tmc_analysis_types.F File Reference

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

Go to the source code of this file.

Data Types
type	tmc_analysis_types::tmc_ana_list_type
type	tmc_analysis_types::tmc_analysis_env
type	tmc_analysis_types::pair_correl_type
type	tmc_analysis_types::atom_pairs_type
type	tmc_analysis_types::dipole_moment_type

Modules
module	tmc_analysis_types
	module provides variables for the TMC analysis tool

Functions/Subroutines
subroutine, public	tmc_analysis_types::tmc_ana_env_create (tmc_ana)
	creates a new structure environment for TMC analysis
subroutine, public	tmc_analysis_types::tmc_ana_env_release (tmc_ana)
	releases the structure environment for TMC analysis
subroutine, public	tmc_analysis_types::tmc_ana_density_create (ana_dens, nr_bins)
	creates a new structure environment for TMC analysis
subroutine, public	tmc_analysis_types::tmc_ana_pair_correl_create (ana_pair_correl, nr_bins)
	creates a new structure environment for TMC analysis
integer function, public	tmc_analysis_types::search_pair_in_list (pair_list, n1, n2, list_end)
	search the pair of two atom types in list
subroutine, public	tmc_analysis_types::tmc_ana_dipole_moment_create (ana_dip_mom, charge_atm, charge, dim_per_elem)
	creates a new structure environment for TMC analysis
subroutine, public	tmc_analysis_types::tmc_ana_dipole_analysis_create (ana_dip_ana)
	creates a new structure environment for TMC analysis
subroutine, public	tmc_analysis_types::tmc_ana_displacement_create (ana_disp, dim_per_elem)
	creates a new structure environment for TMC analysis

Variables
character(len=default_path_length), parameter, public	tmc_analysis_types::tmc_ana_density_file_name = "tmc_ana_density.dat"
character(len=default_path_length), parameter, public	tmc_analysis_types::tmc_ana_pair_correl_file_name = "tmc_ana_g_r.dat"
integer, parameter, public	tmc_analysis_types::ana_type_default = 0
integer, parameter, public	tmc_analysis_types::ana_type_ice = 1
integer, parameter, public	tmc_analysis_types::ana_type_sym_xyz = 2