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Seed a bridging hydrogen's TS distances from measured data - #1035

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fix_pauling_delta_bond_order
Open

Seed a bridging hydrogen's TS distances from measured data#1035
calvinp0 wants to merge 1 commit into
mainfrom
fix_pauling_delta_bond_order

Seed a bridging hydrogen's TS distances from measured data, and stop …

5e63aed
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Codecov / codecov/project succeeded Aug 31, 2026 in 0s

65.57% (+0.03%) compared to c5e700b

View this Pull Request on Codecov

65.57% (+0.03%) compared to c5e700b

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Codecov Report

✅ All modified and coverable lines are covered by tests.
✅ Project coverage is 65.57%. Comparing base (c5e700b) to head (5e63aed).

Additional details and impacted files
@@            Coverage Diff             @@
##             main    #1035      +/-   ##
==========================================
+ Coverage   65.53%   65.57%   +0.03%     
==========================================
  Files         120      120              
  Lines       40468    40480      +12     
  Branches    10430    10431       +1     
==========================================
+ Hits        26519    26543      +24     
+ Misses      10946    10937       -9     
+ Partials     3003     3000       -3     

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