| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394762 | Computational and Theoretical Chemistry | 2012 | 4 Pages |
Abstract
⺠We study hydration structure of Nafion ionomer with quantum chemical calculations. ⺠Trifluoromethanesulfonate (TFMS) uses as a model for Nafion ionomer. ⺠Hydration of TFMS induces deprotonation and formation of hydronium anion. ⺠Frequencies of O-H stretching modes increase, deformation modes decrease with number of H+(H2O)n. ⺠Hydration energies of TFMS decrease with increasing number of deprotonated anion.
Related Topics
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Chemistry
Physical and Theoretical Chemistry
Authors
Dodik Kurniawan, Shigeaki Morita, Kuniyuki Kitagawa,