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doc_legacy\source\conf.py
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examples\qmmm\11-soscf.py
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examples\cc\11-frozen_core.py
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examples\gto\03-ghost_atom.py
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examples\qmmm\20-grad.py
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examples\gto\04-input_basis.py
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examples\qmmm\22-with_solvent.py
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pyscf\grad\__init__.py
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examples\scf\00-simple_hf.py
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examples\cc\12-reuse_integrals.py
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examples\gto\05-input_ecp.py
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examples\scf\01-h2o.py
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examples\scf\02-ghf.py
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examples\gto\06-load_mol_from_chkfile.py
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examples\scf\02-rohf_uhf.py
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examples\scf\03-level_shift.py
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examples\cc\13-standalone_ccsd_t.py
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examples\gto\07-nucmod.py
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examples\scf\04-dirac_hf.py
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pyscf\grad\roks.py
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