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Molecular Orbitals for Oxonium (H3O+) and Hydroxide (OH) Ions


H3O+ molecular orbitals


OH- molecular orbitals



The molecular orbitals were calculated using the Restricted Hartree-Fock wave function (RHF) with 6-31G** basis set. The calculated energies (eV) are given. Interactive structures with orbitals are available (COW only, H3O+ [Plug-in, ActiveX] and OH [Plug-in, ActiveX])



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This page was established in 2002 and last updated by Martin Chaplin on 7 October, 2021

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