/*----------------------------------------------------------------------
  PuReMD - Purdue ReaxFF Molecular Dynamics Program
  
  Copyright (2010) Purdue University
  Hasan Metin Aktulga, haktulga@cs.purdue.edu
  Joseph Fogarty, jcfogart@mail.usf.edu
  Sagar Pandit, pandit@usf.edu
  Ananth Y Grama, ayg@cs.purdue.edu

  This program is free software; you can redistribute it and/or
  modify it under the terms of the GNU General Public License as
  published by the Free Software Foundation; either version 2 of 
  the License, or (at your option) any later version.
  
  This program is distributed in the hope that it will be useful,
  but WITHOUT ANY WARRANTY; without even the implied warranty of
  MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  
  See the GNU General Public License for more details:
  <http://www.gnu.org/licenses/>.
  ----------------------------------------------------------------------*/

#ifndef __ALLOCATE_H_
#define __ALLOCATE_H_

#include "reaxc_types.h"
int PreAllocate_Space( reax_system*, control_params*, storage*, MPI_Comm );

void reax_atom_Copy( reax_atom*, reax_atom* );
int  Allocate_System( reax_system*, int, int, char* );
void DeAllocate_System( reax_system* );

int  Allocate_Workspace( reax_system*, control_params*, storage*, 
			 int, int, MPI_Comm, char* );
void DeAllocate_Workspace( control_params*, storage* );

void Allocate_Grid( reax_system*, MPI_Comm );
void Deallocate_Grid( grid* );

int  Allocate_MPI_Buffers( mpi_datatypes*, int, neighbor_proc*, char* );

int  Allocate_Matrix( sparse_matrix**, int, int, MPI_Comm );

int  Allocate_HBond_List( int, int, int*, int*, reax_list* );

int  Allocate_Bond_List( int, int*, reax_list* );

void ReAllocate( reax_system*, control_params*, simulation_data*, storage*, 
		 reax_list**, mpi_datatypes* );
#endif
