/usr/include/liggghts/replicate.h is in libliggghts-dev 2.3.8-1build1.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 | /* ----------------------------------------------------------------------
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 molecular system atom IDs are too big
See the setting for the allowed atom ID size 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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