int get_dens_from_fock_general(int n, int noOfOccupiedOrbs, int use_diagonalization, int use_diag_if_puri_fail, ergo_real electronicTemperature, symmMatrix &resultDens, ergo_real factor, ergo_real &resultEntropyTerm, symmMatrix &Finput, intervalType &homoInterval_Finput, intervalType &lumoInterval_Finput, symmMatrix &overlapMatrix, triangMatrix const &invCholFactor, ergo_real invCholFactor_euclnorm, ergo_real gap_expected_lower_bound, mat::SizesAndBlocks const &matrixSizesAndBlocks, symmMatrix &F_ort_prev, intervalType &homoInterval_F_ort_prev, intervalType &lumoInterval_F_ort_prev, ergo_real eigvalueErrorLimit, ergo_real subspaceErrorLimit, mat::normType const truncationNormPurification, int maxMul, int create_m_files, int ignore_purification_failure, int use_rand_perturbation_for_alleigsint, std::string stats_prefix, std::map< std::string, double > &puri_stats, int do_sparsity_investigation, int sparsity_plots_resolution_m, int do_comparison_to_simple_purification, int do_puri_mmul_tests, generalVector *eigVecLUMO=0, generalVector *eigVecHOMO=0)
Definition: densfromf_general.cc:42