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ChemInform Abstract: A Theoretical Study of the Structures of Flavin in Different Oxidation and Protonation States.

โœ Scribed by Y.-J. ZHENG; R. L. ORNSTEIN

Publisher
John Wiley and Sons
Year
2010
Weight
25 KB
Volume
28
Category
Article
ISSN
0931-7597

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ChemInform Abstract: Theoretical Study of the Intercalation of Li into TiO2 Structures.
โœ Lubomir Benco; Jean-Luc Barras; Claude Auguste Daul; Erich Deiss ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› John Wiley and Sons โš– 28 KB ๐Ÿ‘ 1 views

Theoretical Study of the Intercalation of Li into TiO 2 Structures. -First principles LAPW (linearized augmented plane wawe) and semiempirical EHT methodology is used to characterize the bonding in LiTi 2 O 4 (spinel) and LiTiO 2 (trigonal) as well as the corresponding Li-extracted TiO 2 structures.