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votca 2026-dev
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This is the complete list of members for votca::xtp::BSE_UKS, including all inherited members.
| AdjustHqpSize(const Eigen::MatrixXd &Hqp_in, const Eigen::VectorXd &RPAInputEnergies, Index homo) const | votca::xtp::BSE_UKS | private |
| alpha_ctotal_ | votca::xtp::BSE_UKS | private |
| alpha_size_ | votca::xtp::BSE_UKS | private |
| alpha_vtotal_ | votca::xtp::BSE_UKS | private |
| Analyze_excitons_uks(std::vector< QMFragment< BSE_Population > > fragments, const Orbitals &orb) const | votca::xtp::BSE_UKS | |
| beta_ctotal_ | votca::xtp::BSE_UKS | private |
| beta_size_ | votca::xtp::BSE_UKS | private |
| beta_vtotal_ | votca::xtp::BSE_UKS | private |
| BSE_UKS(Logger &log, const TCMatrix_gwbse_spin &Mmn) | votca::xtp::BSE_UKS | inline |
| configure_with_precomputed_screening(const options &opt, Index homo_alpha, Index homo_beta, const Eigen::VectorXd &RPAInputEnergiesAlpha, const Eigen::VectorXd &RPAInputEnergiesBeta, const Eigen::MatrixXd &Hqp_alpha_in, const Eigen::MatrixXd &Hqp_beta_in, const Eigen::VectorXd &epsilon_0_inv, const Eigen::MatrixXd &epsilon_eigenvectors) | votca::xtp::BSE_UKS | |
| configureBSEOperator(BSE_OPERATOR &H) const | votca::xtp::BSE_UKS | private |
| epsilon_0_inv_ | votca::xtp::BSE_UKS | private |
| ExpectationValue_Operator(const Orbitals &orb, const BSE_OPERATOR &H) const | votca::xtp::BSE_UKS | private |
| ExpectationValue_Operator_State(Index state, const Orbitals &orb, const BSE_OPERATOR &H) const | votca::xtp::BSE_UKS | private |
| homo_alpha_ | votca::xtp::BSE_UKS | private |
| homo_beta_ | votca::xtp::BSE_UKS | private |
| Hqp_alpha_ | votca::xtp::BSE_UKS | private |
| Hqp_beta_ | votca::xtp::BSE_UKS | private |
| log_ | votca::xtp::BSE_UKS | private |
| Mmn_ | votca::xtp::BSE_UKS | private |
| Mmn_raw_ | votca::xtp::BSE_UKS | private |
| opt_ | votca::xtp::BSE_UKS | private |
| Perturbative_DynamicalScreening(Orbitals &orb) | votca::xtp::BSE_UKS | |
| PrintWeightsUKS(const Eigen::VectorXd &coeffs) const | votca::xtp::BSE_UKS | private |
| SetupDirectInteractionOperator(const Eigen::VectorXd &RPAInputEnergiesAlpha, const Eigen::VectorXd &RPAInputEnergiesBeta, double energy) | votca::xtp::BSE_UKS | private |
| Solve_excitons_uks(Orbitals &orb) const | votca::xtp::BSE_UKS | |
| Solve_excitons_uks_BTDA() const | votca::xtp::BSE_UKS | private |
| Solve_excitons_uks_TDA() const | votca::xtp::BSE_UKS | private |
| solve_hermitian(BSE_OPERATOR &h) const | votca::xtp::BSE_UKS | private |
| Solve_nonhermitian_Davidson(BSE_OPERATOR_A &Aop, BSE_OPERATOR_B &Bop) const | votca::xtp::BSE_UKS | private |