pao_input.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	pao_input

Functions/Subroutines
subroutine, public	pao_input::parse_pao_section (pao, input)
	Declare the PAO input section.
character(len=20) function, public	pao_input::id2str (id)
	Helper routine.
subroutine, public	pao_input::create_pao_section (section)
	Creates the PAO subsection of the linear scaling section.

Variables
integer, parameter, public	pao_input::pao_rotinv_param = 101
integer, parameter, public	pao_input::pao_fock_param = 102
integer, parameter, public	pao_input::pao_exp_param = 103
integer, parameter, public	pao_input::pao_gth_param = 104
integer, parameter, public	pao_input::pao_equi_param = 105
integer, parameter, public	pao_input::pao_opt_cg = 301
integer, parameter, public	pao_input::pao_opt_bfgs = 302
integer, parameter, public	pao_input::pao_ml_gp = 401
integer, parameter, public	pao_input::pao_ml_nn = 402
integer, parameter, public	pao_input::pao_ml_lazy = 403
integer, parameter, public	pao_input::pao_ml_prior_zero = 501
integer, parameter, public	pao_input::pao_ml_prior_mean = 502
integer, parameter, public	pao_input::pao_ml_desc_pot = 601
integer, parameter, public	pao_input::pao_ml_desc_overlap = 602
integer, parameter, public	pao_input::pao_ml_desc_r12 = 603