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Deprecated Structure.ntypesp in pymatgen #1105

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merged 2 commits into from
Jan 23, 2025
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@jmmshn jmmshn commented Jan 21, 2025

Summary

Structure.ntypesp was replaced by Structure.n_elems
materialsproject/pymatgen#3562

This PR allows for both of those within atomate2 for now.

@jmmshn jmmshn changed the title Deprecated ` Deprecated Structure.ntypesp in pymatgen Jan 21, 2025
@jmmshn jmmshn force-pushed the jmmshn/md branch 2 times, most recently from b5adeab to fcda528 Compare January 21, 2025 21:49
@jmmshn jmmshn marked this pull request as draft January 22, 2025 03:03
@jmmshn jmmshn marked this pull request as ready for review January 23, 2025 21:21
@JaGeo JaGeo enabled auto-merge (squash) January 23, 2025 21:36
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JaGeo commented Jan 23, 2025

Thank you @jmmshn !

@JaGeo JaGeo merged commit 233c2a9 into materialsproject:main Jan 23, 2025
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@jmmshn jmmshn deleted the jmmshn/md branch January 23, 2025 22:54
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3 participants