pair_rebo_intel.cpp
No OneTemporary
Actions

Subscribers

None

File Metadata

	/* ----------------------------------------------------------------------
	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.
	------------------------------------------------------------------------- */

	/* ----------------------------------------------------------------------
	Contributing author: Markus Hohnerbach (RWTH)
	------------------------------------------------------------------------- */

	#include "pair_rebo_intel.h"
	#include "error.h"

	using namespace LAMMPS_NS;

	/* ---------------------------------------------------------------------- */

	PairREBOIntel::PairREBOIntel(LAMMPS *lmp) : PairAIREBOIntel(lmp) {}

	/* ----------------------------------------------------------------------
	global settings
	------------------------------------------------------------------------- */

	void PairREBOIntel::settings(int narg, char **arg)
	{
	if (narg != 0) error->all(FLERR,"Illegal pair_style command");

	cutlj = 0.0;
	ljflag = torflag = 0;
	//
	// this one parameter for C-C interactions is different in REBO vs AIREBO
	// see Favata, Micheletti, Ryu, Pugno, Comp Phys Comm (2016)

	PCCf_2_0 = 0.0;
	}