SHOSet Member List

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

acquireResource(ResourceCollection &collection, const RefVectorWithLeader< SPOSet > &spo_list) const	SPOSet	inlinevirtual
applyRotation(const ValueMatrix &rot_mat, bool use_stored_copy=false)	SPOSet	virtual
basic_report(const std::string &pad="") const	SPOSet
bvalues	SHOSet
center	SHOSet
checkObject() const	SPOSet	inlinevirtual
checkOutVariables(const opt_variables_type &active)	SPOSet	virtual
ComplexType typedef	QMCTraits
createResource(ResourceCollection &collection) const	SPOSet	inlinevirtual
d0_values	SHOSet
d1_values	SHOSet
d2_values	SHOSet
DIM enum value	QMCTraits
DIM_VGL enum value	QMCTraits
evaluate_check(PosType r, ValueVector &psi, GradVector &dpsi, ValueVector &d2psi)	SHOSet
evaluate_d0(const PosType &xpos, ValueVector &psi)	SHOSet
evaluate_d1(const PosType &xpos, ValueVector &psi, GradVector &dpsi)	SHOSet
evaluate_d2(const PosType &xpos, ValueVector &psi, ValueVector &d2psi)	SHOSet
evaluate_hermite(const PosType &xpos)	SHOSet
evaluate_notranspose(const ParticleSet &P, int first, int last, ValueMatrix &logdet, GradMatrix &dlogdet, ValueMatrix &d2logdet) override	SHOSet	virtual
evaluate_notranspose(const ParticleSet &P, int first, int last, ValueMatrix &logdet, GradMatrix &dlogdet, HessMatrix &ddlogdet) override	SHOSet	virtual
evaluate_notranspose(const ParticleSet &P, int first, int last, ValueMatrix &logdet, GradMatrix &dlogdet, HessMatrix &ddlogdet, GGGMatrix &dddlogdet) override	SHOSet	virtual
evaluate_notranspose_spin(const ParticleSet &P, int first, int last, ValueMatrix &logdet, GradMatrix &dlogdet, ValueMatrix &d2logdet, ValueMatrix &dspinlogdet)	SPOSet	virtual
evaluate_spin(const ParticleSet &P, int iat, ValueVector &psi, ValueVector &dpsi)	SPOSet	virtual
evaluate_v(PosType r, ValueVector &psi)	SHOSet
evaluate_vgl(PosType r, ValueVector &psi, GradVector &dpsi, ValueVector &d2psi)	SHOSet
evaluateDerivatives(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi, Vector< ValueType > &dhpsioverpsi, const int &FirstIndex, const int &LastIndex)	SPOSet	virtual
evaluateDerivatives(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi, Vector< ValueType > &dhpsioverpsi, const ValueType &psiCurrent, const std::vector< ValueType > &Coeff, const std::vector< size_t > &C2node_up, const std::vector< size_t > &C2node_dn, const ValueVector &detValues_up, const ValueVector &detValues_dn, const GradMatrix &grads_up, const GradMatrix &grads_dn, const ValueMatrix &lapls_up, const ValueMatrix &lapls_dn, const ValueMatrix &M_up, const ValueMatrix &M_dn, const ValueMatrix &Minv_up, const ValueMatrix &Minv_dn, const GradMatrix &B_grad, const ValueMatrix &B_lapl, const std::vector< int > &detData_up, const size_t N1, const size_t N2, const size_t NP1, const size_t NP2, const std::vector< std::vector< int >> &lookup_tbl)	SPOSet	virtual
evaluateDerivativesWF(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi, int FirstIndex, int LastIndex)	SPOSet	virtual
evaluateDerivativesWF(ParticleSet &P, const opt_variables_type &optvars, Vector< ValueType > &dlogpsi, const QTFull::ValueType &psiCurrent, const std::vector< ValueType > &Coeff, const std::vector< size_t > &C2node_up, const std::vector< size_t > &C2node_dn, const ValueVector &detValues_up, const ValueVector &detValues_dn, const ValueMatrix &M_up, const ValueMatrix &M_dn, const ValueMatrix &Minv_up, const ValueMatrix &Minv_dn, const std::vector< int > &detData_up, const std::vector< std::vector< int >> &lookup_tbl)	SPOSet	virtual
evaluateDerivRatios(const VirtualParticleSet &VP, const opt_variables_type &optvars, ValueVector &psi, const ValueVector &psiinv, std::vector< ValueType > &ratios, Matrix< ValueType > &dratios, int FirstIndex, int LastIndex)	SPOSet	virtual
evaluateDetRatios(const VirtualParticleSet &VP, ValueVector &psi, const ValueVector &psiinv, std::vector< ValueType > &ratios)	SPOSet	virtual
evaluateDetSpinorRatios(const VirtualParticleSet &VP, ValueVector &psi, const std::pair< ValueVector, ValueVector > &spinor_multiplier, const ValueVector &invrow, std::vector< ValueType > &ratios)	SPOSet	virtual
evaluateGradSource(const ParticleSet &P, int first, int last, const ParticleSet &source, int iat_src, GradMatrix &gradphi) override	SHOSet	virtual
evaluateGradSource(const ParticleSet &P, int first, int last, const ParticleSet &source, int iat_src, GradMatrix &dphi, HessMatrix &ddphi, GradMatrix &dlapl_phi) override	SHOSet	virtual
evaluateGradSourceRow(const ParticleSet &P, int iel, const ParticleSet &source, int iat_src, GradVector &gradphi)	SPOSet	virtual
evaluateThirdDeriv(const ParticleSet &P, int first, int last, GGGMatrix &dddlogdet) override	SHOSet	virtual
evaluateValue(const ParticleSet &P, int iat, ValueVector &psi) override	SHOSet	virtual
evaluateVGH(const ParticleSet &P, int iat, ValueVector &psi, GradVector &dpsi, HessVector &grad_grad_psi)	SPOSet	virtual
evaluateVGHGH(const ParticleSet &P, int iat, ValueVector &psi, GradVector &dpsi, HessVector &grad_grad_psi, GGGVector &grad_grad_grad_psi)	SPOSet	virtual
evaluateVGL(const ParticleSet &P, int iat, ValueVector &psi, GradVector &dpsi, ValueVector &d2psi) override	SHOSet	virtual
evaluateVGL_spin(const ParticleSet &P, int iat, ValueVector &psi, GradVector &dpsi, ValueVector &d2psi, ValueVector &dspin)	SPOSet	virtual
extractOptimizableObjectRefs(UniqueOptObjRefs &opt_obj_refs)	SPOSet	virtual
finalizeConstruction()	SPOSet	inlinevirtual
FullPrecRealType typedef	QMCTraits
FullPrecValueType typedef	QMCTraits
get_k(int orb)	SPOSet	inlinevirtual
getClassName() const override	SHOSet	inlinevirtual
getName() const	SPOSet	inline
getOrbitalSetSize() const	SPOSet	inline
GGGMatrix typedef	SPOSet
GGGVector typedef	SPOSet
grad_type typedef	SHOSet
GradMatrix typedef	SPOSet
GradType typedef	QMCTraits
GradVector typedef	SPOSet
hasIonDerivs() const	SPOSet	inlinevirtual
hermite	SHOSet
HessMatrix typedef	SPOSet
HessVector typedef	SPOSet
IndexType typedef	QMCTraits
initialize()	SHOSet
isOMPoffload() const	SPOSet	inlinevirtual
isOptimizable() const	SPOSet	inlinevirtual
isRotationSupported() const	SPOSet	inlinevirtual
length	SHOSet
makeClone() const override	SHOSet	virtual
mw_evaluate_notranspose(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< ParticleSet > &P_list, int first, int last, const RefVector< ValueMatrix > &logdet_list, const RefVector< GradMatrix > &dlogdet_list, const RefVector< ValueMatrix > &d2logdet_list) const	SPOSet	virtual
mw_evaluateDetRatios(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< const VirtualParticleSet > &vp_list, const RefVector< ValueVector > &psi_list, const std::vector< const ValueType *> &invRow_ptr_list, std::vector< std::vector< ValueType >> &ratios_list) const	SPOSet	virtual
mw_evaluateValue(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< ParticleSet > &P_list, int iat, const RefVector< ValueVector > &psi_v_list) const	SPOSet	virtual
mw_evaluateVGL(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< ParticleSet > &P_list, int iat, const RefVector< ValueVector > &psi_v_list, const RefVector< GradVector > &dpsi_v_list, const RefVector< ValueVector > &d2psi_v_list) const	SPOSet	virtual
mw_evaluateVGLandDetRatioGrads(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< ParticleSet > &P_list, int iat, const std::vector< const ValueType *> &invRow_ptr_list, OffloadMWVGLArray &phi_vgl_v, std::vector< ValueType > &ratios, std::vector< GradType > &grads) const	SPOSet	virtual
mw_evaluateVGLandDetRatioGradsWithSpin(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< ParticleSet > &P_list, int iat, const std::vector< const ValueType *> &invRow_ptr_list, OffloadMWVGLArray &phi_vgl_v, std::vector< ValueType > &ratios, std::vector< GradType > &grads, std::vector< ValueType > &spingrads) const	SPOSet	virtual
mw_evaluateVGLWithSpin(const RefVectorWithLeader< SPOSet > &spo_list, const RefVectorWithLeader< ParticleSet > &P_list, int iat, const RefVector< ValueVector > &psi_v_list, const RefVector< GradVector > &dpsi_v_list, const RefVector< ValueVector > &d2psi_v_list, OffloadMatrix< ComplexType > &mw_dspin) const	SPOSet	virtual
my_name_	SPOSet	protected
myVars	SPOSet	protected
nmax	SHOSet
not_implemented(const std::string &method)	SHOSet	inline
OffloadMatrix typedef	SPOSet
OffloadMWVArray typedef	SPOSet
OffloadMWVGLArray typedef	SPOSet
OrbitalSetSize	SPOSet	protected
PosType typedef	QMCTraits
prefactors	SHOSet
PropertySetType typedef	QMCTraits
PtclGrpIndexes typedef	QMCTraits
qn_max	SHOSet
QTBase typedef	QMCTraits
QTFull typedef	QMCTraits
RealType typedef	QMCTraits
releaseResource(ResourceCollection &collection, const RefVectorWithLeader< SPOSet > &spo_list) const	SPOSet	inlinevirtual
report(const std::string &pad="") const override	SHOSet	virtual
setOrbitalSetSize(int norbs) override	SHOSet	inlinevirtual
SHOSet(const std::string &my_name, RealType l, PosType c, const std::vector< SHOState *> &sho_states)	SHOSet
size() const	SPOSet	inline
SPOMap typedef	SPOSet
SPOSet(const std::string &my_name)	SPOSet
state_info	SHOSet
storeParamsBeforeRotation()	SPOSet	inlinevirtual
TensorType typedef	QMCTraits
test_derivatives()	SHOSet
test_overlap()	SHOSet
transformSPOSet()	SPOSet	inlinevirtual
value_type typedef	SHOSet
ValueMatrix typedef	SPOSet
ValueType typedef	QMCTraits
ValueVector typedef	SPOSet
~SHOSet() override	SHOSet
~SPOSet()=default	SPOSet	virtual