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@jnsLs jnsLs commented Nov 19, 2025

I added the pymatgen nbh list and the vesin nbh list as proposed in #756 .
The nbh lists are tested using pytest but the nbh list speed is not benchmarked yet.

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This still needs to add vesin and pymatgen to requirements.

@stefaanhessmann stefaanhessmann merged commit c62152d into dev Dec 4, 2025
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Oh sorry, I did not see this. Looks good to me, thanks!

@jnsLs jnsLs deleted the jl/nbh branch December 4, 2025 13:43
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4 participants