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Issues
A
pyscf\pbc\dft\__init__.py
6 3 -
A
pyscf\pbc\df\test\test_rsdf.py
6 1 -
A
pyscf\pbc\scf\test\test_scfint.py
6 2 -
A
pyscf\pbc\df\test\test_mdf_ao2mo.py
6 4 -
A
pyscf\pbc\scf\test\test_stability.py
6 2 -
A
examples\pbc\41-pbc1d_real_space_sum.py
6 2 -
A
examples\2-benchmark\benchmarking_utils.py
6 1 -
A
pyscf\pbc\cc\test\test_eom_kgccsd.py
6 3 -
A
pyscf\symm\test\test_Dmatrix.py
6 2 -
A
pyscf\grad\ccsd_t.py
6 4 -
A
pyscf\mcscf\test\test_umc1step.py
6 2 -
A
pyscf\mcscf\test\test_newton_casscf.py
6 4 -
A
pyscf\lo\test\test_orth.py
6 3 -
A
examples\cc\42-as_casci_fcisolver.py
6 4 -
A
pyscf\lib\test\test_misc.py
6 2 -
A
pyscf\adc\test\test_radc\test_dfadc_N2.py
6 2 -
A
pyscf\adc\test\test_uadc\test_dfadc_OH.py
6 2 -
A
pyscf\agf2\test\test_c_agf2.py
6 1 -
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pyscf\agf2\test\test_uagf2_slow_beh.py
6 1 -
A
pyscf\scf\chkfile.py
6 2 -