orbitalbasis_oct_m Module Reference

Data Types
type	orbitalbasis_t

Functions/Subroutines
subroutine, public	orbitalbasis_init (this, namespace, periodic_dim)
subroutine, public	orbitalbasis_end (this)
subroutine, public	dorbitalbasis_build (this, namespace, ions, mesh, kpt, ndim, skip_s_orb, use_all_orb, verbose)
	This routine is an interface for constructing the orbital basis. More...
subroutine, public	dorbitalbasis_build_empty (this, mesh, kpt, ndim, norbsets, map_os, verbose)
	This routine constructd an empty orbital basis. More...
subroutine, public	zorbitalbasis_build (this, namespace, ions, mesh, kpt, ndim, skip_s_orb, use_all_orb, verbose)
	This routine is an interface for constructing the orbital basis. More...
subroutine, public	zorbitalbasis_build_empty (this, mesh, kpt, ndim, norbsets, map_os, verbose)
	This routine constructd an empty orbital basis. More...

Function/Subroutine Documentation

orbitalbasis_init()

subroutine, public orbitalbasis_oct_m::orbitalbasis_init	(	type(orbitalbasis_t), intent(inout)	this,
		type(namespace_t), intent(in)	namespace,
		integer, intent(in)	periodic_dim
	)

Definition at line 174 of file orbitalbasis.F90.

orbitalbasis_end()

subroutine, public orbitalbasis_oct_m::orbitalbasis_end

(

type(orbitalbasis_t), intent(inout)

this

)

Definition at line 273 of file orbitalbasis.F90.

dorbitalbasis_build()

subroutine, public orbitalbasis_oct_m::dorbitalbasis_build	(	type(orbitalbasis_t), intent(inout), target	this,
		type(namespace_t), intent(in)	namespace,
		type(ions_t), intent(in), target	ions,
		class(mesh_t), intent(in)	mesh,
		type(distributed_t), intent(in)	kpt,
		integer, intent(in)	ndim,
		logical, intent(in)	skip_s_orb,
		logical, intent(in)	use_all_orb,
		logical, intent(in), optional	verbose
	)

This routine is an interface for constructing the orbital basis.

Definition at line 360 of file orbitalbasis.F90.

dorbitalbasis_build_empty()

subroutine, public orbitalbasis_oct_m::dorbitalbasis_build_empty	(	type(orbitalbasis_t), intent(inout), target	this,
		class(mesh_t), intent(in), target	mesh,
		type(distributed_t), intent(in)	kpt,
		integer, intent(in)	ndim,
		integer, intent(in)	norbsets,
		integer, dimension(:), intent(in)	map_os,
		logical, intent(in), optional	verbose
	)

This routine constructd an empty orbital basis.

Definition at line 748 of file orbitalbasis.F90.

zorbitalbasis_build()

subroutine, public orbitalbasis_oct_m::zorbitalbasis_build	(	type(orbitalbasis_t), intent(inout), target	this,
		type(namespace_t), intent(in)	namespace,
		type(ions_t), intent(in), target	ions,
		class(mesh_t), intent(in)	mesh,
		type(distributed_t), intent(in)	kpt,
		integer, intent(in)	ndim,
		logical, intent(in)	skip_s_orb,
		logical, intent(in)	use_all_orb,
		logical, intent(in), optional	verbose
	)

This routine is an interface for constructing the orbital basis.

Definition at line 897 of file orbitalbasis.F90.

zorbitalbasis_build_empty()

subroutine, public orbitalbasis_oct_m::zorbitalbasis_build_empty	(	type(orbitalbasis_t), intent(inout), target	this,
		class(mesh_t), intent(in), target	mesh,
		type(distributed_t), intent(in)	kpt,
		integer, intent(in)	ndim,
		integer, intent(in)	norbsets,
		integer, dimension(:), intent(in)	map_os,
		logical, intent(in), optional	verbose
	)

This routine constructd an empty orbital basis.

Definition at line 1310 of file orbitalbasis.F90.