dos_oct_m Module Reference

Module that handles computing and output of various density of states. More...

Detailed Description

Module that handles computing and output of various density of states.

Data Types
type	dos_t

Functions/Subroutines
subroutine, public	dos_init (this, namespace, st, kpoints)
	Initializes the dot_t object. More...
subroutine	dos_end (this)
	Finalizer for the dos_t object. More...
subroutine, public	dos_write_dos (this, dir, st, box, ions, mesh, hm, namespace)
	Computes and output the DOS and the projected DOS (PDOS) More...
subroutine, public	dos_write_jdos (this, dir, st, box, ions, mesh, hm, namespace)
	Computes and output the joint DOS (LDOS) More...
subroutine, public	dos_write_ldos (this, dir, st, box, ions, mesh, how, namespace)
	Computes and output the local DOS (LDOS) More...

Function/Subroutine Documentation

dos_init()

subroutine, public dos_oct_m::dos_init	(	type(dos_t), intent(out)	this,
		type(namespace_t), intent(in)	namespace,
		type(states_elec_t), intent(in)	st,
		type(kpoints_t), intent(in)	kpoints
	)

Initializes the dot_t object.

Definition at line 179 of file dos.F90.

dos_end()

subroutine dos_oct_m::dos_end ( type(dos_t), intent(inout)  this )

private

Finalizer for the dos_t object.

Definition at line 284 of file dos.F90.

dos_write_dos()

subroutine, public dos_oct_m::dos_write_dos	(	type(dos_t), intent(in)	this,
		character(len=*), intent(in)	dir,
		type(states_elec_t), intent(in)	st,
		class(box_t), intent(in)	box,
		type(ions_t), intent(in), target	ions,
		class(mesh_t), intent(in)	mesh,
		type(hamiltonian_elec_t), intent(in)	hm,
		type(namespace_t), intent(in)	namespace
	)

Computes and output the DOS and the projected DOS (PDOS)

Definition at line 297 of file dos.F90.

dos_write_jdos()

subroutine, public dos_oct_m::dos_write_jdos	(	type(dos_t), intent(in)	this,
		character(len=*), intent(in)	dir,
		type(states_elec_t), intent(in)	st,
		class(box_t), intent(in)	box,
		type(ions_t), intent(in), target	ions,
		class(mesh_t), intent(in)	mesh,
		type(hamiltonian_elec_t), intent(in)	hm,
		type(namespace_t), intent(in)	namespace
	)

Computes and output the joint DOS (LDOS)

Definition at line 620 of file dos.F90.

dos_write_ldos()

subroutine, public dos_oct_m::dos_write_ldos	(	type(dos_t), intent(in)	this,
		character(len=*), intent(in)	dir,
		type(states_elec_t), intent(in)	st,
		class(box_t), intent(in)	box,
		type(ions_t), intent(in), target	ions,
		class(mesh_t), intent(in)	mesh,
		integer(int64), intent(in)	how,
		type(namespace_t), intent(in)	namespace
	)

Computes and output the local DOS (LDOS)

Definition at line 714 of file dos.F90.