainBoundingVectorsFile : dftfe::dftParameters
• domainVectorsFileNEB : dftfe::runParameters
• dot() : dftfe::linearAlgebra::MultiVector< ValueType, memorySpace >
• dvec : dftfe::dealiiLinearSolver