dipole_oct_m::dipole_t Type Reference

Detailed Description

Definition at line 123 of file dipole.F90.

Private Member Functions
procedure	init => dipole_init
procedure	calculate => dipole_calculate
	Calculate the dipole moment from the ions and the electronic states. More...
procedure	get => dipole_get
	accedd the dipole moment More...
procedure	end => dipole_end

Private Attributes
integer	dim
	dimension of the dipole moment More...
logical	periodic
	if periodic, we need to use more complex code, which is not yet implemented More...
real(real64), dimension(:), allocatable	dipole
	the total dipole moment of electrons and ions More...

Member Function/Subroutine Documentation

init()

procedure dipole_oct_m::dipole_t::init

private

Definition at line 131 of file dipole.F90.

calculate()

procedure dipole_oct_m::dipole_t::calculate

private

Calculate the dipole moment from the ions and the electronic states.

Definition at line 132 of file dipole.F90.

get()

procedure dipole_oct_m::dipole_t::get

private

accedd the dipole moment

Definition at line 133 of file dipole.F90.

end()

procedure dipole_oct_m::dipole_t::end

private

Definition at line 134 of file dipole.F90.

Member Data Documentation

dim

integer dipole_oct_m::dipole_t::dim

private

dimension of the dipole moment

Definition at line 126 of file dipole.F90.

periodic

logical dipole_oct_m::dipole_t::periodic

private

if periodic, we need to use more complex code, which is not yet implemented

Definition at line 127 of file dipole.F90.

dipole

real(real64), dimension(:), allocatable dipole_oct_m::dipole_t::dipole

private

the total dipole moment of electrons and ions

Definition at line 128 of file dipole.F90.

---

The documentation for this type was generated from the following file:

• electrons/dipole.F90