fix_shear_history.h
284c1f2d04aclammm-master-deprecated

fix_shear_history.h
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			/* ----------------------------------------------------------------------
			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 FIX_SHEAR_HISTORY_H
			#define FIX_SHEAR_HISTORY_H

			#include "fix.h"

			namespace LAMMPS_NS {

			class FixShearHistory : public Fix {
			friend class Neighbor;
			friend class FixPour;

			public:
			FixShearHistory(class LAMMPS , int, char *);
			~FixShearHistory();
			int setmask();
			void init();
			void pre_exchange();

			int memory_usage();
			void grow_arrays(int);
			void copy_arrays(int, int);
			int pack_exchange(int, double *);
			int unpack_exchange(int, double *);
			int pack_restart(int, double *);
			void unpack_restart(int, int);
			int size_restart(int);
			int maxsize_restart();

			private:
			int *npartner; // # of touching partners of each atom
			int **partner; // tags for the partners
			double ***shearpartner; // 3 shear values with the partner
			};

			}

			#endif