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examples\geomopt\12-excited_states.py
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examples\geomopt\12-mcscf_excited_states.py
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conda\conda_build_config.yaml
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examples\1-advanced\031-MEP.py
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examples\ao2mo\20-eri_grad_hess.py
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examples\geomopt\13-ccsd_t.py
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examples\geomopt\14-with_solvent.py
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examples\ao2mo\21-spin_orbit_coupling.py
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examples\geomopt\20-callback.py
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examples\grad\01-scf_grad.py
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examples\1-advanced\031-density.py
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examples\ao2mo\22-rkb_no_pair_ints.py
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examples\grad\02-dft_grad.py
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examples\grad\03-mp2_grad.py
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examples\cc\00-simple_ccsd.py
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examples\grad\04-cisd_grad.py
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examples\grad\05-ccsd_grad.py
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.github\workflows\ci_macos\python_deps.sh
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conda\meta.yaml
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examples\1-advanced\032-virial-ratio.py
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