Files
lammps/examples/plugins/improper_zero2.h
2021-05-24 16:19:37 -04:00

54 lines
1.3 KiB
C++

/* -*- c++ -*- ----------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
https://www.lammps.org/ 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.
------------------------------------------------------------------------- */
#ifndef LMP_IMPROPER_ZERO2_H
#define LMP_IMPROPER_ZERO2_H
#include "improper.h"
namespace LAMMPS_NS {
class ImproperZero2 : public Improper {
public:
ImproperZero2(class LAMMPS *);
virtual ~ImproperZero2();
virtual void compute(int, int);
virtual void coeff(int, char **);
virtual void settings(int, char **);
void write_restart(FILE *);
void read_restart(FILE *);
void write_data(FILE *);
protected:
int coeffflag;
virtual void allocate();
};
} // namespace LAMMPS_NS
#endif
/* ERROR/WARNING messages:
E: Illegal ... command
UNDOCUMENTED
E: Incorrect args for improper coefficients
Self-explanatory. Check the input script or data file.
*/