qs_active_space_utils.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	qs_active_space_utils
	Contains utility routines for the active space module.

Functions/Subroutines
subroutine, public	qs_active_space_utils::subspace_matrix_to_array (source_matrix, target_array, row_index, col_index)
	Copy a (square portion) of a cp_fm_type matrix to a standard 1D Fortran array.
subroutine, public	qs_active_space_utils::eri_to_array (eri_env, array, active_orbitals, spin1, spin2)
	Copy the eri tensor for spins isp1 and isp2 to a standard 1D Fortran array.