63 lines
1.3 KiB
C++
63 lines
1.3 KiB
C++
/* -*- c++ -*- ----------------------------------------------------------
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LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
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http://lammps.sandia.gov, Sandia National Laboratories
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Steve Plimpton, sjplimp@sandia.gov
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Copyright (2003) Sandia Corporation. Under the terms of Contract
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DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
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certain rights in this software. This software is distributed under
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the GNU General Public License.
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See the README file in the top-level LAMMPS directory.
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------------------------------------------------------------------------- */
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#ifdef ATOM_CLASS
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AtomStyle(sphere,AtomVecSphere)
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#else
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#ifndef LMP_ATOM_VEC_SPHERE_H
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#define LMP_ATOM_VEC_SPHERE_H
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#include "atom_vec.h"
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namespace LAMMPS_NS {
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class AtomVecSphere : public AtomVec {
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public:
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AtomVecSphere(class LAMMPS *);
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void process_args(int, char **);
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void init();
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void grow_pointers();
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void create_atom_post(int);
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void data_atom_post(int);
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void pack_data_pre(int);
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void pack_data_post(int);
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private:
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double *radius,*rmass;
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double **omega;
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int radvary;
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double radius_one,rmass_one;
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};
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}
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Invalid radius in Atoms section of data file
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Radius must be >= 0.0.
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E: Invalid density in Atoms section of data file
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Density value cannot be <= 0.0.
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*/
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