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pyscf
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examples\mcscf\50-casscf_then_dmrgscf.py
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pyscf\cc\test\test_addons.py
4 1 -
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examples\agf2\07-scs_agf2.py
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pyscf\cc\test\test_ccsd_lambda.py
3 2 -
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examples\mcscf\50-cornell_shci_casscf.py
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pyscf\cc\test\test_dfccsd.py
16 6 -
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examples\fci\10-spin.py
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pyscf\cc\test\test_eom_rccsd.py
53 3 -
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examples\mcscf\51-o2_triplet_by_various_fci.py
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pyscf\cc\test\test_gccsd.py
13 5 -
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.github\workflows\run_tests.sh
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examples\mcscf\61-rcas_vs_ucas\o2-scan.py
4 1 -
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.codecov.yml
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.github\workflows\ci_linux\build_pyscf.sh
 7 1
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.github\workflows\ci_macos\deps_apt.sh
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conda\build.sh
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examples\1-advanced\018-dmrg_casscf_for_feporph.py
3 1 -
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examples\ao2mo\01-outcore.py
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examples\fci\33-rotate_wfn.py
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examples\pbc\05-input_pp.py
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