lammps-sys 0.6.0

Generates bindings to LAMMPS' C interface (with optional builds from source)
Documentation
/* -*- 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(eam/opt,PairEAMOpt)

#else

#ifndef LMP_PAIR_EAM_OPT_H
#define LMP_PAIR_EAM_OPT_H

#include "pair_eam.h"

namespace LAMMPS_NS {

// use virtual public since this class is parent in multiple inheritance

class PairEAMOpt : virtual public PairEAM {
 public:
  PairEAMOpt(class LAMMPS *);
  virtual ~PairEAMOpt() {}
  void compute(int, int);

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

}

#endif
#endif