intermolecular different type

Note

For a description of the common aspects of conditions, including their usage and shared parameters (cutOff, cutOffVerletFactor), please refer to the general conditions documentation.

This condition creates one Verlet list only. This Verlet list can be requested using the identifier "inter" in the “condition” option of the potential.

All the pairs contains only particles with different modelId values (intermolecular) and with different type (different type).


  • type: VerletConditionalListSet, interDifferentType.

  • parameters:

    • cutOff : float, optional, default: 0.

    • cutOffVerletFactor : float, optional, default: 1.1 .

  • data: None.


Example:

"entryName":{
  "type":["VerletConditionalListSet","interDifferentType"]
  "parameters":{
    "cutOff":1.0,
    "cutOffVerletFactor":1.2
  }
}