qs_energy_init.F File Reference

#include "./base/base_uses.f90"

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Modules
module	qs_energy_init
	Utility subroutine for qs energy calculation.

Functions/Subroutines
subroutine, public	qs_energy_init::qs_energies_init (qs_env, calc_forces)
	Refactoring of qs_energies_scf. Driver routine for the initial setup and calculations for a qs energy calculation.