ChargeSpilling#

pydantic model atomate2.lobster.schemas.ChargeSpilling[source]#

Model describing the Charge spilling field in the CalcQualitySummary model.

field abs_charge_spilling: float [Required]#

Absolute charge spilling value from the LOBSTER calculation.

field abs_total_spilling: float [Required]#

Total charge spilling percent from the LOBSTER calculation.