Open GPMueller opened 5 years ago
As they can be set through the input file via translations etc., the same should be exposed in the Geometry API. Pinning and atom types can be set via the Configurations API, but only using real space positions etc.
As they can be set through the input file via translations etc., the same should be exposed in the Geometry API. Pinning and atom types can be set via the Configurations API, but only using real space positions etc.