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fix_mvv_tdpd.h
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Created
Fri, Aug 30, 13:11
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1 KB
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text/x-c
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Sun, Sep 1, 13:11 (2 d)
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blob
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rLAMMPS lammps
fix_mvv_tdpd.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 FIX_CLASS
FixStyle
(
mvv
/
tdpd
,
FixMvvTDPD
)
#else
#ifndef LMP_FIX_MVV_TDPD_H
#define LMP_FIX_MVV_TDPD_H
#include "fix.h"
namespace
LAMMPS_NS
{
class
FixMvvTDPD
:
public
Fix
{
public:
FixMvvTDPD
(
class
LAMMPS
*
,
int
,
char
**
);
virtual
~
FixMvvTDPD
()
{}
int
setmask
();
virtual
void
init
();
virtual
void
initial_integrate
(
int
);
virtual
void
final_integrate
();
virtual
void
reset_dt
();
protected:
double
dtv
,
dtf
;
double
verlet
;
int
cc_species
;
};
}
#endif
#endif
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