ps_hgh.F90 File Reference

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Modules
module	ps_hgh_oct_m

Data Types
type	ps_hgh_oct_m::ps_hgh_t
	The following data type contains: (a) the pseudopotential parameters, as read from a *.hgh file, (b) auxiliary intermediate functions, to store stuff before passing it to the "ps" variable. More...

Functions/Subroutines
subroutine, public	ps_hgh_oct_m::hgh_init (psp, filename, namespace)
subroutine, public	ps_hgh_oct_m::hgh_end (psp)
subroutine, public	ps_hgh_oct_m::hgh_process (psp, namespace)
subroutine, public	ps_hgh_oct_m::hgh_get_eigen (psp, eigen)
integer function	ps_hgh_oct_m::load_params (unit, params, namespace)
subroutine	ps_hgh_oct_m::get_cutoff_radii (psp)
subroutine	ps_hgh_oct_m::vlocalr_scalar (r, np, p, vloc)
subroutine	ps_hgh_oct_m::projectorr_scalar (r, np, p, i, l, proj)
subroutine	ps_hgh_oct_m::solve_schroedinger (psp, ierr, namespace)
subroutine, public	ps_hgh_oct_m::hgh_debug (psp, dir, namespace)

Variables
real(real64), parameter	ps_hgh_oct_m::eps = 1.0e-8_real64