orgdisord.disordered_structure.DisorderedStructure#

class orgdisord.disordered_structure.DisorderedStructure[source]#

A class for representing a disordered structure.

__new__(**kwargs)#
__init__(ordered_atoms: ase.atoms.Atoms, Z: int, spacegroup: ase.spacegroup.spacegroup.Spacegroup, disorder_assemblies: List[orgdisord.disordered_structure.DisorderAssembly], molecular_crystal: bool = True, correlated_assemblies: bool = False) → None#