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from structuretoolkit.common.pymatgen import pymatgen_to_ase


class MPQueryResults:
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This class really only works with the HasStructure interface from pyiron_atomistics. Since we don't have that here, it might be better to replace it completely with just lists of dictionaries.

@jan-janssen jan-janssen marked this pull request as draft February 14, 2024 13:27
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2 participants