Revision: | 2527 |
Committed: | Thu Dec 29 16:37:09 2005 UTC (18 years, 8 months ago) by chuckv |
File size: | 324 byte(s) |
Log Message: | More cvs changing. |
# | User | Rev | Content |
---|---|---|---|
1 | chuckv | 2527 | #include "metals.md" |
2 | |||
3 | |||
4 | component{ | ||
5 | type = "Au"; | ||
6 | nMol = 9179; | ||
7 | } | ||
8 | |||
9 | initialConfig = "/Au_nanoparticle.in"; | ||
10 | |||
11 | forceField = "EAM"; | ||
12 | forceFieldVariant = "VC"; | ||
13 | targetTemp = 1000.0; | ||
14 | |||
15 | |||
16 | ensemble = "NVE"; | ||
17 | dt = 1.0; | ||
18 | runTime = 1000.0; | ||
19 | |||
20 | usePeriodicBoundaryConditions = "false"; | ||
21 | |||
22 | sampleTime = 50.0; | ||
23 | |||
24 | thermalTime = 100.0; | ||
25 | tempSet = "false"; |