atomes 1.1.14
atomes: an atomic scale modeling tool box
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Functions to read Chem3d atomic coordinates. More...
#include "global.h"
#include "glview.h"
#include "callbacks.h"
#include "interface.h"
#include "project.h"
#include "bind.h"
#include <omp.h>
#include "readers.h"
Go to the source code of this file.
Functions | |
void | check_for_species (double v, int ato) |
Fill the species for each atom and the associated data. | |
int | c3d_get_atom_coordinates () |
get the atomic coordinates from the C3D file | |
int | open_c3d_file (int linec) |
open C3D file | |
Functions to read Chem3d atomic coordinates.
Definition in file read_c3d.c.
int c3d_get_atom_coordinates | ( | ) |
get the atomic coordinates from the C3D file
Definition at line 54 of file read_c3d.c.
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extern |
Fill the species for each atom and the associated data.
v | Z |
ato | the atom id |
Definition at line 194 of file read_coord.c.
int open_c3d_file | ( | int | linec | ) |
open C3D file
linec | Number of lines in the file |
Definition at line 320 of file read_c3d.c.