samples/cutoff/GB-Ar-max.md

#include "gb.md"
#include "lj.md"

component{
  type = "linear";
  nMol = 1;
}
component{
  type = "Ar";
  nMol =862;
}


initialConfig = "./gb-ar.in";

ensemble = NVE;
forceField = "DUFF";
cutoffPolicy = "max";

dt = 1;
runTime = 1e4;
useInitialTime = "false";
useInitialExtendedSystemState = "false";

sampleTime = 100;
statusTime = 1;
Revision:	815
Committed:	Fri Dec 16 15:53:16 2005 UTC (19 years, 11 months ago) by gezelter
Original Path:	*trunk/samples/cutoff/GB-Ar-max.md*
File size:	338 byte(s)
Log Message:	Removed one parasitic argon atom which was living inside the GB particle. No alien-like ripping out of the stomach was required.
#	Content
1	#include "gb.md"
2	#include "lj.md"
3
4	component{
5	type = "linear";
6	nMol = 1;
7	}
8	component{
9	type = "Ar";
10	nMol =862;
11	}
12
13
14	initialConfig = "./gb-ar.in";
15
16	ensemble = NVE;
17	forceField = "DUFF";
18	cutoffPolicy = "max";
19
20	dt = 1;
21	runTime = 1e4;
22	useInitialTime = "false";
23	useInitialExtendedSystemState = "false";
24
25	sampleTime = 100;
26	statusTime = 1;