The pyiron_dataclasses module provides a series of dataclasses
for the pyiron workflow framework. It can load HDF5 files created by pyiron_atomistics and read the content stored
in those files, without depending on pyiron_atomistics. Furthermore, it is not fixed to a single version of
pyiron_atomistics but rather matches multiple versions of pyiron_atomistics to the same API version of
pyiron_dataclasses.
Using the get_dataclass() function of the built-in converter:
from h5io_browser import read_dict_from_hdf
from pyiron_dataclasses.v1.converter import get_dataclass
job_classes = get_dataclass(
job_dict=read_dict_from_hdf(
file_name=job.project_hdf5.file_name,
h5_path="/",
recursive=True,
slash='ignore',
)[job.job_name]
)
job_classesSupported versions of pyiron_atomistics:
0.6.130.6.12