Computer simulation of the structure and proton transport in orthoiodates

Authors
Zyubina, TS Shilov, GV Dobrovolsky, YA Atovmyan, LO Chernyak, AV Leonova, LS Ukshe, AE
Citation
Ts. Zyubina et al., Computer simulation of the structure and proton transport in orthoiodates, SOL ST ION, 145(1-4), 2001, pp. 459-462
Citations number
2
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
SOLID STATE IONICS
ISSN journal
01672738 → ACNP
Volume
145
Issue
1-4
Year of publication
2001
Pages
459 - 462
Database
ISI
SICI code
0167-2738(200112)145:1-4<459:CSOTSA>2.0.ZU;2-#
Abstract
The crystal structure and proper-ties of CsH4IO6 . H5IO6 have been studied by electrochemistry, X-ray methods, and calculated by density functional th eory (DFT) methods. High protonic conductivity in crystals of CsH4IO6 . H5I O6 has been discovered and is discussed. (C) 2001 Published by Elsevier Sci ence B.V.