QMCHamiltonians Directory Reference

Directory dependency graph for QMCHamiltonians:

Directories
directory	tests

Files
file	ACForce.cpp [code]
	Implementation of ACForce, Assaraf-Caffarel ZVZB style force estimation.
file	ACForce.h [code]
	Declaration of ACForce, Assaraf-Caffarel ZVZB style force estimation.
file	BareForce.cpp [code]
file	BareForce.h [code]
file	BareKineticEnergy.cpp [code]
file	BareKineticEnergy.h [code]
file	BareKineticHelper.h [code]
file	ChiesaCorrection.cpp [code]
file	ChiesaCorrection.h [code]
file	ConservedEnergy.h [code]
file	CoulombPBCAA.cpp [code]
file	CoulombPBCAA.h [code]
file	CoulombPBCAB.cpp [code]
file	CoulombPBCAB.h [code]
file	CoulombPotential.h [code]
file	CoulombPotentialFactory.cpp [code]
file	DensityEstimator.cpp [code]
file	DensityEstimator.h [code]
file	DensityMatrices1B.cpp [code]
file	DensityMatrices1B.h [code]
file	ECPComponentBuilder.1.cpp [code]
file	ECPComponentBuilder.2.cpp [code]
file	ECPComponentBuilder.cpp [code]
file	ECPComponentBuilder.h [code]
	Declaration of a builder class for an ECP component for an ionic type.
file	ECPComponentBuilder_L2.cpp [code]
file	ECPotentialBuilder.cpp [code]
file	ECPotentialBuilder.h [code]
file	EnergyDensityEstimator.cpp [code]
file	EnergyDensityEstimator.h [code]
file	EwaldRef.cpp [code]
file	EwaldRef.h [code]
	Computes Ewald sums of the potential energy to a given tolerance for arbitrary collections of charges.
file	ForceBase.cpp [code]
file	ForceBase.h [code]
file	ForceCeperley.cpp [code]
file	ForceCeperley.h [code]
file	ForceChiesaPBCAA.cpp [code]
file	ForceChiesaPBCAA.h [code]
file	ForwardWalking.cpp [code]
file	ForwardWalking.h [code]
	Declarations of ForwardWalking.
file	GridExternalPotential.cpp [code]
file	GridExternalPotential.h [code]
file	HamiltonianFactory.cpp [code]
	Manage instantiation of Coulomb-related potentials.
file	HamiltonianFactory.h [code]
	Declaration of a HamiltonianFactory.
file	HamiltonianPool.cpp [code]
	Implements HamiltonianPool operators.
file	HamiltonianPool.h [code]
	Declaration of HamiltonianPool.
file	HarmonicExternalPotential.cpp [code]
file	HarmonicExternalPotential.h [code]
file	Hdispatcher.cpp [code]
file	Hdispatcher.h [code]
file	L2Potential.cpp [code]
file	L2Potential.h [code]
file	LatticeDeviationEstimator.cpp [code]
file	LatticeDeviationEstimator.h [code]
file	Listener.hpp [code]
	Listener types that allow Estimators to register with QMCHamiltonian to have "trace" values from operators reported.
file	LocalECPotential.cpp [code]
file	LocalECPotential.h [code]
file	MomentumEstimator.cpp [code]
file	MomentumEstimator.h [code]
file	MPC.cpp [code]
file	MPC.h [code]
file	NLPP.h [code]
file	NLPPJob.h [code]
file	NonLocalData.h [code]
file	NonLocalECPComponent.cpp [code]
file	NonLocalECPComponent.h [code]
file	NonLocalECPotential.cpp [code]
file	NonLocalECPotential.deriv.cpp [code]
file	NonLocalECPotential.h [code]
file	NonLocalTOperator.cpp [code]
	Definition of NonLocalTOperator.
file	NonLocalTOperator.h [code]
	Declaration of NonLocalTOperator.
file	ObservableHelper.cpp [code]
	Definition of ObservableHelper class.
file	ObservableHelper.h [code]
	Declaration of ObservableHelper and other helper class for observables.
file	OperatorBase.cpp [code]
	Definition of OperatorBase.
file	OperatorBase.h [code]
	Declaration of OperatorBase.
file	OrbitalImages.cpp [code]
file	OrbitalImages.h [code]
file	PairCorrEstimator.cpp [code]
file	PairCorrEstimator.h [code]
file	Pressure.h [code]
file	QMCHamiltonian.cpp [code]
file	QMCHamiltonian.h [code]
	Declaration of QMCHamiltonian.
file	RandomRotationMatrix.h [code]
file	ReferencePoints.cpp [code]
file	ReferencePoints.h [code]
file	SelfHealingOverlapLegacy.cpp [code]
file	SelfHealingOverlapLegacy.h [code]
file	SkAllEstimator.cpp [code]
file	SkAllEstimator.h [code]
	Declare SkAllEstimator.
file	SkEstimator.cpp [code]
file	SkEstimator.h [code]
	Declare SkEstimator.
file	SkPot.cpp [code]
file	SkPot.h [code]
	Declare SkPot.
file	SOECPComponent.cpp [code]
file	SOECPComponent.h [code]
file	SOECPotential.cpp [code]
file	SOECPotential.h [code]
file	SpaceGrid.cpp [code]
file	SpaceGrid.h [code]
file	SpaceWarpTransformation.cpp [code]
file	SpaceWarpTransformation.h [code]
file	SpeciesKineticEnergy.cpp [code]
file	SpeciesKineticEnergy.h [code]
file	SpinDensity.cpp [code]
file	SpinDensity.h [code]
file	StaticStructureFactor.cpp [code]
file	StaticStructureFactor.h [code]
file	StressPBC.cpp [code]
file	StressPBC.h [code]