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pair_lubricateU_poly.h
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rLAMMPS lammps
pair_lubricateU_poly.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 PAIR_CLASS
PairStyle
(
lubricateU
/
poly
,
PairLubricateUPoly
)
#else
#ifndef LMP_PAIR_LUBRICATEU_POLY_H
#define LMP_PAIR_LUBRICATEU_POLY_H
#include "pair_lubricateU.h"
namespace
LAMMPS_NS
{
class
PairLubricateUPoly
:
public
PairLubricateU
{
public:
PairLubricateUPoly
(
class
LAMMPS
*
);
~
PairLubricateUPoly
()
{}
void
compute
(
int
,
int
);
void
settings
(
int
,
char
**
);
void
init_style
();
private:
double
vol_P
;
int
flagdeform
,
flagwall
,
flagVF
,
flagHI
;
class
FixWall
*
wallfix
;
void
iterate
(
double
**
,
int
);
void
compute_RE
(
double
**
);
void
compute_RU
(
double
**
);
void
compute_Fh
(
double
**
);
};
}
#endif
#endif
/* ERROR/WARNING messages:
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.
W: Cannot include log terms without 1/r terms; setting flagHI to 1
Self-explanatory.
E: Pair lubricateU/poly requires newton pair off
Self-explanatory.
E: Pair lubricateU/poly requires ghost atoms store velocity
Use the comm_modify vel yes command to enable this.
E: Pair lubricate/poly requires atom style sphere
Self-explanatory.
E: Pair lubricate/poly requires extended particles
One of the particles has radius 0.0.
E: Cannot use multiple fix wall commands with pair lubricateU
Self-explanatory.
*/
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