FermiQC / Fermi.jl

Fermi quantum chemistry program
MIT License
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New tests and GaussianBasis.jl #110

Closed gustavojra closed 2 years ago

gustavojra commented 2 years ago
codecov[bot] commented 2 years ago

Codecov Report

Merging #110 (c458f0c) into master (5751862) will decrease coverage by 4.90%. The diff coverage is 87.50%.

Impacted file tree graph

@@            Coverage Diff             @@
##           master     #110      +/-   ##
==========================================
- Coverage   63.49%   58.59%   -4.91%     
==========================================
  Files          41       35       -6     
  Lines        3301     2676     -625     
==========================================
- Hits         2096     1568     -528     
+ Misses       1205     1108      -97     
Impacted Files Coverage Δ
src/Backend/Arrays.jl 95.29% <ø> (+9.42%) :arrow_up:
src/Core/Integrals/ROIntegrals.jl 24.56% <ø> (ø)
src/Core/Integrals/ROIntegrals/DFERI.jl 69.04% <ø> (ø)
src/Core/Integrals/ROIntegrals/OneElectron.jl 0.00% <ø> (ø)
src/Methods/HartreeFock/RHF/RHF.jl 43.47% <ø> (+16.55%) :arrow_up:
src/Core/Integrals/ERITypes.jl 70.00% <70.00%> (ø)
src/Core/Integrals/AtomicIntegrals.jl 96.55% <96.55%> (ø)
src/Backend/Contract.jl 100.00% <100.00%> (+6.97%) :arrow_up:
src/Core/Integrals/IntegralHelper.jl 46.29% <100.00%> (ø)
src/Core/Orbitals.jl 100.00% <100.00%> (+18.18%) :arrow_up:
... and 8 more

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