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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@254 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2007-01-30 00:22:05 +00:00
parent 9cdbeaf9f2
commit 209f169cbc
414 changed files with 6935 additions and 10462 deletions
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14
src/improper.h
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@ -1,7 +1,7 @@
/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
www.cs.sandia.gov/~sjplimp/lammps.html
Steve Plimpton, sjplimp@sandia.gov, Sandia National Laboratories
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
@ -15,9 +15,11 @@
#define IMPROPER_H
#include "stdio.h"
#include "lammps.h"
#include "pointers.h"
class Improper : public LAMMPS {
namespace LAMMPS_NS {
class Improper : protected Pointers {
public:
int allocated;
int *setflag;
@ -25,7 +27,7 @@ class Improper : public LAMMPS {
double virial[6];
double PI;
Improper();
Improper(class LAMMPS *);
virtual ~Improper() {}
virtual void init();
virtual void compute(int, int) = 0;
@ -36,4 +38,6 @@ class Improper : public LAMMPS {
virtual int memory_usage() {return 0;}
};
}
#endif