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fix_indent.h
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Created
Wed, Jul 10, 02:44
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1 KB
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text/x-c
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Fri, Jul 12, 02:44 (2 d)
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blob
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rLAMMPS lammps
fix_indent.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
(
indent
,
FixIndent
)
#else
#ifndef LMP_FIX_INDENT_H
#define LMP_FIX_INDENT_H
#include "fix.h"
namespace
LAMMPS_NS
{
class
FixIndent
:
public
Fix
{
public:
FixIndent
(
class
LAMMPS
*
,
int
,
char
**
);
~
FixIndent
();
int
setmask
();
void
init
();
void
setup
(
int
);
void
min_setup
(
int
);
void
post_force
(
int
);
void
post_force_respa
(
int
,
int
,
int
);
void
min_post_force
(
int
);
double
compute_scalar
();
double
compute_vector
(
int
);
private:
int
istyle
,
scaleflag
,
side
;
double
k
,
k3
;
char
*
xstr
,
*
ystr
,
*
zstr
,
*
rstr
,
*
pstr
;
int
xvar
,
yvar
,
zvar
,
rvar
,
pvar
;
double
xvalue
,
yvalue
,
zvalue
,
rvalue
,
pvalue
;
int
indenter_flag
,
planeside
;
double
indenter
[
4
],
indenter_all
[
4
];
int
cdim
,
varflag
;
int
nlevels_respa
;
void
options
(
int
,
char
**
);
};
}
#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.
E: Variable name for fix indent does not exist
Self-explanatory.
E: Variable for fix indent is invalid style
Only equal-style variables can be used.
E: Variable for fix indent is not equal style
Only equal-style variables can be used.
*/
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