qs_tddfpt2_fhxc_forces.F File Reference

#include "./base/base_uses.f90"

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Modules
module	qs_tddfpt2_fhxc_forces

Functions/Subroutines
subroutine, public	qs_tddfpt2_fhxc_forces::fhxc_force (qs_env, ex_env, gs_mos, full_kernel, debug_forces)
	Calculate direct tddft forces.
subroutine, public	qs_tddfpt2_fhxc_forces::stda_force (qs_env, ex_env, gs_mos, stda_env, sub_env, work, debug_forces)
	Simplified Tamm Dancoff approach (sTDA). Kernel contribution to forces.