ElectronicStructureSummary

class emmet.core.electronic_structure.ElectronicStructureSummary(**data)

Bases: ElectronicStructureBaseData

Parameters:
  • band_gap (float)

  • cbm (float | None)

  • vbm (float | None)

  • efermi (float | None)

  • is_gap_direct (bool | None)

  • is_metal (bool | None)

  • magnetic_ordering (Annotated[Ordering, BeforeValidator(func=~emmet.core.electronic_structure.<lambda>, json_schema_input_type=PydanticUndefined), WrapSerializer(func=~emmet.core.electronic_structure.<lambda>, return_type=str, when_used=always)] | None)

model_config: ClassVar[ConfigDict] = {}

Configuration for the model, should be a dictionary conforming to [ConfigDict][pydantic.config.ConfigDict].