- Generated by
1.16.1
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votca 2026-dev
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This is the complete list of members for votca::xtp::BSE, including all inherited members.
| AdjustHqpSize(const Eigen::MatrixXd &Hqp_in, const Eigen::VectorXd &RPAInputEnergies) | votca::xtp::BSE | private |
| Analyze_eh_interaction(const QMStateType &type, const Orbitals &orb) const | votca::xtp::BSE | private |
| Analyze_singlets(std::vector< QMFragment< BSE_Population > > fragments, const Orbitals &orb) const | votca::xtp::BSE | |
| Analyze_triplets(std::vector< QMFragment< BSE_Population > > fragments, const Orbitals &orb) const | votca::xtp::BSE | |
| BSE(Logger &log, TCMatrix_gwbse &Mmn) | votca::xtp::BSE | inline |
| bse_cmin_ | votca::xtp::BSE | private |
| bse_ctotal_ | votca::xtp::BSE | private |
| bse_size_ | votca::xtp::BSE | private |
| bse_vmax_ | votca::xtp::BSE | private |
| bse_vtotal_ | votca::xtp::BSE | private |
| configure(const options &opt, const Eigen::VectorXd &RPAEnergies, const Eigen::MatrixXd &Hqp_in) | votca::xtp::BSE | |
| configure_with_precomputed_screening(const options &opt, const Eigen::VectorXd &RPAEnergies, const Eigen::MatrixXd &Hqp_in, const Eigen::VectorXd &epsilon_0_inv) | votca::xtp::BSE | |
| configureBSEOperator(BSE_OPERATOR &H, std::shared_ptr< SymmetricTiles > cache=nullptr) const | votca::xtp::BSE | private |
| CouplingTermDensity(const Eigen::VectorXd &Avec, const Eigen::VectorXd &Bvec) const | votca::xtp::BSE | private |
| DecideDirectCaches(bool coupling) const | votca::xtp::BSE | private |
| direct_caches_ | votca::xtp::BSE | mutableprivate |
| DirectTermDensity(const std::vector< std::pair< const Eigen::VectorXd *, const Eigen::VectorXd * > > &pairs) const | votca::xtp::BSE | private |
| dressing_ | votca::xtp::BSE | private |
| dyn_tolerance_ | votca::xtp::BSE | private |
| epsilon_0_inv_ | votca::xtp::BSE | private |
| ExchangePrefactor(const QMStateType &type) const | votca::xtp::BSE | private |
| ExpectationValue_Operator(const QMStateType &type, const Orbitals &orb, const BSE_OPERATOR &H) const | votca::xtp::BSE | private |
| GetBSEEigenSystem(const QMStateType &type, Orbitals &orb) const | votca::xtp::BSE | private |
| GetBSEEigenSystem(const QMStateType &type, const Orbitals &orb) const | votca::xtp::BSE | private |
| getHqp() const | votca::xtp::BSE | inline |
| getSingletOperator_TDA() const | votca::xtp::BSE | |
| getTripletOperator_TDA() const | votca::xtp::BSE | |
| Hqp_ | votca::xtp::BSE | private |
| include_kreac_ | votca::xtp::BSE | private |
| log_ | votca::xtp::BSE | private |
| MatchDressingToRoute() | votca::xtp::BSE | private |
| max_dyn_iter_ | votca::xtp::BSE | private |
| Mmn_ | votca::xtp::BSE | private |
| opt_ | votca::xtp::BSE | private |
| Perturbative_DynamicalScreening(const QMStateType &type, Orbitals &orb) | votca::xtp::BSE | |
| printFragInfo(const std::vector< QMFragment< BSE_Population > > &frags, Index state) const | votca::xtp::BSE | private |
| PrintWeights(const Eigen::VectorXd &weights) const | votca::xtp::BSE | private |
| printWeights(Index i_bse, double weight) const | votca::xtp::BSE | private |
| reaction_field_ | votca::xtp::BSE | private |
| ReactionFieldExchange(const tools::EigenSystem &es, bool tda) const | votca::xtp::BSE | |
| ReleaseDirectCaches() const | votca::xtp::BSE | private |
| RotateIntoScreeningFrame(const Eigen::MatrixXd &U) | votca::xtp::BSE | private |
| ScreenedInteraction(const Eigen::VectorXd &RPAInputEnergies, double energy, DFTTimings &timings) const | votca::xtp::BSE | private |
| setReactionField(const Eigen::MatrixXd &R, bool include_kreac) | votca::xtp::BSE | |
| setStateMatrixMemory(double bytes) | votca::xtp::BSE | inlinestatic |
| SetupDirectInteractionOperator(const Eigen::VectorXd &DFTenergies, double energy) | votca::xtp::BSE | private |
| solve_hermitian(BSE_OPERATOR &h) const | votca::xtp::BSE | private |
| Solve_nonhermitian(BSE_OPERATOR_ApB &apb, BSE_OPERATOR_AmB &) const | votca::xtp::BSE | private |
| Solve_nonhermitian_Davidson(BSE_OPERATOR_A &Aop, BSE_OPERATOR_B &Bop) const | votca::xtp::BSE | private |
| Solve_singlets(Orbitals &orb) const | votca::xtp::BSE | |
| Solve_singlets_BTDA() const | votca::xtp::BSE | private |
| Solve_singlets_TDA() const | votca::xtp::BSE | private |
| Solve_triplets(Orbitals &orb) const | votca::xtp::BSE | |
| Solve_triplets_BTDA() const | votca::xtp::BSE | private |
| Solve_triplets_TDA() const | votca::xtp::BSE | private |
| state_matrix_bytes_ | votca::xtp::BSE | privatestatic |
| StateDynamicLabel(const QMStateType &type) const | votca::xtp::BSE | private |
| StateEnergiesHeader(const QMStateType &type) const | votca::xtp::BSE | private |
| StateShortLabel(const QMStateType &type) const | votca::xtp::BSE | private |
1.16.1