Page Menu
Home
c4science
Search
Configure Global Search
Log In
Files
F90432673
pair_rebo.cpp
No One
Temporary
Actions
Download File
Edit File
Delete File
View Transforms
Subscribe
Mute Notifications
Award Token
Subscribers
None
File Metadata
Details
File Info
Storage
Attached
Created
Fri, Nov 1, 14:57
Size
1 KB
Mime Type
text/x-c
Expires
Sun, Nov 3, 14:57 (2 d)
Engine
blob
Format
Raw Data
Handle
22031391
Attached To
rLAMMPS lammps
pair_rebo.cpp
View Options
/* ----------------------------------------------------------------------
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.
------------------------------------------------------------------------- */
#include "pair_rebo.h"
#include "error.h"
using
namespace
LAMMPS_NS
;
/* ---------------------------------------------------------------------- */
PairREBO
::
PairREBO
(
LAMMPS
*
lmp
)
:
PairAIREBO
(
lmp
)
{}
/* ----------------------------------------------------------------------
global settings
------------------------------------------------------------------------- */
void
PairREBO
::
settings
(
int
narg
,
char
**
arg
)
{
if
(
narg
!=
0
)
error
->
all
(
FLERR
,
"Illegal pair_style command"
);
cutlj
=
0.0
;
ljflag
=
torflag
=
0
;
// this one parameter for C-C interactions is different in REBO vs AIREBO
// see Favata, Micheletti, Ryu, Pugno, Comp Phys Comm (2016)
PCCf_2_0
=
0.0
;
}
Event Timeline
Log In to Comment