Functions/Subroutines
subroutine, public	dg_pme_grid_setup (b_cell_hmat, npts_s, cutoff_radius, grid_s, grid_b, grid_ref, rs_dims, iounit, fft_usage)
	... More...

subroutine, public	dg_grid_change (b_cell_hmat, grid_b, grid_s)
	... More...

subroutine, public	dg_get_strucfac (cell_hmat, r, npts_s, npts_b, centre, lb, ex, ey, ez)
	... More...

Detailed Description

History: JGH (15-Mar-2001) : Update small grid when cell changes with dg_grid_change

Function/Subroutine Documentation

subroutine, public dgs::dg_pme_grid_setup	(	real(kind=dp), dimension(3, 3), intent(in)	b_cell_hmat,
		integer, dimension(:), intent(in)	npts_s,
		real(kind=dp), intent(in)	cutoff_radius,
		type(pw_grid_type), pointer	grid_s,
		type(pw_grid_type), pointer	grid_b,
		type(pw_grid_type), intent(in), optional	grid_ref,
		integer, dimension(2), intent(in), optional	rs_dims,
		integer, intent(in), optional	iounit,
		logical, intent(in), optional	fft_usage
	)

...

Parameters

Definition at line 92 of file dgs.F.

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subroutine, public dgs::dg_grid_change	(	real(kind=dp), dimension(3, 3), intent(in)	b_cell_hmat,
		type(pw_grid_type), pointer	grid_b,
		type(pw_grid_type), pointer	grid_s
	)

...

Parameters

Definition at line 243 of file dgs.F.

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subroutine, public dgs::dg_get_strucfac	(	real(kind=dp), dimension(3, 3), intent(in)	cell_hmat,
		real(kind=dp), dimension(:), intent(in)	r,
		integer, dimension(:), intent(in)	npts_s,
		integer, dimension(:), intent(in)	npts_b,
		integer, dimension(3), intent(out)	centre,
		integer, dimension(3), intent(in)	lb,
		complex(kind=dp), dimension(lb(1):), intent(out)	ex,
		complex(kind=dp), dimension(lb(2):), intent(out)	ey,
		complex(kind=dp), dimension(lb(3):), intent(out)	ez
	)

...

Parameters

Definition at line 331 of file dgs.F.

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