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@HaoZeke HaoZeke commented Nov 14, 2025

Just fixes the docs.

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  • Tests updated (for new features and bugfixes)?
  • Documentation updated (for new features)?
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  • CHANGELOG updated with public API or any other important changes?

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Could you add i-PI? I think it is implemented there as well

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HaoZeke commented Nov 14, 2025

Actually though this should really update the actual pages with the usage instructions i.e.
https://docs.metatensor.org/metatomic/latest/engines/ipi.html

etc.

@HaoZeke HaoZeke marked this pull request as draft November 14, 2025 15:38
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HaoZeke commented Nov 14, 2025

Converted to draft and leaving it up for grabs

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HaoZeke commented Nov 14, 2025

or we need to have a better way to link out to upstream, e.g. https://github.com/i-pi/i-pi/pull/475/files has docs on the uncertainty too

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2 participants