Page MenuHomec4science

fix_wall_ees.h
No OneTemporary

File Metadata

Created
Tue, Dec 3, 05:23

fix_wall_ees.h

/* -*- 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 FIX_CLASS
FixStyle(wall/ees,FixWallEES)
#else
#ifndef LMP_FIX_WALL_EES_H
#define LMP_FIX_WALL_EES_H
#include "fix_wall.h"
namespace LAMMPS_NS {
class FixWallEES : public FixWall {
public:
FixWallEES(class LAMMPS *, int, char **);
void precompute(int);
void init();
void wall_particle(int, int, double);
private:
double coeff1[6],coeff2[6],coeff3[6],coeff4[6],coeff5[6],coeff6[6];
class AtomVecEllipsoid *avec;
};
}
#endif
#endif
/* ERROR/WARNING messages:
E: Particle on or inside fix wall surface
Particles must be "exterior" to the wall in order for energy/force to
be calculated.
*/

Event Timeline