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npair_half_bin_newton_ssa.h
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Wed, Jul 24, 08:57

npair_half_bin_newton_ssa.h

/* -*- 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 NPAIR_CLASS
NPairStyle(half/bin/newton/ssa,
NPairHalfBinNewtonSSA,
NP_HALF | NP_BIN | NP_NEWTON | NP_ORTHO | NP_SSA | NP_GHOST)
#else
#ifndef LMP_NPAIR_HALF_BIN_NEWTON_SSA_H
#define LMP_NPAIR_HALF_BIN_NEWTON_SSA_H
#include "npair.h"
namespace LAMMPS_NS {
class NPairHalfBinNewtonSSA : public NPair {
public:
// SSA Work plan data structures
int ssa_phaseCt;
int *ssa_phaseLen;
int **ssa_itemLoc;
int **ssa_itemLen;
NPairHalfBinNewtonSSA(class LAMMPS *);
~NPairHalfBinNewtonSSA();
void build(class NeighList *);
private:
int ssa_maxPhaseCt;
int ssa_maxPhaseLen;
};
}
#endif
#endif
/* ERROR/WARNING messages:
*/

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