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lammps/src/replicate.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 COMMAND_CLASS
CommandStyle(replicate,Replicate)
#else
#ifndef LMP_REPLICATE_H
#define LMP_REPLICATE_H
#include "pointers.h"
namespace LAMMPS_NS {
class Replicate : protected Pointers {
public:
Replicate(class LAMMPS *);
void command(int, char **);
};
}
#endif
#endif
/* ERROR/WARNING messages:
E: Replicate command before simulation box is defined
The replicate command cannot be used before a read_data, read_restart,
or create_box command.
E: Illegal ... command
Self-explanatory. Check the input script syntax and compare to the
documentation for the command. You can use -echo screen as a
command-line option when running LAMMPS to see the offending line.
E: Cannot replicate 2d simulation in z dimension
The replicate command cannot replicate a 2d simulation in the z
dimension.
W: Replicating in a non-periodic dimension
The parameters for a replicate command will cause a non-periodic
dimension to be replicated; this may cause unwanted behavior.
E: Cannot replicate with fixes that store atom quantities
Either fixes are defined that create and store atom-based vectors or a
restart file was read which included atom-based vectors for fixes.
The replicate command cannot duplicate that information for new atoms.
You should use the replicate command before fixes are applied to the
system.
E: Replicated system atom IDs are too big
See the setting for tagint in the src/lmptype.h file.
E: Replicated system is too big
See the setting for bigint in the src/lmptype.h file.
E: Replicate did not assign all atoms correctly
Atoms replicated by the replicate command were not assigned correctly
to processors. This is likely due to some atom coordinates being
outside a non-periodic simulation box.
*/
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