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JaGeo / LobsterPy

Package to perform automatic bonding analysis with the program Lobster in the field of computational materials science and quantum chemistry
https://jageo.github.io/LobsterPy/
BSD 3-Clause "New" or "Revised" License
74 stars 27 forks source link

fix automatic plotting for large structures #265

Closed JaGeo closed 5 months ago

JaGeo commented 5 months ago

Closes #260 by skipping to display all plots but instead saving them to a file when more than 20 inequivalent ions are found in the structure.

codecov[bot] commented 5 months ago

Codecov Report

Attention: Patch coverage is 44.44444% with 5 lines in your changes are missing coverage. Please review.

Project coverage is 97.29%. Comparing base (9be3ff4) to head (2373352).

Files Patch % Lines
lobsterpy/cohp/describe.py 44.44% 5 Missing :warning:
Additional details and impacted files ```diff @@ Coverage Diff @@ ## main #265 +/- ## ========================================== - Coverage 97.48% 97.29% -0.19% ========================================== Files 12 12 Lines 2659 2666 +7 ========================================== + Hits 2592 2594 +2 - Misses 67 72 +5 ```

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