master
pyscf
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Grade
Name
Complexity
Churn
Issues
C
pyscf\gto\mole.py
585 72 6
A
pyscf\scf\hf.py
286 53 1
A
pyscf\lib\misc.py
186 34 -
A
pyscf\dft\libxc.py
138 31 1
A
pyscf\soscf\newton_ah.py
129 30 2
A
pyscf\df\df_jk.py
53 30 1
A
pyscf\pbc\df\df.py
139 27 1
A
pyscf\mcscf\addons.py
111 27 1
A
pyscf\gto\test\test_mole.py
86 26 -
A
pyscf\scf\dhf.py
151 26 -
A
pyscf\__init__.py
3 25 -
A
setup.py
11 25 -
A
pyscf\mcscf\mc1step.py
140 25 2
A
pyscf\x2c\x2c.py
158 25 -
A
pyscf\solvent\ddcosmo.py
84 25 -
A
pyscf\cc\ccsd.py
210 25 1
A
pyscf\dft\rks.py
67 24 1
A
pyscf\lib\numpy_helper.py
194 23 3
A
pyscf\cc\uccsd.py
134 22 -
A
pyscf\scf\uhf.py
168 22 1