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adapt for QCSchema v2 and Python v3.14 #170

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Codecov / codecov/project succeeded Mar 22, 2026 in 0s

65.87% (+0.08%) compared to 87efc01

View this Pull Request on Codecov

65.87% (+0.08%) compared to 87efc01

Details

Codecov Report

❌ Patch coverage is 90.62500% with 3 lines in your changes missing coverage. Please review.
✅ Project coverage is 65.87%. Comparing base (87efc01) to head (a57a472).

Files with missing lines Patch % Lines
python/dftd3/qcschema.py 90.62% 3 Missing ⚠️
Additional details and impacted files
@@            Coverage Diff             @@
##             main     #170      +/-   ##
==========================================
+ Coverage   65.78%   65.87%   +0.08%     
==========================================
  Files          34       34              
  Lines        4782     4800      +18     
  Branches     1668     1668              
==========================================
+ Hits         3146     3162      +16     
- Misses        683      685       +2     
  Partials      953      953              

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