ConversionElectrodeDoc

class emmet.core.electrode.ConversionElectrodeDoc(**data)

Bases: ConversionVoltagePairDoc, BaseElectrode

Conversion electrode

Parameters:
  • builder_meta (EmmetMeta | None)

  • battery_type (BatteryType | None)

  • battery_id (str | None)

  • thermo_type (str | None)

  • battery_formula (str | None)

  • working_ion (Annotated[ElementTypeVar, BeforeValidator(func=~emmet.core.types.pymatgen_types.element_adapter.<lambda>, json_schema_input_type=PydanticUndefined), WrapSerializer(func=~emmet.core.types.pymatgen_types.element_adapter.<lambda>, return_type=str, when_used=always)] | None)

  • num_steps (int | None)

  • max_voltage_step (float | None)

  • last_updated (Annotated[datetime, BeforeValidator(func=~emmet.core.utils.convert_datetime, json_schema_input_type=PydanticUndefined)])

  • framework (Annotated[CompositionTypeVar, BeforeValidator(func=~emmet.core.types.pymatgen_types.composition_adapter.<lambda>, json_schema_input_type=PydanticUndefined), WrapSerializer(func=~emmet.core.types.pymatgen_types.composition_adapter.<lambda>, return_type=dict[str, float], when_used=always)] | None)

  • framework_formula (str | None)

  • elements (list[Annotated[ElementTypeVar, BeforeValidator(func=~emmet.core.types.pymatgen_types.element_adapter.<lambda>, json_schema_input_type=PydanticUndefined), WrapSerializer(func=~emmet.core.types.pymatgen_types.element_adapter.<lambda>, return_type=str, when_used=always)]] | None)

  • nelements (int | None)

  • chemsys (str | None)

  • formula_anonymous (str | None)

  • warnings (list[str])

  • formula_charge (str | None)

  • formula_discharge (str | None)

  • max_delta_volume (float | None)

  • average_voltage (float | None)

  • capacity_grav (float | None)

  • capacity_vol (float | None)

  • energy_grav (float | None)

  • energy_vol (float | None)

  • fracA_charge (float | None)

  • fracA_discharge (float | None)

  • reaction (Annotated[BalancedReactionTypeVar, BeforeValidator(func=~emmet.core.types.pymatgen_types.balanced_reaction_adapter.<lambda>, json_schema_input_type=PydanticUndefined), WrapSerializer(func=~emmet.core.types.pymatgen_types.balanced_reaction_adapter.<lambda>, return_type=~emmet.core.types.pymatgen_types.balanced_reaction_adapter.TypedBalancedReactionDict, when_used=always)] | None)

  • initial_comp_formula (str | None)

  • adj_pairs (list[ConversionVoltagePairDoc] | None)

  • electrode_object (Annotated[ConversionElectrodeTypeVar, BeforeValidator(func=~emmet.core.types.pymatgen_types.electrode_adapter.electrode_object_deserializer, json_schema_input_type=PydanticUndefined), WrapSerializer(func=~emmet.core.types.pymatgen_types.electrode_adapter.electrode_object_serializer, return_type=dict[str, Any], when_used=always)] | None)

static get_conversion_elec_doc(ce)
Return type:

dict

Parameters:

ce (ConversionElectrode)

Gets a summary doc for a ConversionElectrode object. Args:

ie (pymatgen ConversionElectrode): electrode_object

Returns:

summary doc

model_config: ClassVar[ConfigDict] = {}

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