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compute_event_displace.h
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Created
Sat, Jul 27, 19:53
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text/x-c
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Mon, Jul 29, 19:53 (2 d)
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rLAMMPS lammps
compute_event_displace.h
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/* ----------------------------------------------------------------------
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 COMPUTE_CLASS
ComputeStyle
(
event
/
displace
,
ComputeEventDisplace
)
#else
#ifndef LMP_COMPUTE_EVENT_DISPLACE_H
#define LMP_COMPUTE_EVENT_DISPLACE_H
#include "compute.h"
namespace
LAMMPS_NS
{
class
ComputeEventDisplace
:
public
Compute
{
public:
ComputeEventDisplace
(
class
LAMMPS
*
,
int
,
char
**
);
~
ComputeEventDisplace
();
void
init
();
double
compute_scalar
();
void
reset_extra_compute_fix
(
char
*
);
private:
int
triclinic
;
double
displace_distsq
;
char
*
id_event
;
class
FixEvent
*
fix_event
;
};
}
#endif
#endif
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