/*---------------------------------------------------------------------- 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 __COMM_TOOLS_H_ #define __COMM_TOOLS_H_ #include "reax_types.h" #ifdef __cplusplus extern "C" { #endif #if defined(NEUTRAL_TERRITORY) void Setup_NT_Comm( reax_system * const, control_params * const, mpi_datatypes * const ); void Estimate_NT_Atoms( reax_system * const, mpi_datatypes * const ); #endif void Check_MPI_Error( int, const char * const, int ); void Setup_Comm( reax_system * const, control_params * const, mpi_datatypes * const ); void Update_Comm( reax_system * const ); void Count_Boundary_Atoms( reax_system const * const, int, int, int, mpi_out_data * const, int * const ); void Sort_Boundary_Atoms( reax_system * const, int, int, int, mpi_out_data * const, mpi_datatypes * const ); void Unpack_Exchange_Message( reax_system * const, int, void * const, int, neighbor_proc * const, int ); int SendRecv( reax_system * const, mpi_datatypes * const, MPI_Datatype, message_counter, message_sorter, unpacker, int ); void Comm_Atoms( reax_system * const, control_params * const, simulation_data * const, storage * const, mpi_datatypes * const, int ); #ifdef __cplusplus } #endif #endif