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  • 281 issues
  • 0 pull requests
  • 1,225 files
  • 1 active branch

CodeFactor Rating A

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Grade
Name
Complexity
Churn
Issues
A
examples\qmmm\11-newton.py
1 -
A
examples\qmmm\11-soscf.py
1 -
A
examples\qmmm\20-grad.py
1 -
A
examples\qmmm\22-with_solvent.py
4 -
A
examples\qmmm\30-force_on_mm_particles.py
8 2 -
A
examples\scf\00-simple_hf.py
2 -
A
examples\scf\01-h2o.py
3 -
A
examples\scf\02-ghf.py
1 -
A
examples\scf\02-rohf_uhf.py
2 -
A
examples\scf\03-level_shift.py
2 -
A
examples\scf\04-dirac_hf.py
1 -
A
examples\scf\05-breit_gaunt.py
1 -
A
examples\scf\10-glycine.py
1 -
A
examples\scf\11-linear_dep.py
1 -
A
examples\scf\12-fast_newton.py
2 -
A
examples\scf\13-symmetry.py
3 -
A
examples\scf\14-restart.py
3 -
A
examples\scf\15-initial_guess.py
4 -
A
examples\scf\16-h2_scan.py
1 -
A
examples\scf\17-stability.py
4 2 -
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