LinearOrbital Member List

This is the complete list of members for LinearOrbital, including all inherited members.

acceptMove(ParticleSet &P, int iat, bool safe_to_delay=false) override	LinearOrbital	inlinevirtual
acquireResource(ResourceCollection &collection, const RefVectorWithLeader< WaveFunctionComponent > &wfc_list) const	WaveFunctionComponent	inlinevirtual
BufferType typedef	WaveFunctionComponent
Bytes_in_WFBuffer	WaveFunctionComponent
checkOutVariables(const opt_variables_type &active)	WaveFunctionComponent	virtual
checkSanity() const	WaveFunctionComponent	inlinevirtual
coeff	LinearOrbital
completeUpdates()	WaveFunctionComponent	inlinevirtual
ComplexType typedef	QMCTraits
copyFromBuffer(ParticleSet &P, WFBufferType &buf) override	LinearOrbital	inlinevirtual
createResource(ResourceCollection &collection) const	WaveFunctionComponent	inlinevirtual
DIM enum value	QMCTraits
DIM_VGL enum value	QMCTraits
evalGrad(ParticleSet &P, int iat) override	LinearOrbital	inlinevirtual
evalGradSource(ParticleSet &P, ParticleSet &source, int iat)	WaveFunctionComponent	inlinevirtual
evalGradSource(ParticleSet &P, ParticleSet &source, int iat, TinyVector< ParticleSet::ParticleGradient, OHMMS_DIM > &grad_grad, TinyVector< ParticleSet::ParticleLaplacian, OHMMS_DIM > &lapl_grad)	WaveFunctionComponent	inlinevirtual
evalGradWithSpin(ParticleSet &P, int iat, ComplexType &spingrad)	WaveFunctionComponent	inlinevirtual
evaluateDerivatives(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi, Vector< ValueType > &dhpsioverpsi) override	LinearOrbital	inlinevirtual
evaluateDerivativesWF(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi)	WaveFunctionComponent	virtual
evaluateDerivRatios(const VirtualParticleSet &VP, const opt_variables_type &optvars, std::vector< ValueType > &ratios, Matrix< ValueType > &dratios)	WaveFunctionComponent	virtual
evaluateGL(const ParticleSet &P, ParticleSet::ParticleGradient &G, ParticleSet::ParticleLaplacian &L, bool fromscratch)	WaveFunctionComponent	virtual
evaluateGradDerivatives(const ParticleSet::ParticleGradient &G_in, std::vector< ValueType > &dgradlogpsi)	WaveFunctionComponent	inlinevirtual
evaluateHessian(ParticleSet &P, HessVector &grad_grad_psi_all)	WaveFunctionComponent	inlinevirtual
evaluateLog(const ParticleSet &P, ParticleSet::ParticleGradient &G, ParticleSet::ParticleLaplacian &L) override	LinearOrbital	inlinevirtual
evaluateRatios(const VirtualParticleSet &VP, std::vector< ValueType > &ratios)	WaveFunctionComponent	virtual
evaluateRatiosAlltoOne(ParticleSet &P, std::vector< ValueType > &ratios)	WaveFunctionComponent	virtual
evaluateSpinorRatios(const VirtualParticleSet &VP, const std::pair< ValueVector, ValueVector > &spinor_multiplier, std::vector< ValueType > &ratios)	WaveFunctionComponent	virtual
extractOptimizableObjectRefs(UniqueOptObjRefs &opt_obj_refs)	WaveFunctionComponent	virtual
finalizeOptimization()	WaveFunctionComponent	inlinevirtual
FullPrecRealType typedef	QMCTraits
FullPrecValueType typedef	QMCTraits
get_log_value() const	WaveFunctionComponent	inline
getClassName() const override	LinearOrbital	inlinevirtual
getName() const	WaveFunctionComponent	inline
getValue() const	WaveFunctionComponent	inline
GradMatrix typedef	WaveFunctionComponent
GradType typedef	QMCTraits
HessType typedef	WaveFunctionComponent
HessVector typedef	WaveFunctionComponent
IndexType typedef	QMCTraits
isFermionic() const	WaveFunctionComponent	inlinevirtual
isMultiDet() const	WaveFunctionComponent	inlinevirtual
isOptimizable() const	WaveFunctionComponent	inlinevirtual
KECorrection()	WaveFunctionComponent	virtual
LinearOrbital()	LinearOrbital	inline
log_value_	WaveFunctionComponent	protected
LogValue typedef	WaveFunctionComponent
makeClone(ParticleSet &tqp) const	WaveFunctionComponent	virtual
mw_accept_rejectMove(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, const std::vector< bool > &isAccepted, bool safe_to_delay=false) const	WaveFunctionComponent	virtual
mw_calcRatio(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios) const	WaveFunctionComponent	virtual
mw_completeUpdates(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list) const	WaveFunctionComponent	virtual
mw_evalGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const int iat, TWFGrads< CT > &grads_now) const	WaveFunctionComponent
mw_evalGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< GradType > &grad_now) const	WaveFunctionComponent	virtual
mw_evalGradWithSpin(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< GradType > &grad_now, std::vector< ComplexType > &spingrad_now) const	WaveFunctionComponent	virtual
mw_evaluateGL(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const RefVector< ParticleSet::ParticleGradient > &G_list, const RefVector< ParticleSet::ParticleLaplacian > &L_list, bool fromscratch) const	WaveFunctionComponent	virtual
mw_evaluateLog(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const RefVector< ParticleSet::ParticleGradient > &G_list, const RefVector< ParticleSet::ParticleLaplacian > &L_list) const	WaveFunctionComponent	virtual
mw_evaluateRatios(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< const VirtualParticleSet > &vp_list, std::vector< std::vector< ValueType >> &ratios) const	WaveFunctionComponent	virtual
mw_prepareGroup(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int ig) const	WaveFunctionComponent	virtual
mw_ratioGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios, TWFGrads< CT > &grad_new) const	WaveFunctionComponent
mw_ratioGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios, std::vector< GradType > &grad_new) const	WaveFunctionComponent	virtual
mw_ratioGradWithSpin(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios, std::vector< GradType > &grad_new, std::vector< ComplexType > &spingrad_new) const	WaveFunctionComponent	virtual
mw_recompute(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const std::vector< bool > &recompute) const	WaveFunctionComponent	virtual
my_name_	WaveFunctionComponent	protected
myVars	WaveFunctionComponent
ORB_ALLWALKER enum value	WaveFunctionComponent
ORB_PBYP_ALL enum value	WaveFunctionComponent
ORB_PBYP_PARTIAL enum value	WaveFunctionComponent
ORB_PBYP_RATIO enum value	WaveFunctionComponent
ORB_WALKER enum value	WaveFunctionComponent
PosType typedef	QMCTraits
prepareGroup(ParticleSet &P, int ig)	WaveFunctionComponent	inlinevirtual
PropertySetType typedef	QMCTraits
PsiValue typedef	WaveFunctionComponent
PtclGrpIndexes typedef	QMCTraits
QTBase typedef	QMCTraits
QTFull typedef	QMCTraits
ratio(ParticleSet &P, int iat) override	LinearOrbital	inlinevirtual
ratioGrad(ParticleSet &P, int iat, GradType &grad_iat) override	LinearOrbital	inlinevirtual
ratioGradWithSpin(ParticleSet &P, int iat, GradType &grad_iat, ComplexType &spingrad_iat)	WaveFunctionComponent	inlinevirtual
RealMatrix_t typedef	WaveFunctionComponent
RealType typedef	QMCTraits
recompute(const ParticleSet &P)	WaveFunctionComponent	virtual
registerData(ParticleSet &P, WFBufferType &buf) override	LinearOrbital	inlinevirtual
registerTWFFastDerivWrapper(const ParticleSet &P, TWFFastDerivWrapper &twf) const	WaveFunctionComponent	virtual
releaseResource(ResourceCollection &collection, const RefVectorWithLeader< WaveFunctionComponent > &wfc_list) const	WaveFunctionComponent	inlinevirtual
restore(int iat) override	LinearOrbital	inlinevirtual
TensorType typedef	QMCTraits
updateBuffer(ParticleSet &P, WFBufferType &buf, bool fromscratch=false) override	LinearOrbital	inlinevirtual
UpdateMode	WaveFunctionComponent
ValueMatrix typedef	WaveFunctionComponent
ValueType typedef	QMCTraits
ValueVector typedef	WaveFunctionComponent
Walker_t typedef	WaveFunctionComponent
WaveFunctionComponent(const std::string &obj_name="")	WaveFunctionComponent
WFBufferType typedef	WaveFunctionComponent
~WaveFunctionComponent()	WaveFunctionComponent	virtual