TransportData

class atomate2.amset.schemas.TransportData(*, doping=None, temperatures=None, fermi_levels=None, conductivity=None, seebeck=None, electronic_thermal_conductivity=None, mobility=None)

Bases: BaseModel

Definition of AMSET transport data model.

Parameters:

• doping (list[float])

• temperatures (list[float])

• fermi_levels (list[list[float]])

• conductivity (list[list[tuple[tuple[float, float, float], tuple[float, float, float], tuple[float, float, float]]]])

• seebeck (list[list[tuple[tuple[float, float, float], tuple[float, float, float], tuple[float, float, float]]]])

• electronic_thermal_conductivity (list[list[tuple[tuple[float, float, float], tuple[float, float, float], tuple[float, float, float]]]])

• mobility (dict[str, list[list[tuple[tuple[float, float, float], tuple[float, float, float], tuple[float, float, float]]]]])

model_config = {}

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