Revision: | 2489 |
Committed: | Tue Dec 6 16:49:59 2005 UTC (18 years, 9 months ago) by tim |
File size: | 321 byte(s) |
Log Message: | remove deprecated keywords from samples |
# | User | Rev | Content |
---|---|---|---|
1 | gezelter | 1490 | #include "lj.md" |
2 | |||
3 | tim | 2489 | |
4 | gezelter | 1490 | component{ |
5 | type = "Ar"; | ||
6 | nMol = 864; | ||
7 | } | ||
8 | |||
9 | initialConfig = "./ar864.in"; | ||
10 | |||
11 | forceField = "LJ"; | ||
12 | targetTemp = 135.1344; | ||
13 | tauThermostat = 1e3; | ||
14 | cutoffRadius = 15.0; | ||
15 | switchingRadius = 15.0; | ||
16 | |||
17 | ensemble = "NVT"; | ||
18 | dt = 1.0; | ||
19 | runTime = 1e5; | ||
20 | |||
21 | sampleTime = 100; | ||
22 | statusTime = 1; | ||
23 | |||
24 | thermalTime = 1000.0; | ||
25 | tempSet = "true"; |