1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
/* -*- 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.
------------------------------------------------------------------------- */
#ifndef LMP_IMBALANCE_VAR_H
#define LMP_IMBALANCE_VAR_H
#include "imbalance.h"
namespace LAMMPS_NS {
class ImbalanceVar : public Imbalance {
public:
ImbalanceVar(class LAMMPS *);
virtual ~ImbalanceVar();
public:
// parse options. return number of arguments consumed.
virtual int options(int, char **);
// re-initialize internal data, e.g. variable ID
virtual void init(int);
// compute per-atom imbalance and apply to weight array
virtual void compute(double *);
// print information about the state of this imbalance compute (required)
virtual void info(FILE *);
private:
char *name; // variable name
int id; // variable index
};
}
#endif
/* ERROR/WARNING messages:
E: Illegal ... command
UNDOCUMENTED
E: Variable name for balance weight does not exist
UNDOCUMENTED
E: Variable for balance weight has invalid style
UNDOCUMENTED
E: Balance weight <= 0.0
UNDOCUMENTED
*/