SurfaceEntry

class emmet.core.surface_properties.SurfaceEntry(**data)

Bases: BaseModel

Surface energies, miller indicies, …

Parameters:
  • miller_index (list[int] | None)

  • surface_energy_EV_PER_ANG2 (float | None)

  • surface_energy (float | None)

  • is_reconstructed (bool | None)

  • structure (str | None)

  • work_function (float | None)

  • efermi (float | None)

  • area_fraction (float | None)

  • has_wulff (bool | None)

model_config: ClassVar[ConfigDict] = {}

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