| # | Line 9 | Line 9 | targetTemp = 119.8; | |
|---|---|---|
| 9 | initialConfig = "./init_au.in"; | |
| 10 | ||
| 11 | forceField = "EAM"; | |
| 12 | < | targetTemp = 119.8; |
| 12 | > | targetTemp = 1000.0; |
| 13 | density = 0.02143659; | |
| 14 | ||
| 15 | ensemble = "NVE"; | |
| # | Line 18 | Line 18 | sampleTime = 10.0; | |
| 18 | ||
| 19 | usePeriodicBoundaryConditions = "false"; | |
| 20 | ||
| 21 | < | sampleTime = 10.0; |
| 21 | > | sampleTime = 50.0; |
| 22 | ||
| 23 | thermalTime = 100.0; | |
| 24 | tempSet = "false"; | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |