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pyscf
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Grade
Name
Complexity
Churn
Issues
A
pyscf\cc\ccsd_lambda.py
24 5 -
A
pyscf\lib\dft\xcfun_itrf.c
23 4 1
A
pyscf\gto\ft_ao.py
23 6 -
A
pyscf\grad\tdrhf.py
23 13 -
A
pyscf\grad\lagrange.py
23 7 -
A
pyscf\grad\cisd.py
23 14 -
A
pyscf\geomopt\geometric_solver.py
23 14 1
A
pyscf\mp\dfmp2.py
23 15 -
A
pyscf\lib\test\test_numpy_helper.py
23 6 -
A
pyscf\pbc\gto\test\test_cell.py
23 6 -
A
pyscf\pbc\ao2mo\eris.py
23 2 -
A
pyscf\dft\dks.py
23 18 1
A
pyscf\df\incore.py
23 14 -
A
pyscf\tdscf\uks.py
23 18 -
A
pyscf\soscf\test\test_newton_ah.py
23 5 -
A
pyscf\solvent\test\test_pol_embed.py
23 6 -
A
pyscf\pbc\grad\krks.py
23 4 -
A
pyscf\cc\qcisd_slow.py
23 1 -
A
pyscf\ao2mo\incore.py
23 7 -
A
pyscf\pbc\gto\pseudo\test\test_pp.py
23 2 -