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Update to average Grüneisen documentation #3773

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merged 2 commits into from
Apr 19, 2024

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@JaGeo JaGeo commented Apr 19, 2024

I have clarified the description of the average Grüneisen paramter.

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coderabbitai bot commented Apr 19, 2024

Walkthrough

The recent update enhances the documentation in the pymatgen library, particularly focusing on the average_gruneisen function in the phonon module. This improvement involves adding a specific reference source for definitions related to negative frequencies, aiming to enhance clarity and usefulness for users.

Changes

File Path Change Summary
pymatgen/.../gruneisen.py Updated documentation to include a reference for definitions related to negative frequencies in the average_gruneisen function.

Recent Review Details

Configuration used: .coderabbit.yaml

Commits Files that changed from the base of the PR and between 9662575 and 6f35223.
Files selected for processing (1)
  • pymatgen/phonon/gruneisen.py (1 hunks)
Files skipped from review as they are similar to previous changes (1)
  • pymatgen/phonon/gruneisen.py

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pymatgen/phonon/gruneisen.py Outdated Show resolved Hide resolved
Signed-off-by: J. George <JaGeo@users.noreply.github.com>
@JaGeo JaGeo merged commit 666e1d7 into materialsproject:master Apr 19, 2024
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JaGeo commented Apr 19, 2024

@janosh I have merged as it is a tiny change to the docu and the tests pass

@JaGeo JaGeo deleted the fix_phonon_doc branch April 19, 2024 12:41
@janosh janosh changed the title Update to average Grüneisen documenation Update to average Grüneisen documentation May 1, 2024
@janosh janosh added the docs Documentation, examples, user guides label May 1, 2024
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