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 FIX_CLASS

FixStyle(reax/c/species/kk,FixReaxCSpeciesKokkos)
FixStyle(reax/c/species/kk/device,FixReaxCSpeciesKokkos)
FixStyle(reax/c/species/kk/host,FixReaxCSpeciesKokkos)

#else

#ifndef LMP_FIX_REAXC_SPECIES_KOKKOS_H
#define LMP_FIX_REAXC_SPECIES_KOKKOS_H

#include "fix_reaxc_species.h"

#define BUFLEN 1000

namespace LAMMPS_NS {

class FixReaxCSpeciesKokkos : public FixReaxCSpecies {
 public:
  FixReaxCSpeciesKokkos(class LAMMPS *, int, char **);
  virtual ~FixReaxCSpeciesKokkos();
  void init();

 private:
  void FindMolecule();
};
}

#endif
#endif