emmet.core.qchem.calc_types.enums

Autogenerated Enums for Q-Chem LevelOfTheory, TaskType, and CalcType.

Do not edit this by hand to add or remove enums. Instead, edit

dev_scripts/generate_enums.py

and/or

emmet/core/qchem/calc_types/calc_types.yaml

Classes

CalcType	Calculation types (LOT + task type) for Q-Chem.
LevelOfTheory	Levels of theory for calculations in Q-Chem.
TaskType	Calculation task types for Q-Chem.