- 1.7
- 1.6
- 1.5
- Beta
- Examples (for 1.6a)
- Misc
Combination rule equations as used when combining similar Lennard Jones parameters.
Table 10.4. Combination Rules
| Keyword | Description |
|---|---|
| arithmetic | The arithmetic mean of two values : a = 0.5*(b*c) |
| geometric | The geometric mean of two values : a = sqrt(b*c) |
| custom1 | Custom combination rule |
| custom2 | Custom combination rule |
| custom3 | Custom combination rule |