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FermiQC / Fermi.jl

Fermi quantum chemistry program
MIT License
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Use libcint_jll instead of cmake in deps/build.jl (#111) #112

Closed carstenbauer closed 2 years ago

carstenbauer commented 2 years ago

Works locally, i.e. the test suite ran successfully.

Closes #111

codecov[bot] commented 2 years ago

Codecov Report

Merging #112 (55da6a0) into master (5751862) will increase coverage by 0.24%. The diff coverage is n/a.

Impacted file tree graph

@@            Coverage Diff             @@
##           master     #112      +/-   ##
==========================================
+ Coverage   63.49%   63.73%   +0.24%     
==========================================
  Files          41       41              
  Lines        3301     3323      +22     
==========================================
+ Hits         2096     2118      +22     
  Misses       1205     1205
Impacted Files Coverage Δ
src/Backend/Libcint.jl 73.91% <ø> (+1.18%) :arrow_up:
src/Core/AtomicIntegrals.jl 100.00% <0.00%> (ø)
src/Methods/CoupledCluster/CoupledCluster.jl 100.00% <0.00%> (ø)
src/Core/IntegralHelper.jl 94.73% <0.00%> (+0.21%) :arrow_up:
src/Core/ROIntegrals.jl 24.80% <0.00%> (+0.23%) :arrow_up:
src/Backend/Contract.jl 93.47% <0.00%> (+0.45%) :arrow_up:
src/Backend/Arrays.jl 86.73% <0.00%> (+0.86%) :arrow_up:
src/Core/Orbitals.jl 83.33% <0.00%> (+1.51%) :arrow_up:

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