emmet.core.qchem.task

Core definition of a Q-Chem Task Document

Functions

filter_task_type

Filter (and sort) TaskDocument entries based on task type

Classes

OutputSummary	Summary of an output for a Q-Chem calculation
QChemStatus	Q-Chem Calculation State
TYPE_CHECKING	bool(x) -> bool
TaskDocument	Definition of a Q-Chem task document