DFT-FE 1.1.0-pre
Density Functional Theory With Finite-Elements
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Class Index
A | B | C | D | E | F | G | H | I | K | L | M | N | O | P | Q | R | S | T | V
A
atomCenteredOrbitalsPostProcessing (dftfe)
AtomCenteredPseudoWavefunctionSpline (dftfe)
AtomCenteredSphericalFunctionBase (dftfe)
AtomCenteredSphericalFunctionBessel (dftfe)
AtomCenteredSphericalFunctionContainer (dftfe)
AtomCenteredSphericalFunctionCoreDensitySpline (dftfe)
AtomCenteredSphericalFunctionGaussian (dftfe)
AtomCenteredSphericalFunctionLocalPotentialSpline (dftfe)
AtomCenteredSphericalFunctionProjectorSpline (dftfe)
AtomCenteredSphericalFunctionSinc (dftfe)
AtomCenteredSphericalFunctionSpline (dftfe)
AtomCenteredSphericalFunctionValenceDensitySpline (dftfe)
AtomCenteredSphericalFunctionZOverR (dftfe)
AtomicBasis (dftfe)
AtomicBasisData (dftfe)
AtomicCenteredNonLocalOperator (dftfe)
AtomPseudoWavefunctions (dftfe)
AuxDensityMatrix (dftfe)
AuxDensityMatrixAtomicBasis (dftfe)
AuxDensityMatrixFE (dftfe)
B
BFGSNonLinearSolver (dftfe)
BLASWrapper (dftfe::linearAlgebra)
BLASWrapper< dftfe::utils::MemorySpace::HOST > (dftfe::linearAlgebra)
C
Cell (dftfe::utils)
cgPRPNonLinearSolver (dftfe)
chebyshevOrthogonalizedSubspaceIterationSolver (dftfe)
CompositeData (dftfe::dftUtils)
constraintMatrixInfo (dftfe::dftUtils)
ContractedGaussian (dftfe)
D
dealiiLinearSolver (dftfe)
dealiiLinearSolverProblem (dftfe)
dftBase (dftfe)
dftClass (dftfe)
dftfeWrapper (dftfe)
dftParameters (dftfe)
dispersionCorrection (dftfe)
E
eigenSolverClass (dftfe)
Element (dftfe::pseudoUtils)
elpaScalaManager (dftfe)
energyCalculator (dftfe)
excDensityGGAClass (dftfe)
excDensityLDAClass (dftfe)
excDensityLLMGGAClass (dftfe)
ExcDFTPlusU (dftfe)
excManager (dftfe)
ExcSSDFunctionalBaseClass (dftfe)
expConfiningPotential (dftfe)
F
FEBasisOperations (dftfe::basis)
FECell (dftfe::utils)
FiniteDifference (dftfe::utils)
forceClass (dftfe)
G
GaussianBasis (dftfe)
GaussianBasisInfo (dftfe)
geometryOptimizationClass (dftfe)
geoOptCell (dftfe)
geoOptIon (dftfe)
H
hubbard (dftfe)
hubbardSpecies (dftfe)
I
InterpolateCellWiseDataToPoints (dftfe)
InterpolateFromCellToLocalPoints (dftfe)
K
kerkerSolverProblem (dftfe)
KohnShamHamiltonianOperator (dftfe)
L
LBFGSNonLinearSolver (dftfe)
linearSolver (dftfe)
M
MapPointsToCells (dftfe::utils)
matrixFreeDeviceKernels (dftfe)
MemoryManager (dftfe::utils)
MemoryManager< ValueType, MemorySpace::HOST > (dftfe::utils)
MemoryStorage (dftfe::utils)
MemoryTransfer (dftfe::utils)
MemoryTransfer< MemorySpace::HOST, MemorySpace::HOST > (dftfe::utils)
meshMovementAffineTransform (dftfe)
meshMovementClass (dftfe)
meshMovementGaussianClass (dftfe)
MixingScheme (dftfe)
molecularDynamicsClass (dftfe)
MPICommunicatorP2P (dftfe::utils::mpi)
MPICommunicatorP2PKernels (dftfe::utils)
MPIPatternP2P (dftfe::utils::mpi)
MPIRequestersBase (dftfe::utils::mpi)
MPIRequestersNBX (dftfe::utils::mpi)
MPIWriteOnFile (dftfe::dftUtils)
MultiVector (dftfe::linearAlgebra)
MultiVectorCGSolver (dftfe)
MultiVectorLinearSolverProblem (dftfe)
MultiVectorMinResSolver (dftfe)
MultiVectorPoissonLinearSolverProblem (dftfe)
N
NodalData (dftfe::dftUtils)
nonLinearSolver (dftfe)
nonlinearSolverFunction (dftfe)
nonlinearSolverProblem (dftfe)
nudgedElasticBandClass (dftfe)
O
oncvClass (dftfe)
operatorDFTClass (dftfe)
OptimizedIndexSet (dftfe::utils)
P
PeriodicTable (dftfe::pseudoUtils)
poissonSolverProblem (dftfe)
Pool (dftfe::dftUtils)
ProcessGrid (dftfe)
Q
QuadDataCompositeWrite (dftfe::dftUtils)
R
RTreeBox (dftfe::utils)
RTreePoint (dftfe::utils)
runParameters (dftfe)
S
ScaLAPACKMatrix (dftfe)
singlePrecType (dftfe::dataTypes)
singlePrecType< double > (dftfe::dataTypes)
singlePrecType< std::complex< double > > (dftfe::dataTypes)
SlaterBasis (dftfe)
SlaterBasisInfo (dftfe)
SlaterPrimitive (dftfe)
symmetryClass (dftfe)
T
TransferDataBetweenMeshesIncompatiblePartitioning (dftfe)
triangulationManager (dftfe)
V
vselfBinsManager (dftfe)