Vibrationally averaged spin densities on muons and protons in the hydroxyl and ethyl radicals
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The observations of the residual isotope effect for muonated radicals are discussed using calculations on the hydroxyl and ethyl radicals. The origins are partly due to the non-linear increase of the hyperfine coupling constants with increase in bond length, although a significant contribution comes from the anharmonicity of the molecular vibrations.
KeywordsThin Film Ethyl Hydroxyl Bond Length Significant Contribution
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