Descriptors#
Workflow has a parallelized interface (wfl.descriptors.quippy.calculate()) for calculating quippy descriptors via quippy.descriptors.Descriptors. See Fitting a MLIP example that generates a global SOAP descriptor.
Workflow has a parallelized interface (wfl.descriptors.quippy.calculate()) for calculating quippy descriptors via quippy.descriptors.Descriptors. See Fitting a MLIP example that generates a global SOAP descriptor.