soprano.collection.generate

soprano.collection.generate#

This module contains generators meant to produce AtomsCollections based on different criteria.

Modules

airss

Bindings for AIRSS Buildcell program for random structure generation

defect

Generator producing structures with a randomly positioned point defect

linspace

Generator producing structures interpolated between two extremes

molneigh

Generator producing molecular neighbourhoods

rattle

Generator producing structures rattled of a given amount

transform

Generator producing structures by repeatedly applying a transform