atomes 1.1.14
atomes: an atomic scale modeling tool box
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read_vas.c File Reference

Functions to read VASP 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"
+ Include dependency graph for read_vas.c:

Go to the source code of this file.

Functions

int vas_get_atom_coordinates (int sli)
 get the atomic coordinates from the VASP file
 
int open_vas_file (int linec)
 open VASP file
 

Detailed Description

Functions to read VASP atomic coordinates.

Author
Sébastien Le Roux sebas.nosp@m.tien.nosp@m..lero.nosp@m.ux@i.nosp@m.pcms..nosp@m.unis.nosp@m.tra.f.nosp@m.r

Definition in file read_vas.c.

Function Documentation

◆ open_vas_file()

int open_vas_file ( int linec)

open VASP file

Parameters
linecNumber of lines in the file

Definition at line 242 of file read_vas.c.

◆ vas_get_atom_coordinates()

int vas_get_atom_coordinates ( int sli)

get the atomic coordinates from the VASP file

Parameters
sliCorrection parameters depending on the VASP file version

Definition at line 54 of file read_vas.c.