BornEffectiveCharges

class emmet.core.polar.BornEffectiveCharges(**data)

Bases: BaseModel

A block for the Born effective charges

Parameters:
  • value (list[tuple[tuple[float, float, float], tuple[float, float, float], tuple[float, float, float]]] | None)

  • symmetrized_value (list[tuple[tuple[float, float, float], tuple[float, float, float], tuple[float, float, float]]] | None)

  • cnsr_break (float | None)

model_config: ClassVar[ConfigDict] = {}

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