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pyscf
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Complexity
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Issues
A
pyscf\lib\vhf\rah_direct_dot.c
35 2 -
A
pyscf\mcscf\mc_ao2mo.py
35 6 1
A
pyscf\agf2\chkfile.py
35 4 1
A
pyscf\scf\test\test_jk.py
35 2 -
A
pyscf\fci\rdm.py
34 4 -
A
pyscf\tdscf\test\test_tdrks.py
34 5 -
A
pyscf\scf\stability_slow.py
34 4 -
A
pyscf\x2c\test\test_x2c_hess.py
34 2 -
A
pyscf\gto\test\test_moleintor.py
34 3 -
A
pyscf\tools\cubegen.py
34 3 -
A
pyscf\mcscf\test\test_addons.py
34 4 -
A
pyscf\pbc\tdscf\test\test_kproxy_supercell_ks.py
33 1 -
A
pyscf\fci\test\test_rdm.py
33 2 -
A
pyscf\grad\dhf.py
33 9 -
A
pyscf\mcscf\dmet_cas.py
33 4 1
A
pyscf\pbc\dft\rks.py
33 16 1
A
pyscf\cc\rintermediates.py
33 5 -
A
pyscf\pbc\mp\test\test_mask_uhf.py
32 2 -
A
pyscf\pbc\dft\krks.py
32 13 1
A
pyscf\grad\casci.py
32 13 -