LCOV - code coverage report
Current view: top level - src - xas_tdp_methods.F (source / functions) Hit Total Coverage
Test: CP2K Regtests (git:4dc10b3) Lines: 1298 1522 85.3 %
Date: 2024-11-21 06:45:46 Functions: 23 25 92.0 %

Function Name Sort by function name Hit count Sort by hit count
__xas_tdp_methods_MOD_assign_mos_to_donor_state 68
__xas_tdp_methods_MOD_assign_mos_to_ex_atoms 48
__xas_tdp_methods_MOD_build_ot_spin_prec 22
__xas_tdp_methods_MOD_compute_dipole_fosc 56
__xas_tdp_methods_MOD_compute_lenrep_multipole 24
__xas_tdp_methods_MOD_compute_quadrupole_fosc 0
__xas_tdp_methods_MOD_diagonalize_assigned_mo_subset 32
__xas_tdp_methods_MOD_find_mo_centers 80
__xas_tdp_methods_MOD_get_ri_3c_batches 52
__xas_tdp_methods_MOD_make_lumo_guess 20
__xas_tdp_methods_MOD_perform_mulliken_on_donor_state 68
__xas_tdp_methods_MOD_print_checks 0
__xas_tdp_methods_MOD_print_info 48
__xas_tdp_methods_MOD_print_xas_tdp_to_file 56
__xas_tdp_methods_MOD_print_xps 30
__xas_tdp_methods_MOD_read_donor_state_restart 2
__xas_tdp_methods_MOD_reinit_qs_loc_env 80
__xas_tdp_methods_MOD_restart_calculation 2
__xas_tdp_methods_MOD_safety_check 48
__xas_tdp_methods_MOD_write_donor_state_restart 60
__xas_tdp_methods_MOD_write_mos_to_ex_atoms_association 48
__xas_tdp_methods_MOD_xas_tdp 50
__xas_tdp_methods_MOD_xas_tdp_core 48
__xas_tdp_methods_MOD_xas_tdp_init 48
__xas_tdp_methods_MOD_xas_tdp_post 62

Generated by: LCOV version 1.15