CCDInput

class atomate2.common.jobs.defect.CCDInput(*, structure, energy, dir_name, uuid)

Bases: BaseModel

Document model to help construct CCDDocument.

Parameters:

• structure (Structure)

• energy (float)

• dir_name (str)

• uuid (str)

model_config = {}

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