input_cp2k_mm.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	input_cp2k_mm
	creates the mm section of the input

Functions/Subroutines
subroutine, public	input_cp2k_mm::create_mm_section (section)
	Create the input section for FIST.. Come on.. Let's get woohooo. More...
subroutine, public	input_cp2k_mm::create_charge_section (section)
	This section specifies the charge of the MM atoms. More...
subroutine, public	input_cp2k_mm::create_nonbonded14_section (section)
	This section specifies the input parameters for 1-4 NON-BONDED Interactions. More...
subroutine, public	input_cp2k_mm::create_neighbor_lists_section (section)
	This section specifies the input parameters for generation of neighbor lists. More...
subroutine, public	input_cp2k_mm::create_genpot_section (section)
	This section specifies the input parameters for a generic potential form. More...
subroutine, public	input_cp2k_mm::create_lj_section (section)
	This section specifies the input parameters for Lennard-Jones potential type. More...
subroutine, public	input_cp2k_mm::create_williams_section (section)
	This section specifies the input parameters for Williams potential type. More...
subroutine, public	input_cp2k_mm::create_goodwin_section (section)
	This section specifies the input parameters for Goodwin potential type. More...
subroutine, public	input_cp2k_mm::create_tabpot_section (section)
	This section specifies the input parameters for TABPOT potential type. More...
subroutine, public	input_cp2k_mm::create_dipoles_section (print_key, label, print_level)
	creates the input section for the qs part More...