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nlesc-nano / nano-CAT

A collection of tools for the analysis of nanocrystals.
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Explicitly disable the frozen core approximation when running CDFT #66

Closed BvB93 closed 3 years ago

codecov[bot] commented 3 years ago

Codecov Report

Merging #66 into master will decrease coverage by 0.01%. The diff coverage is n/a.

Impacted file tree graph

@@            Coverage Diff             @@
##           master      #66      +/-   ##
==========================================
- Coverage   34.84%   34.82%   -0.02%     
==========================================
  Files          30       30              
  Lines        2121     2122       +1     
==========================================
  Hits          739      739              
- Misses       1382     1383       +1
Impacted Files Coverage Δ
nanoCAT/cdft.py 31.88% <ø> (ø)
nanoCAT/ligand_solvation.py 0.00% <0.00%> (ø)

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BvB93 commented 3 years ago

Pinging @felipeZ .