xc_derivative_desc.F File Reference

#include "../base/base_uses.f90"

Go to the source code of this file.

Modules
module	xc_derivative_desc
	Module with functions to handle derivative descriptors. derivative description are strings have the following form "rhorhorhoa" which means that it is a forth order derivative, twice with respect to rho, once with respect to rhoa and once with respect to drhoa. Possible derivatives are:

Functions/Subroutines
integer function, public	xc_derivative_desc::desc_to_id (desc)
	... More...
character(len=max_label_length) function, public	xc_derivative_desc::id_to_desc (id)
	... More...
subroutine, public	xc_derivative_desc::create_split_desc (desc, split_desc)
	... More...
subroutine, public	xc_derivative_desc::standardize_desc (desc, split_desc)
	... More...

Variables
integer, parameter, public	xc_derivative_desc::deriv_rho = 1
integer, parameter, public	xc_derivative_desc::deriv_rhoa = 2
integer, parameter, public	xc_derivative_desc::deriv_rhob = 3
integer, parameter, public	xc_derivative_desc::deriv_norm_drho = 4
integer, parameter, public	xc_derivative_desc::deriv_norm_drhoa = 5
integer, parameter, public	xc_derivative_desc::deriv_norm_drhob = 6
integer, parameter, public	xc_derivative_desc::deriv_tau = 7
integer, parameter, public	xc_derivative_desc::deriv_tau_a = 8
integer, parameter, public	xc_derivative_desc::deriv_tau_b = 9
integer, parameter, public	xc_derivative_desc::deriv_laplace_rho = 10
integer, parameter, public	xc_derivative_desc::deriv_laplace_rhoa = 11
integer, parameter, public	xc_derivative_desc::deriv_laplace_rhob = 12