common_obj_gbl Module Reference

Data Types
module	darray_1d
	1D array of reals More...
type	darray_2d
type	ecp_obj
module	iarray_1d
	1D array of integers More...
module	nucleus_type
interface	resize_array

Functions/Subroutines
subroutine	print_orbital_table (energies, num_sym, n_orbs, n_sym, convert_to_ev, print_level)
integer function	init_darray_2d (this)
integer function	final_darray_2d (this)
subroutine	read_ecp_nml (this, lunit)
subroutine	write_ecp (this, lunit, posit)
subroutine	read_ecp (this, lunit, posit)
subroutine	mpi_ecp_bcast (this)
subroutine	eval_local_ecp (this, r, local_ecp)
subroutine	eval_semi_local_ecp (this, r, semi_local_ecp)
subroutine	eval_SO_ecp (this, r, so_ecp)
integer function	resize_2d_array_cfp (array, d1, d2)
integer function	resize_3d_array_cfp (array, d1, d2, d3)
integer function	resize_2d_array_int (array, d1, d2)
integer function	resize_3d_array_int (array, d1, d2, d3)
subroutine	resize_copy_2d_array (array, d1, d2)

Function/Subroutine Documentation

eval_local_ecp()

subroutine common_obj_gbl::eval_local_ecp	(	class(ecp_obj)	this,
		real(kind=cfp), dimension(:), intent(in)	r,
		real(kind=cfp), dimension(:), allocatable	local_ecp )

eval_semi_local_ecp()

subroutine common_obj_gbl::eval_semi_local_ecp	(	class(ecp_obj)	this,
		real(kind=cfp), dimension(:), intent(in)	r,
		real(kind=cfp), dimension(:,:), allocatable	semi_local_ecp )

eval_SO_ecp()

subroutine common_obj_gbl::eval_SO_ecp	(	class(ecp_obj)	this,
		real(kind=cfp), dimension(:), intent(in)	r,
		real(kind=cfp), dimension(:,:), allocatable	so_ecp )

final_darray_2d()

integer function common_obj_gbl::final_darray_2d

(

class(darray_2d)

this

)

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init_darray_2d()

integer function common_obj_gbl::init_darray_2d

(

class(darray_2d)

this

)

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mpi_ecp_bcast()

subroutine common_obj_gbl::mpi_ecp_bcast

(

class(ecp_obj)

this

)

print_orbital_table()

subroutine common_obj_gbl::print_orbital_table	(	real(kind=cfp), dimension(n_orbs)	energies,
		integer, dimension(2,n_orbs), intent(in)	num_sym,
		integer, intent(in)	n_orbs,
		integer, intent(in)	n_sym,
		logical, intent(in)	convert_to_ev,
		integer, intent(in)	print_level )

read_ecp()

subroutine common_obj_gbl::read_ecp	(	class(ecp_obj)	this,
		integer, intent(in)	lunit,
		integer, intent(in)	posit )

read_ecp_nml()

subroutine common_obj_gbl::read_ecp_nml	(	class(ecp_obj)	this,
		integer, intent(in)	lunit )

resize_2d_array_cfp()

integer function common_obj_gbl::resize_2d_array_cfp	(	real(kind=cfp), dimension(:,:), allocatable	array,
		integer, intent(in)	d1,
		integer, intent(in)	d2 )

resize_2d_array_int()

integer function common_obj_gbl::resize_2d_array_int	(	integer, dimension(:,:), allocatable	array,
		integer, intent(in)	d1,
		integer, intent(in)	d2 )

resize_3d_array_cfp()

integer function common_obj_gbl::resize_3d_array_cfp	(	real(kind=cfp), dimension(:,:,:), allocatable	array,
		integer, intent(in)	d1,
		integer, intent(in)	d2,
		integer, intent(in)	d3 )

resize_3d_array_int()

integer function common_obj_gbl::resize_3d_array_int	(	integer, dimension(:,:,:), allocatable	array,
		integer, intent(in)	d1,
		integer, intent(in)	d2,
		integer, intent(in)	d3 )

resize_copy_2d_array()

subroutine common_obj_gbl::resize_copy_2d_array	(	real(kind=cfp), dimension(:,:), allocatable	array,
		integer, intent(in)	d1,
		integer, intent(in)	d2 )

write_ecp()

subroutine common_obj_gbl::write_ecp	(	class(ecp_obj)	this,
		integer, intent(in)	lunit,
		integer, intent(in)	posit )