Revision: | 397 |
Committed: | Tue Mar 25 01:06:10 2003 UTC (21 years, 5 months ago) by gezelter |
File size: | 288 byte(s) |
Log Message: | moved tests to samples |
# | Content |
---|---|
1 | #include "lj.mdl" |
2 | |
3 | nComponents = 1; |
4 | component{ |
5 | type = "Ar"; |
6 | nMol = 108; |
7 | } |
8 | |
9 | initialConfig = "./init_argon.eor"; |
10 | |
11 | forceField = "LJ"; |
12 | targetTemp = 119.8; |
13 | density = 0.02143659; |
14 | |
15 | ensemble = "NVE"; |
16 | dt = 1.0; |
17 | runTime = 50000.0; |
18 | |
19 | sampleTime = 500.0; |
20 | thermalTime = 1000.0; |
21 | |
22 | tempSet = "false"; |