Available objects
PyMatGenObject
Objects of this type store pymatgen object types.
Creating a PyMatGen object
| Python |
PyMatGenObject( name : str ="Object Name", description: Optional[str] = "Object description", native: pymatgen.core.Structure = ... ) |
where
- name is the name of the object in the Data Catalog.
- description is the description of the object in Data Catalog.
- native is a pymatgen.core.Structure object.
Getting the object data
| Python |
def native(self) -> pymatgen.core.Structure |
This function returns a pymatgen.core.Structure object from the Data Catalog.