CI fix

[esoteric-ephemera]

Very small fix to patch CI segfaults - seems like the issue is with newer versions of the openff libraries. Pinning them to the versions we use in atomate2's CI

[codecov-commenter]

Codecov Report

All modified and coverable lines are covered by tests ✅

Project coverage is 90.18%. Comparing base (fa089be) to head (afc7495).
Report is 8 commits behind head on main.

Additional details and impacted files

@@             Coverage Diff             @@
##             main    #1194       +/-   ##
===========================================
+ Coverage   72.19%   90.18%   +17.99%     
===========================================
  Files          77      147       +70     
  Lines        5146    14504     +9358     
===========================================
+ Hits         3715    13081     +9366     
+ Misses       1431     1423        -8     

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[esoteric-ephemera]

@tschaume: had to put a pin on the openff dependencies as well as pymatgen. For now, I think we need pymatgen<=2025.1.9 to ensure that the new bandgap parsing doesn't affect tests. Would like to address that change in a separate PR

[tschaume]

Thanks for tracking this down! Can we put the pymatgen pin also into the setup.py for emmet-core? We'd want to avoid pymatgen being bumped when I run the action to upgrade dependencies next time.

[esoteric-ephemera]

Done! Good to merge?

[tschaume]

Yes, looks good. Thanks!