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pyscf
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Name
Complexity
Churn
Issues
A
pyscf\eph\uhf.py
8 3 -
A
examples\grad\05-ccsd_grad.py
 2 -
A
pyscf\fci\__init__.py
22 6 1
A
examples\pbc\36-ccsd_level_shift.py
1 1 -
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pyscf\fci\cistring.py
77 5 -
A
.github\workflows\ci_linux\deps_apt.sh
 1 -
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pyscf\fci\direct_nosym.py
19 4 -
A
examples\pbc\41-pbc1d_real_space_sum.py
6 2 -
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pyscf\fci\direct_spin0_symm.py
50 7 -
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examples\grad\10-excited_state_cisd_grad.py
 2 -
A
pyscf\fci\direct_uhf.py
35 4 -
A
examples\pbc\44-k_point_eom_ccsd_ghf.py
 1 -
A
.github\workflows\ci_linux\build_pyscf.sh
 7 1
A
.github\workflows\ci_macos\deps_apt.sh
 2 -
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conda\build.sh
 3 -
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examples\1-advanced\018-dmrg_casscf_for_feporph.py
3 1 -
A
examples\ao2mo\01-outcore.py
 1 -
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examples\fci\33-rotate_wfn.py
 2 -
A
examples\pbc\05-input_pp.py
 1 -
A
pyscf\df\__init__.py
1 3 -