soft_basis_set Module Reference

Functions/Subroutines
subroutine, public	create_soft_basis (orb_basis, soft_basis, eps_fit, rc, paw_atom, paw_type_forced, gpw_r3d_rs_type_forced)
	create the soft basis from a GTO basis More...

Detailed Description

History

none

Author

MI (08.01.2004)

Function/Subroutine Documentation

create_soft_basis()

subroutine, public soft_basis_set::create_soft_basis	(	type(gto_basis_set_type), pointer	orb_basis,
		type(gto_basis_set_type), pointer	soft_basis,
		real(dp), intent(in)	eps_fit,
		real(dp), intent(in)	rc,
		logical, intent(out)	paw_atom,
		logical, intent(in)	paw_type_forced,
		logical, intent(in)	gpw_r3d_rs_type_forced
	)

create the soft basis from a GTO basis

Parameters

orb_basis	...
soft_basis	...
eps_fit	...
rc	...
paw_atom	...
paw_type_forced	...
gpw_r3d_rs_type_forced	...

Version

1.0

Definition at line 59 of file soft_basis_set.F.

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