Bases: _BaseNonbondedHandler
Base handler for storing vdW interactions.
- Fields
-
-
field type: str = 'vdW'
-
field expression: str = '4*epsilon*((sigma/r)**12-(sigma/r)**6)'
-
field method: Literal['cutoff', 'pme', 'no-cutoff'] = 'cutoff'
-
field mixing_rule: Literal['lorentz-berthelot', 'geometric'] = 'lorentz-berthelot'
The mixing rule (combination rule) used in computing pairwise vdW interactions