lammps/src/dump_xyz.h

44 lines
1014 B
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.
------------------------------------------------------------------------- */
#ifdef DUMP_CLASS
DumpStyle(xyz,DumpXYZ)
#else
#ifndef LMP_DUMP_XYZ_H
#define LMP_DUMP_XYZ_H
#include "dump.h"
namespace LAMMPS_NS {
class DumpXYZ : public Dump {
public:
DumpXYZ(class LAMMPS *, int, char**);
~DumpXYZ() {}
private:
void init_style();
void write_header(bigint);
int count();
void pack(int *);
void write_data(int, double *);
};
}
#endif
#endif