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fix_indent.h
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Created
Thu, Jul 31, 11:52
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1 KB
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text/x-c
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Sat, Aug 2, 11:52 (2 d)
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blob
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rLAMMPS lammps
fix_indent.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.
------------------------------------------------------------------------- */
#ifndef FIX_INDENT_H
#define FIX_INDENT_H
#include "fix.h"
namespace
LAMMPS_NS
{
class
FixIndent
:
public
Fix
{
public:
FixIndent
(
class
LAMMPS
*
,
int
,
char
**
);
int
setmask
();
void
init
();
void
setup
(
int
);
void
min_setup
(
int
);
virtual
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
,
radflag
,
thermo_flag
,
eflag_enable
;
double
k
,
k3
;
double
x0
,
y0
,
z0
,
r0_stop
,
r0_start
,
planepos
;
int
indenter_flag
,
planeside
;
double
indenter
[
4
],
indenter_all
[
4
];
int
cdim
;
double
c1
,
c2
;
double
vx
,
vy
,
vz
;
int
nlevels_respa
;
void
options
(
int
,
char
**
);
};
}
#endif
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