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Add CITATION.cff for software citation guidelines
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update urllib3 from 2.6.1 to 2.7.0 (CVE-2026-44431) (#97)
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PP references (#96)
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Clean-up (#84)
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merging (#81)
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Merging final bits (#80)
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Update README.md to refresh coverage badge link
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Documentation update (#79)
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MC3D interface change, Supercell error correction
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pytorch_geometric problems in streamlit (#76)
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new changes are cleaned (#75)
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Update README.md
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Some problems with joblib (#74)
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App update, new models (#73)
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