xtb_ehess_force.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	xtb_ehess_force
	Calculation of forces for Coulomb contributions in response xTB.

Functions/Subroutines
subroutine, public	xtb_ehess_force::calc_xtb_ehess_force (qs_env, matrix_p0, matrix_p1, charges0, mcharge0, charges1, mcharge1, debug_forces)
	...