Adiag_ | votca::xtp::DavidsonSolver | private |
argsort(const Eigen::VectorXd &V) const | votca::xtp::DavidsonSolver | private |
ArrayXb typedef | votca::xtp::DavidsonSolver | private |
checkConvergence(const RitzEigenPair &rep, ProjectedSpace &proj, Index neigen) const | votca::xtp::DavidsonSolver | private |
checkOptions(Index operator_size) | votca::xtp::DavidsonSolver | private |
computeCorrectionVector(const Eigen::VectorXd &qj, double lambdaj, const Eigen::VectorXd &Aqj) const | votca::xtp::DavidsonSolver | private |
CORR enum name | votca::xtp::DavidsonSolver | private |
davidson_correction_ | votca::xtp::DavidsonSolver | private |
davidson_update_ | votca::xtp::DavidsonSolver | private |
DavidsonSolver(Logger &log) | votca::xtp::DavidsonSolver | |
DPR enum value | votca::xtp::DavidsonSolver | private |
dpr(const Eigen::VectorXd &r, double lambda) const | votca::xtp::DavidsonSolver | private |
eigenvalues() const | votca::xtp::DavidsonSolver | inline |
eigenvalues_ | votca::xtp::DavidsonSolver | private |
eigenvectors() const | votca::xtp::DavidsonSolver | inline |
eigenvectors_ | votca::xtp::DavidsonSolver | private |
extendProjection(const RitzEigenPair &rep, ProjectedSpace &proj) const | votca::xtp::DavidsonSolver | private |
extract_vectors(const Eigen::MatrixXd &V, const ArrayXl &idx) const | votca::xtp::DavidsonSolver | private |
getHarmonicRitz(const ProjectedSpace &proj) const | votca::xtp::DavidsonSolver | private |
getRitz(const ProjectedSpace &proj) const | votca::xtp::DavidsonSolver | private |
getRitzEigenPairs(const ProjectedSpace &proj) const | votca::xtp::DavidsonSolver | private |
getSizeUpdate(Index neigen) const | votca::xtp::DavidsonSolver | private |
gramschmidt(Eigen::MatrixXd &A, Index nstart) const | votca::xtp::DavidsonSolver | private |
HAM enum value | votca::xtp::DavidsonSolver | private |
i_iter_ | votca::xtp::DavidsonSolver | private |
info() const | votca::xtp::DavidsonSolver | inline |
info_ | votca::xtp::DavidsonSolver | private |
initProjectedSpace(Index neigen, Index size_initial_guess) const | votca::xtp::DavidsonSolver | private |
iter_max_ | votca::xtp::DavidsonSolver | private |
log_ | votca::xtp::DavidsonSolver | private |
MATRIX_TYPE enum name | votca::xtp::DavidsonSolver | private |
matrix_type_ | votca::xtp::DavidsonSolver | private |
MAX enum value | votca::xtp::DavidsonSolver | private |
max_search_space_ | votca::xtp::DavidsonSolver | private |
MIN enum value | votca::xtp::DavidsonSolver | private |
num_iterations() const | votca::xtp::DavidsonSolver | inline |
OLSEN enum value | votca::xtp::DavidsonSolver | private |
olsen(const Eigen::VectorXd &r, const Eigen::VectorXd &x, double lambda) const | votca::xtp::DavidsonSolver | private |
orthogonalize(Eigen::MatrixXd &V, Index nupdate) const | votca::xtp::DavidsonSolver | private |
printIterationData(const RitzEigenPair &rep, const ProjectedSpace &proj, Index neigen) const | votca::xtp::DavidsonSolver | private |
printOptions(Index operator_size) const | votca::xtp::DavidsonSolver | private |
printTiming(const std::chrono::time_point< std::chrono::system_clock > &start) const | votca::xtp::DavidsonSolver | private |
qr(const Eigen::MatrixXd &A) const | votca::xtp::DavidsonSolver | private |
restart(const RitzEigenPair &rep, ProjectedSpace &proj, Index newtestvectors) const | votca::xtp::DavidsonSolver | private |
restart_size_ | votca::xtp::DavidsonSolver | private |
SAFE enum value | votca::xtp::DavidsonSolver | private |
set_correction(std::string method) | votca::xtp::DavidsonSolver | |
set_iter_max(Index N) | votca::xtp::DavidsonSolver | inline |
set_matrix_type(std::string mt) | votca::xtp::DavidsonSolver | |
set_max_search_space(Index N) | votca::xtp::DavidsonSolver | inline |
set_size_update(std::string update_size) | votca::xtp::DavidsonSolver | |
set_tolerance(std::string tol) | votca::xtp::DavidsonSolver | |
setupInitialEigenvectors(Index size_initial_guess) const | votca::xtp::DavidsonSolver | private |
solve(const MatrixReplacement &A, Index neigen, Index size_initial_guess=0) | votca::xtp::DavidsonSolver | inline |
storeConvergedData(const RitzEigenPair &rep, Index neigen) | votca::xtp::DavidsonSolver | private |
storeEigenPairs(const RitzEigenPair &rep, Index neigen) | votca::xtp::DavidsonSolver | private |
storeNotConvergedData(const RitzEigenPair &rep, const ArrayXb &root_converged, Index neigen) | votca::xtp::DavidsonSolver | private |
SYMM enum value | votca::xtp::DavidsonSolver | private |
tol_ | votca::xtp::DavidsonSolver | private |
UPDATE enum name | votca::xtp::DavidsonSolver | private |
updateProjection(const MatrixReplacement &A, ProjectedSpace &proj) const | votca::xtp::DavidsonSolver | inlineprivate |