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Begun work to make NP cutting more general
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UlrikFriisJensen committed Nov 28, 2023
1 parent 1c532c8 commit 7058aae
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1 change: 1 addition & 0 deletions debyecalculator/debye_calculator.py
Original file line number Diff line number Diff line change
Expand Up @@ -586,6 +586,7 @@ def generate_nanoparticles(
self,
structure_path: str,
radii: Union[List[float], float],
metals: Union[List[float], List[str]],
sort_atoms: bool = True,
disable_pbar: bool = False,
_override_device: bool = True,
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