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body_nparticle.h
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Sun, Nov 17, 06:22

body_nparticle.h
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/* -*- 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 BODY_CLASS
BodyStyle(nparticle,BodyNparticle)
#else
#ifndef LMP_BODY_NPARTICLE_H
#define LMP_BODY_NPARTICLE_H
#include "body.h"
#include "atom_vec_body.h"
namespace LAMMPS_NS {
class BodyNparticle : public Body {
public:
BodyNparticle(class LAMMPS *, int, char **);
~BodyNparticle();
int nsub(struct AtomVecBody::Bonus *);
double *coords(struct AtomVecBody::Bonus *);
int pack_border_body(struct AtomVecBody::Bonus *, double *);
int unpack_border_body(struct AtomVecBody::Bonus *, double *);
void data_body(int, int, int, int *, double *);
double radius_body(int, int, int *, double *);
int noutrow(int);
int noutcol();
void output(int, int, double *);
int image(int, double, double, int *&, double **&);
private:
int *imflag;
double **imdata;
};
}
#endif
#endif
/* ERROR/WARNING messages:
E: Invalid body nparticle command
Arguments in atom-style command are not correct.
E: Incorrect # of integer values in Bodies section of data file
See doc page for body style.
E: Incorrect integer value in Bodies section of data file
See doc page for body style.
E: Incorrect # of floating-point values in Bodies section of data file
See doc page for body style.
E: Insufficient Jacobi rotations for body nparticle
Eigensolve for rigid body was not sufficiently accurate.
*/

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