votca 2026-dev
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votca::xtp::RPA_UKS Member List

This is the complete list of members for votca::xtp::RPA_UKS, including all inherited members.

BuildCachedScreeningModes() constvotca::xtp::RPA_UKSprivate
calculate_epsilon(double frequency) constvotca::xtp::RPA_UKSprivate
calculate_epsilon_i(double frequency) constvotca::xtp::RPA_UKSinline
calculate_epsilon_r(double frequency) constvotca::xtp::RPA_UKSinline
calculate_epsilon_r(std::complex< double > frequency) constvotca::xtp::RPA_UKS
Calculate_H2p_AmB() constvotca::xtp::RPA_UKSprivate
Calculate_H2p_ApB() constvotca::xtp::RPA_UKSprivate
configure(Index homo_alpha, Index homo_beta, Index rpamin, Index rpamax)votca::xtp::RPA_UKSinline
Diagonalize_H2p() constvotca::xtp::RPA_UKS
Diagonalize_H2p_C(const Eigen::MatrixXd &C) constvotca::xtp::RPA_UKSprivate
energies_alpha_votca::xtp::RPA_UKSprivate
energies_beta_votca::xtp::RPA_UKSprivate
eta_votca::xtp::RPA_UKSprivate
GetCachedScreeningModes(const Eigen::VectorXd *&omegas, const std::vector< Eigen::VectorXd > *&modes) constvotca::xtp::RPA_UKS
getEta() constvotca::xtp::RPA_UKSinline
getHomoAlpha() constvotca::xtp::RPA_UKSinline
getHomoBeta() constvotca::xtp::RPA_UKSinline
getMaxCorrection(const Eigen::VectorXd &energies, const Eigen::VectorXd &dftenergies, Index min, Index max) constvotca::xtp::RPA_UKSprivate
getRPAInputEnergiesAlpha() constvotca::xtp::RPA_UKSinline
getRPAInputEnergiesBeta() constvotca::xtp::RPA_UKSinline
h2p_cached_votca::xtp::RPA_UKSmutableprivate
h2p_solution_cache_votca::xtp::RPA_UKSmutableprivate
homo_alpha_votca::xtp::RPA_UKSprivate
homo_beta_votca::xtp::RPA_UKSprivate
InvalidateH2pCache()votca::xtp::RPA_UKSprivate
log_votca::xtp::RPA_UKSprivate
Mmn_votca::xtp::RPA_UKSprivate
RPA_UKS(Logger &log, const TCMatrix_gwbse_spin &Mmn)votca::xtp::RPA_UKSinline
rpamax_votca::xtp::RPA_UKSprivate
rpamin_votca::xtp::RPA_UKSprivate
screening_cached_votca::xtp::RPA_UKSmutableprivate
screening_modes_votca::xtp::RPA_UKSmutableprivate
screening_omegas_votca::xtp::RPA_UKSmutableprivate
setRPAInputEnergies(const Eigen::VectorXd &rpaenergies_alpha, const Eigen::VectorXd &rpaenergies_beta)votca::xtp::RPA_UKSinline
ShiftUncorrectedEnergies(Eigen::VectorXd &energies, const Eigen::VectorXd &dftenergies, Index homo, Index qpmin, Index gwsize)votca::xtp::RPA_UKSprivate
UpdateRPAInputEnergies(const Eigen::VectorXd &dftenergies_alpha, const Eigen::VectorXd &dftenergies_beta, const Eigen::VectorXd &gwaenergies_alpha, const Eigen::VectorXd &gwaenergies_beta, Index qpmin)votca::xtp::RPA_UKS