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MPQC
3.0.0-alpha
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This is the complete list of members for sc::Extern_RefWavefunction, including all inherited members.
| actual_value_accuracy() const | sc::Extern_RefWavefunction | inlinevirtual |
| basis() const (defined in sc::RefWavefunction) | sc::RefWavefunction | inline |
| class_desc() const MPQC__NOEXCEPT | sc::DescribedClass | |
| class_name() const | sc::DescribedClass | |
| class_version() const | sc::DescribedClass | |
| core_hamiltonian_for_basis(const Ref< GaussianBasisSet > &basis, const Ref< GaussianBasisSet > &p_basis) | sc::Extern_RefWavefunction | virtual |
| dereference() | sc::RefCount | inline |
| DescribedClass() (defined in sc::DescribedClass) | sc::DescribedClass | |
| DescribedClass(const DescribedClass &) (defined in sc::DescribedClass) | sc::DescribedClass | |
| desired_value_accuracy() const | sc::Extern_RefWavefunction | inlinevirtual |
| desired_value_accuracy_set_to_default() const | sc::RefWavefunction | virtual |
| dir_restore_state(StateIn &si, const char *objectname, const char *keyword=0) (defined in sc::SavableState) | sc::SavableState | static |
| dk() const | sc::Extern_RefWavefunction | inlinevirtual |
| energy() | sc::Extern_RefWavefunction | inlinevirtual |
| Extern_RefWavefunction(const Ref< WavefunctionWorld > &world, const Ref< GaussianBasisSet > &basis, const Ref< Integral > &integral, const RefSCMatrix &orbs, const std::vector< unsigned int > &orbsymm, const RefSymmSCMatrix &alpha_1rdm, const RefSymmSCMatrix &beta_1rdm, unsigned int nocc, unsigned int nfzc=0, unsigned int nfzv=0, bool omit_uocc=false) | sc::Extern_RefWavefunction | |
| Extern_RefWavefunction(const Ref< WavefunctionWorld > &world, const Ref< GaussianBasisSet > &basis, const Ref< Integral > &integral, const RefSCMatrix &orbs, const std::vector< unsigned int > &orbsymm, const RefSymmSCMatrix &alpha_1rdm, const RefSymmSCMatrix &beta_1rdm, std::vector< unsigned int > occpi, std::vector< unsigned int > fzcpi, std::vector< unsigned int > fzvpi, std::vector< unsigned int > holepi=std::vector< unsigned int >(), std::vector< unsigned int > partpi=std::vector< unsigned int >(), bool omit_uocc=false) | sc::Extern_RefWavefunction | |
| Extern_RefWavefunction(StateIn &) (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | |
| force_average_AB_rdm1_ | sc::RefWavefunction | protected |
| identifier() const | sc::RefCount | inline |
| sc::RefWavefunction::init() const | sc::RefWavefunction | protected |
| integral() const (defined in sc::RefWavefunction) | sc::RefWavefunction | inline |
| key_restore_state(StateIn &si, const char *keyword) | sc::SavableState | static |
| lock_ptr() const | sc::RefCount | |
| magnetic_moment() const | sc::Extern_RefWavefunction | virtual |
| managed() const (defined in sc::RefCount) | sc::RefCount | inline |
| momentum_basis() const | sc::Extern_RefWavefunction | inlinevirtual |
| nelectron() const | sc::Extern_RefWavefunction | inlinevirtual |
| nfzc() const (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | inline |
| nfzv() const (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | inline |
| nreference() const | sc::RefCount | inline |
| obsolete() | sc::Extern_RefWavefunction | virtual |
| occ(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| occ_act(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| occ_act_sb(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| occ_frz(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| occ_frz_sb(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| occ_sb(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| omit_uocc() const (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | inline |
| operator=(const SavableState &) (defined in sc::SavableState) | sc::SavableState | |
| operator=(const DescribedClass &) (defined in sc::DescribedClass) | sc::DescribedClass | |
| operator=(const RefCount &) (defined in sc::RefCount) | sc::RefCount | inlineprotected |
| orbs(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| orbs_sb(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| ordm(SpinCase1 spin) const | sc::Extern_RefWavefunction | inlinevirtual |
| ordm_idempotent() const (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | inline |
| ordm_occ_sb(SpinCase1 spin) const | sc::RefWavefunction | virtual |
| ordm_orbs_sb(SpinCase1 spin) const | sc::RefWavefunction | virtual |
| oso_space() const | sc::RefWavefunction | |
| print(std::ostream &os=ExEnv::out0()) const | sc::Extern_RefWavefunction | virtual |
| purge() | sc::RefWavefunction | virtual |
| ref() | sc::DescribedClass | inline |
| RefCount() (defined in sc::RefCount) | sc::RefCount | inlineprotected |
| RefCount(const RefCount &) (defined in sc::RefCount) | sc::RefCount | inlineprotected |
| reference() | sc::RefCount | inline |
| RefWavefunction(const Ref< KeyVal > &kv) | sc::RefWavefunction | protected |
| RefWavefunction(StateIn &) (defined in sc::RefWavefunction) | sc::RefWavefunction | protected |
| RefWavefunction(const Ref< WavefunctionWorld > &world, const Ref< GaussianBasisSet > &basis, const Ref< Integral > &integral, bool use_world_df=false) | sc::RefWavefunction | protected |
| reset() | sc::RefWavefunction | protectedvirtual |
| restore_state(StateIn &si) | sc::SavableState | static |
| SavableState() (defined in sc::SavableState) | sc::SavableState | protected |
| SavableState(const SavableState &) (defined in sc::SavableState) | sc::SavableState | protected |
| SavableState(StateIn &) | sc::SavableState | protected |
| save_data_state(StateOut &) | sc::Extern_RefWavefunction | virtual |
| save_object_state(StateOut &) | sc::SavableState | |
| save_state(StateOut &) | sc::SavableState | |
| save_state(SavableState *s, StateOut &) (defined in sc::SavableState) | sc::SavableState | static |
| save_vbase_state(StateOut &) | sc::SavableState | virtual |
| sdref() const | sc::Extern_RefWavefunction | virtual |
| set_desired_value_accuracy(double) | sc::RefWavefunction | |
| spin_polarized() const (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | inline |
| spin_restricted() const (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | inline |
| spinspaces_ (defined in sc::RefWavefunction) | sc::RefWavefunction | mutableprotected |
| unlock_ptr() const | sc::RefCount | |
| unmanage() | sc::RefCount | inline |
| uocc(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| uocc_act(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| uocc_act_sb(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| uocc_basis() const | sc::RefWavefunction | inlinevirtual |
| uocc_sb(SpinCase1 spin=AnySpinCase1) const | sc::RefWavefunction | |
| use_locks(bool inVal) | sc::RefCount | |
| use_world_dfinfo() const | sc::RefWavefunction | inlineprotected |
| valence_orbs() const | sc::RefWavefunction | |
| world() const (defined in sc::RefWavefunction) | sc::RefWavefunction | inline |
| ~DescribedClass() (defined in sc::DescribedClass) | sc::DescribedClass | virtual |
| ~Extern_RefWavefunction() (defined in sc::Extern_RefWavefunction) | sc::Extern_RefWavefunction | virtual |
| ~RefCount() (defined in sc::RefCount) | sc::RefCount | virtual |
| ~RefWavefunction() (defined in sc::RefWavefunction) | sc::RefWavefunction | |
| ~SavableState() (defined in sc::SavableState) | sc::SavableState | virtual |