semi_empirical_mpole_types.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Data Types
type	semi_empirical_mpole_types::semi_empirical_mpole_type
	Semi-empirical integral multipole expansion type. More...
type	semi_empirical_mpole_types::semi_empirical_mpole_p_type
	Semi-empirical integral multipole expansion type - pointer type. More...
type	semi_empirical_mpole_types::nddo_mpole_type
	Global Multipolar NDDO information type. More...

Modules
module	semi_empirical_mpole_types
	Definition of the semi empirical multipole integral expansions types.

Functions/Subroutines
subroutine, public	semi_empirical_mpole_types::semi_empirical_mpole_p_create (mpole, ndim)
	Allocate semi-empirical mpole type.
subroutine, public	semi_empirical_mpole_types::semi_empirical_mpole_p_release (mpole)
	Deallocate the semi-empirical mpole type.
subroutine, public	semi_empirical_mpole_types::nddo_mpole_create (nddo_mpole)
	Allocate NDDO multipole type.
subroutine, public	semi_empirical_mpole_types::nddo_mpole_release (nddo_mpole)
	Deallocate NDDO multipole type.