atomate2.forcefields.schemas

Schema definitions for force field tasks.

Classes

ForceFieldTaskDocument	Document containing information on structure relaxation using a force field.
ForcefieldObject	Types of forcefield data objects.
ForcefieldResult	Schema to store outputs in ForceFieldTaskDocument.
GPa	Convert a string or number to a floating point number, if possible.
InputDoc	The inputs used to run this job.
IonicStep	Document defining the information at each ionic step.
OutputDoc	The outputs of this job.