QMCPACK
CountingJastrow< RegionType > Member List

This is the complete list of members for CountingJastrow< RegionType >, including all inherited members.

acceptMove(ParticleSet &P, int iat, bool safe_to_delay=false) overrideCountingJastrow< RegionType >inlinevirtual
acquireResource(ResourceCollection &collection, const RefVectorWithLeader< WaveFunctionComponent > &wfc_list) constWaveFunctionComponentinlinevirtual
addDebug(bool debug_flag, int seqlen, int period)CountingJastrow< RegionType >inline
BufferType typedefWaveFunctionComponent
Bytes_in_WFBufferWaveFunctionComponent
CCountingJastrow< RegionType >protected
checkInVariablesExclusive(opt_variables_type &active) finalCountingJastrow< RegionType >inlinevirtual
checkOutVariables(const opt_variables_type &active) overrideCountingJastrow< RegionType >inlinevirtual
checkSanity() constWaveFunctionComponentinlinevirtual
completeUpdates()WaveFunctionComponentinlinevirtual
ComplexType typedefQMCTraits
copyFromBuffer(ParticleSet &P, WFBufferType &buf) overrideCountingJastrow< RegionType >inlinevirtual
CountingJastrow(ParticleSet &P, std::unique_ptr< RegionType > c, const Matrix< RealType > &f, bool opt_C_flag, bool opt_F_flag)CountingJastrow< RegionType >inline
createResource(ResourceCollection &collection) constWaveFunctionComponentinlinevirtual
dCFCggsumCountingJastrow< RegionType >protected
dCggsumCountingJastrow< RegionType >protected
dCindexCountingJastrow< RegionType >protected
dClapsumCountingJastrow< RegionType >protected
dCsumCountingJastrow< RegionType >protected
dCsum_tCountingJastrow< RegionType >protected
debugCountingJastrow< RegionType >protected
debug_periodCountingJastrow< RegionType >protected
debug_seqlenCountingJastrow< RegionType >protected
DIM enum valueQMCTraits
DIM_VGL enum valueQMCTraits
evalGrad(ParticleSet &P, int iat) overrideCountingJastrow< RegionType >inlinevirtual
evalGradSource(ParticleSet &P, ParticleSet &source, int iat)WaveFunctionComponentinlinevirtual
evalGradSource(ParticleSet &P, ParticleSet &source, int iat, TinyVector< ParticleSet::ParticleGradient, OHMMS_DIM > &grad_grad, TinyVector< ParticleSet::ParticleLaplacian, OHMMS_DIM > &lapl_grad)WaveFunctionComponentinlinevirtual
evalGradWithSpin(ParticleSet &P, int iat, ComplexType &spingrad)WaveFunctionComponentinlinevirtual
evaluateDerivatives(ParticleSet &P, const opt_variables_type &active, Vector< ValueType > &dlogpsi, Vector< ValueType > &dhpsioverpsi) overrideCountingJastrow< RegionType >inline
qmcplusplus::WaveFunctionComponent::evaluateDerivatives(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi, Vector< ValueType > &dhpsioverpsi)=0WaveFunctionComponentpure virtual
evaluateDerivativesWF(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi)WaveFunctionComponentvirtual
evaluateDerivRatios(const VirtualParticleSet &VP, const opt_variables_type &optvars, std::vector< ValueType > &ratios, Matrix< ValueType > &dratios)WaveFunctionComponentvirtual
evaluateExponents(const ParticleSet &P)CountingJastrow< RegionType >inline
evaluateExponents_print(std::ostream &os, const ParticleSet &P)CountingJastrow< RegionType >inline
evaluateGL(const ParticleSet &P, ParticleSet::ParticleGradient &G, ParticleSet::ParticleLaplacian &L, bool fromscratch)WaveFunctionComponentvirtual
evaluateGradDerivatives(const ParticleSet::ParticleGradient &G_in, std::vector< ValueType > &dgradlogpsi)WaveFunctionComponentinlinevirtual
evaluateHessian(ParticleSet &P, HessVector &grad_grad_psi_all)WaveFunctionComponentinlinevirtual
evaluateLog(const ParticleSet &P, ParticleSet::ParticleGradient &G, ParticleSet::ParticleLaplacian &L) overrideCountingJastrow< RegionType >inlinevirtual
evaluateRatios(const VirtualParticleSet &VP, std::vector< ValueType > &ratios)WaveFunctionComponentvirtual
evaluateRatiosAlltoOne(ParticleSet &P, std::vector< ValueType > &ratios)WaveFunctionComponentvirtual
evaluateSpinorRatios(const VirtualParticleSet &VP, const std::pair< ValueVector, ValueVector > &spinor_multiplier, std::vector< ValueType > &ratios)WaveFunctionComponentvirtual
evaluateTempExponents(ParticleSet &P, int iat)CountingJastrow< RegionType >inline
evaluateTempExponents_print(std::ostream &os, ParticleSet &P, int iat)CountingJastrow< RegionType >inline
extractOptimizableObjectRefs(UniqueOptObjRefs &opt_obj_refs) overrideCountingJastrow< RegionType >inlinevirtual
FCountingJastrow< RegionType >protected
FCggsumCountingJastrow< RegionType >protected
FCgradCountingJastrow< RegionType >protected
FCgrad_tCountingJastrow< RegionType >protected
FClapCountingJastrow< RegionType >protected
FClap_tCountingJastrow< RegionType >protected
FClapsumCountingJastrow< RegionType >protected
FCsumCountingJastrow< RegionType >protected
FCsum_tCountingJastrow< RegionType >protected
finalizeOptimization()WaveFunctionComponentinlinevirtual
FullPrecRealType typedefQMCTraits
FullPrecValueType typedefQMCTraits
get_log_value() constWaveFunctionComponentinline
getClassName() const overrideCountingJastrow< RegionType >inlinevirtual
qmcplusplus::getName() constWaveFunctionComponentinline
qmcplusplus::OptimizableObject::getName() constOptimizableObjectinline
getValue() constWaveFunctionComponentinline
GradMatrix typedefWaveFunctionComponent
GradType typedefQMCTraits
HessType typedefWaveFunctionComponent
HessVector typedefWaveFunctionComponent
IndexType typedefQMCTraits
initialize()CountingJastrow< RegionType >inline
isFermionic() constWaveFunctionComponentinlinevirtual
isMultiDet() constWaveFunctionComponentinlinevirtual
isOptimizable() const overrideCountingJastrow< RegionType >inlinevirtual
isOptimized() constOptimizableObjectinline
JgradCountingJastrow< RegionType >protected
Jgrad_tCountingJastrow< RegionType >protected
JlapCountingJastrow< RegionType >protected
Jlap_tCountingJastrow< RegionType >protected
JvalCountingJastrow< RegionType >protected
Jval_tCountingJastrow< RegionType >protected
KECorrection()WaveFunctionComponentvirtual
log_value_WaveFunctionComponentprotected
LogValue typedefWaveFunctionComponent
makeClone(ParticleSet &tqp) const overrideCountingJastrow< RegionType >inlinevirtual
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) constWaveFunctionComponentvirtual
mw_calcRatio(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios) constWaveFunctionComponentvirtual
mw_completeUpdates(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list) constWaveFunctionComponentvirtual
mw_evalGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const int iat, TWFGrads< CT > &grads_now) constWaveFunctionComponent
mw_evalGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< GradType > &grad_now) constWaveFunctionComponentvirtual
mw_evalGradWithSpin(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< GradType > &grad_now, std::vector< ComplexType > &spingrad_now) constWaveFunctionComponentvirtual
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) constWaveFunctionComponentvirtual
mw_evaluateLog(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const RefVector< ParticleSet::ParticleGradient > &G_list, const RefVector< ParticleSet::ParticleLaplacian > &L_list) constWaveFunctionComponentvirtual
mw_evaluateRatios(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< const VirtualParticleSet > &vp_list, std::vector< std::vector< ValueType >> &ratios) constWaveFunctionComponentvirtual
mw_prepareGroup(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int ig) constWaveFunctionComponentvirtual
mw_ratioGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios, TWFGrads< CT > &grad_new) constWaveFunctionComponent
mw_ratioGrad(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, int iat, std::vector< PsiValue > &ratios, std::vector< GradType > &grad_new) constWaveFunctionComponentvirtual
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) constWaveFunctionComponentvirtual
mw_recompute(const RefVectorWithLeader< WaveFunctionComponent > &wfc_list, const RefVectorWithLeader< ParticleSet > &p_list, const std::vector< bool > &recompute) constWaveFunctionComponentvirtual
my_name_WaveFunctionComponentprotected
myVarsWaveFunctionComponent
num_elsCountingJastrow< RegionType >protected
NUM_OPT_VAR enum valueCountingJastrow< RegionType >protected
num_regionsCountingJastrow< RegionType >protected
opt_CCountingJastrow< RegionType >protected
OPT_F enum valueCountingJastrow< RegionType >protected
opt_FCountingJastrow< RegionType >protected
opt_idCountingJastrow< RegionType >protected
opt_indexCountingJastrow< RegionType >protected
opt_var enum nameCountingJastrow< RegionType >protected
OptimizableObject(const std::string &name)OptimizableObjectinline
ORB_ALLWALKER enum valueWaveFunctionComponent
ORB_PBYP_ALL enum valueWaveFunctionComponent
ORB_PBYP_PARTIAL enum valueWaveFunctionComponent
ORB_PBYP_RATIO enum valueWaveFunctionComponent
ORB_WALKER enum valueWaveFunctionComponent
PosType typedefQMCTraits
prepareGroup(ParticleSet &P, int ig)WaveFunctionComponentinlinevirtual
PropertySetType typedefQMCTraits
PsiValue typedefWaveFunctionComponent
PtclGrpIndexes typedefQMCTraits
QTBase typedefQMCTraits
QTFull typedefQMCTraits
ratio(ParticleSet &P, int iat) overrideCountingJastrow< RegionType >inlinevirtual
ratioGrad(ParticleSet &P, int iat, GradType &grad_iat) overrideCountingJastrow< RegionType >inlinevirtual
ratioGradWithSpin(ParticleSet &P, int iat, GradType &grad_iat, ComplexType &spingrad_iat)WaveFunctionComponentinlinevirtual
readVariationalParameters(hdf_archive &hin)OptimizableObjectinlinevirtual
RealMatrix_t typedefWaveFunctionComponent
RealType typedefQMCTraits
recompute(const ParticleSet &P) overrideCountingJastrow< RegionType >inlinevirtual
registerData(ParticleSet &P, WFBufferType &buf) overrideCountingJastrow< RegionType >inlinevirtual
registerTWFFastDerivWrapper(const ParticleSet &P, TWFFastDerivWrapper &twf) constWaveFunctionComponentvirtual
releaseResource(ResourceCollection &collection, const RefVectorWithLeader< WaveFunctionComponent > &wfc_list) constWaveFunctionComponentinlinevirtual
reportStatus(std::ostream &os) overrideCountingJastrow< RegionType >inlinevirtual
resetParametersExclusive(const opt_variables_type &active) overrideCountingJastrow< RegionType >inlinevirtual
restore(int iat) overrideCountingJastrow< RegionType >inlinevirtual
setOptimization(bool state)OptimizableObjectinline
TensorType typedefQMCTraits
updateBuffer(ParticleSet &P, WFBufferType &buf, bool fromscratch=false) overrideCountingJastrow< RegionType >inlinevirtual
UpdateModeWaveFunctionComponent
ValueMatrix typedefWaveFunctionComponent
ValueType typedefQMCTraits
ValueVector typedefWaveFunctionComponent
Walker_t typedefWaveFunctionComponent
WaveFunctionComponent(const std::string &obj_name="")WaveFunctionComponent
WFBufferType typedefWaveFunctionComponent
writeVariationalParameters(hdf_archive &hout)OptimizableObjectinlinevirtual
~WaveFunctionComponent()WaveFunctionComponentvirtual