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[pre-commit.ci] auto fixes from pre-commit.com hooks

74899d3
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Melting: Edit structure related functions #637

[pre-commit.ci] auto fixes from pre-commit.com hooks
74899d3
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Codecov / codecov/project failed May 19, 2026 in 0s

84.86% (-2.07%) compared to 3670e95

View this Pull Request on Codecov

84.86% (-2.07%) compared to 3670e95

Details

Codecov Report

❌ Patch coverage is 42.85714% with 8 lines in your changes missing coverage. Please review.
✅ Project coverage is 84.86%. Comparing base (3670e95) to head (74899d3).

Files with missing lines Patch % Lines
src/atomistics/calculators/lammps/melting.py 42.85% 8 Missing ⚠️
Additional details and impacted files
@@               Coverage Diff               @@
##           melting_cna     #637      +/-   ##
===============================================
- Coverage        86.92%   84.86%   -2.07%     
===============================================
  Files               44       44              
  Lines             2501     2504       +3     
===============================================
- Hits              2174     2125      -49     
- Misses             327      379      +52     

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