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A
examples\mcscf\30-hf_scan\hf-scan-triplet.py
2 1 -
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examples\mcscf\30-hf_scan\hf-scan.py
2 1 -
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examples\mcscf\31-cr2_scan\cr2-scan.py
2 1 -
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pyscf\pbc\tdscf\krks.py
2 4 -
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pyscf\lo\test\test_ibo.py
2 3 -
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examples\mcscf\32-beh2_scan\BeH2-scan.py
2 1 -
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pyscf\grad\ucisd.py
2 5 -
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pyscf\pbc\gw\test\test_kugw.py
2 1 -
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pyscf\lo\test\test_nao.py
2 1 -
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pyscf\gw\test\test_ugw.py
2 1 -
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pyscf\eph\test\test_uhf.py
2 2 -
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pyscf\cc\test\test_bz.py
2 1 -
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pyscf\grad\test\test_roks.py
2 1 -
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pyscf\tools\ring.py
2 1 -
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pyscf\pbc\grad\test\test_kuhf.py
2 2 -
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pyscf\pbc\grad\test\test_krhf.py
2 2 -
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pyscf\pbc\geomopt\__init__.py
2 1 -
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examples\misc\30-macro_call_in_background.py
2 1 -
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pyscf\mcscf\test\test_mcao2mo.py
2 1 -
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examples\mrpt\02-cr2_nevpt2\cr2-scan.py
2 1 -