Generate Aflow structure prototype labels with `moyopy`#96

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CompRhys merged 17 commits intomainfrom

prototype-from-moyopy

Mar 1, 2025

Commits on Jan 19, 2025

Commits on Jan 21, 2025

improve get_protostructure_label_from_moyopy orbit grouping
janosh
committed

Commits on Jan 27, 2025

pin moyopy>=0.3.1
janosh
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Commits on Feb 2, 2025

fix: orbit grouping code was not doing anything useful.
CompRhys
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Commits on Feb 3, 2025

fea: use moyopy.SpaceGroupType to get the crystal system
CompRhys
committed

Commits on Feb 5, 2025

fea: use moyo pearson number
CompRhys
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Commits on Feb 6, 2025