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examples\mcscf\16-density_fitting.py
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examples\dft\12-camb3lyp.py
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examples\mcscf\18-o2_spatial_spin_symmetry.py
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examples\agf2\01-simple_uagf2.py
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examples\mcscf\19-frozen_orbital.py
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examples\dft\24-custom_xc_functional.py
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examples\mcscf\21-active_space_symmetry.py
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docker\conda-env\Dockerfile
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examples\mcscf\22-x2c.py
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examples\dft\30-ao_value_on_grid.py
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examples\mcscf\24-callback.py
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examples\agf2\03-photoemission_spectra.py
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examples\1-advanced\002-input_script.py
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examples\agf2\10-dyson_orbitals.py
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examples\fci\15-FCI_hamiltonian.py
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examples\fci\30-h6_scan.py
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examples\ao2mo\00-mo_integrals.py
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examples\fci\31-apply_2nd_quantized_op.py
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examples\fci\32-wfn_overlap.py
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examples\dft\32-broken_symmetry_dft.py
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