lammps/src/create_atoms.h

46 lines
1.1 KiB
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 COMMAND_CLASS
CommandStyle(create_atoms,CreateAtoms)
#else
#ifndef LMP_CREATE_ATOMS_H
#define LMP_CREATE_ATOMS_H
#include "pointers.h"
namespace LAMMPS_NS {
class CreateAtoms : protected Pointers {
public:
CreateAtoms(class LAMMPS *);
void command(int, char **);
private:
int itype,style,nregion,nbasis,nrandom,seed;
int *basistype;
double xone[3];
void add_single();
void add_random();
void add_lattice();
};
}
#endif
#endif