atom_grb Module Reference

Data Types
type	basis_p_type

Functions/Subroutines
subroutine, public	atom_grb_construction (atom_info, atom_section, iw)
	Construct geometrical response basis set.

Function/Subroutine Documentation

atom_grb_construction()

subroutine, public atom_grb::atom_grb_construction	(	type(atom_p_type), dimension(:, :), pointer	atom_info,
		type(section_vals_type), pointer	atom_section,
		integer, intent(in)	iw )

Construct geometrical response basis set.

Parameters

atom_info	information about the atomic kind. Two-dimensional array of size (electronic-configuration, electronic-structure-method)
atom_section	ATOM input section
iw	output file unit

History

• 11.2016 created [Juerg Hutter]

Definition at line 76 of file atom_grb.F.

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