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read_dump_xyz.h
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read_dump_xyz.h

/* -*- c++ -*- ----------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
Copyright (2003) Sandia Corporation. Under the terms of Contract
DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
certain rights in this software. This software is distributed under
the GNU General Public License.
See the README file in the top-level LAMMPS directory.
Contributed by Timothy Sirk
------------------------------------------------------------------------- */
#ifndef LMP_READ_DUMP_XYZ_H
#define LMP_READ_DUMP_XYZ_H
#include "stdio.h"
#include "pointers.h"
namespace LAMMPS_NS {
class ReadDumpXYZ : protected Pointers {
public:
ReadDumpXYZ(class LAMMPS *);
~ReadDumpXYZ();
void file(FILE *);
int read_time(bigint &);
void skip();
bigint read_header(double [3][3], int &, int, int, int *, char **,
int, int &, int &, int &, int &);
void read_atoms(int, int, double **);
private:
FILE *fp; // pointer to file opened by caller
char *line; // line read from dump file
bigint nstep; // current (time) step number
bigint natoms; // current number of atoms
bigint nid; // current atom id.
int *fieldindex; // mapping of input fields to dump
void read_lines(int);
};
}
#endif

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