fix_srp.h
No OneTemporary
Actions

Subscribers

None

File Metadata

	/* -- 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 FIX_CLASS

	FixStyle(SRP,FixSRP)

	#else

	#ifndef LMP_FIX_SRP_H
	#define LMP_FIX_SRP_H

	#include <stdio.h>
	#include "fix.h"

	namespace LAMMPS_NS {

	class FixSRP : public Fix {
	public:
	FixSRP(class LAMMPS , int, char *);
	~FixSRP();
	int setmask();
	void init();

	void pre_exchange();
	void setup_pre_force(int);

	double memory_usage();
	void grow_arrays(int);
	void copy_arrays(int, int, int);
	void set_arrays(int);
	int pack_exchange(int, double *);
	int unpack_exchange(int, double *);
	int pack_border(int, int , double );
	int unpack_border(int, int, double *);
	void post_run();

	int pack_restart(int, double*);
	void unpack_restart(int, int);
	int maxsize_restart();
	int size_restart(int);
	void write_restart(FILE *);
	void restart(char *);
	int modify_param(int, char **);

	double **array;

	private:
	int btype;
	int bptype;
	};

	}

	#endif
	#endif

	/* ERROR/WARNING messages:

	*/