/usr/include/liggghts/create_atoms.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 85 86 87 88 89 90 91 92 93 94 95 | /* ----------------------------------------------------------------------
LIGGGHTS - LAMMPS Improved for General Granular and Granular Heat
Transfer Simulations
LIGGGHTS is part of the CFDEMproject
www.liggghts.com | www.cfdem.com
This file was modified with respect to the release in LAMMPS
Modifications are Copyright 2009-2012 JKU Linz
Copyright 2012- DCS Computing GmbH, Linz
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 directory.
------------------------------------------------------------------------- */
#ifdef COMMAND_CLASS
CommandStyle(create_atoms,CreateAtoms)
#else
#ifndef LMP_CREATE_ATOMS_H
#define LMP_CREATE_ATOMS_H
#include "pointers.h"
namespace LAMMPS_NS {
class CreateAtoms : protected Pointers {
public:
CreateAtoms(class LAMMPS *);
void command(int, char **);
private:
int itype,style,nregion,nbasis,nrandom,seed;
int *basistype;
double xone[3];
int remapflag;
void add_single();
void add_random();
void add_lattice();
};
}
#endif
#endif
/* ERROR/WARNING messages:
E: Create_atoms command before simulation box is defined
The create_atoms command cannot be used before a read_data,
read_restart, or create_box command.
E: Cannot create_atoms after reading restart file with per-atom info
The per-atom info was stored to be used when by a fix that you
may re-define. If you add atoms before re-defining the fix, then
there will not be a correct amount of per-atom info.
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: Invalid atom type in create_atoms command
The create_box command specified the range of valid atom types.
An invalid type is being requested.
E: Create_atoms region ID does not exist
A region ID used in the create_atoms command does not exist.
E: Cannot create atoms with undefined lattice
Must use the lattice command before using the create_atoms
command.
E: Too many total atoms
See the setting for bigint in the src/lmptype.h file.
*/
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