Electronic Structure of S[O.sub.3]H Functional Groups and Proton Mobility in Nafion and Aquivion Ionomer Membranes

Electronic Structure of S[O.sub.3]H Functional Groups and Proton Mobility in Nafion and Aquivion Ionomer Membranes

The electronic structure of S[O.sub.3]H functional groups in Nafion and Aquivion monomers was calculated. The effect of charge states of the functional group atoms on the proton mobility was studied. Keywords: Nafion, Aquivion, ionomer membranes, electronic structure, density functional theory DOI:...

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Veröffentlicht in:Russian journal of general chemistry 2019-03, Vol.89 (3), p.553
Hauptverfasser: Petrov, A.V, Murin, I.V
Format: Artikel
Sprache:eng
Schlagworte:
Density functionals
Fluorine compounds
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Zusammenfassung:The electronic structure of S[O.sub.3]H functional groups in Nafion and Aquivion monomers was calculated. The effect of charge states of the functional group atoms on the proton mobility was studied. Keywords: Nafion, Aquivion, ionomer membranes, electronic structure, density functional theory DOI: 10.1134/S1070363219030320
ISSN:1070-3632
DOI:10.1134/S1070363219030320