qs_localizer_torus.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	qs_localizer_torus
	Full Born-von-Karman AO operators at a frozen SCF potential.

Functions/Subroutines
subroutine, public	qs_localizer_torus::localizer_torus_operators (qs_env, grid, directions, do_soc, h, s, cosines, sines, soc)
	Lift scalar image operators and ordered Berry integrals to a full real-cell torus.
subroutine, public	qs_localizer_torus::torus_translation_operators (qs_env, grid, shifts, do_soc, h, s, translations, soc)
	Full AO torus with translated, periodized Gaussians instead of position coordinates.