| # | Line 13 | Line 13 | switchingRadius = 7.7; | |
|---|---|---|
| 13 | electrostaticSummationMethod = "reaction_field"; | |
| 14 | dielectric = 80.0; | |
| 15 | cutoffRadius = 9.0; | |
| 16 | < | switchingRadius = 7.7; |
| 16 | > | switchingRadius = 7.65; |
| 17 | ||
| 18 | targetTemp = 300; | |
| 19 | targetPressure = 1.0; | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |