/* ----------------------------------------------------------------------
   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.
------------------------------------------------------------------------- */

#ifndef COMPUTE_SW_TEST_H
#define COMPUTE_SW_TEST_H

#include "compute.h"

namespace LAMMPS_NS {

class ComputeSWTest : public Compute {
 public:
  ComputeSWTest(class LAMMPS *, int, char **);
  ~ComputeSWTest();
  void init();
  int pack_reverse_comm(int, int, double *);
  void unpack_reverse_comm(int, int *, double *);
  
void compute_vector();

 private:
  int nmax;
  double* energy1;
  int *map; 			// mapping fom atom types to elements 
  char **elements;             // names of unique elements
  int ***elem2param;           // mapping from element triplets to parameters

};

}

#endif