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pyscf
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Grade
Name
Complexity
Churn
Issues
A
pyscf\eph\uhf.py
8 3 1
A
examples\grad\05-ccsd_grad.py
 2 -
A
pyscf\fci\__init__.py
22 6 4
A
examples\grad\06-tddft_gradients.py
 2 -
A
pyscf\fci\cistring.py
77 5 11
A
pyscf\fci\test\test_selected_ci.py
105 5 2
A
pyscf\fci\direct_nosym.py
19 4 3
A
examples\grad\10-excited_state_cisd_grad.py
 2 1
A
pyscf\fci\direct_spin0_symm.py
50 7 5
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examples\cc\01-density_matrix.py
 3 1
A
pyscf\fci\test\test_spin1_symm.py
5 5 4
A
pyscf\fci\test\test_spin1.py
11 2 2
A
pyscf\fci\test\test_cistring.py
28 2 1
A
pyscf\fci\spin_op.py
20 6 -
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pyscf\fci\direct_spin1_symm.py
80 12 6
A
pyscf\fci\direct_uhf.py
35 4 -
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conda\build.sh
 3 -
A
examples\fci\33-rotate_wfn.py
 2 1
A
examples\pbc\05-input_pp.py
 1 1
A
pyscf\df\__init__.py
1 3 -