pair_morse_opt.h
0f4a27ad8bablammm-master-deprecated

pair_morse_opt.h
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			/* -- 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 PAIR_CLASS

			PairStyle(morse/opt,PairMorseOpt)

			#else

			#ifndef LMP_PAIR_MORSE_OPT_H
			#define LMP_PAIR_MORSE_OPT_H

			#include "pair_morse.h"

			namespace LAMMPS_NS {

			class PairMorseOpt : public PairMorse {
			public:
			PairMorseOpt(class LAMMPS *);
			void compute(int, int);

			private:
			template < int EVFLAG, int EFLAG, int NEWTON_PAIR > void eval();
			};

			}

			#endif
			#endif