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Stabilizing small particles of lithium hydroxide with adsorbed water molecules: a quantum chemical study

Stabilizing small particles of lithium hydroxide with adsorbed water molecules: a quantum chemical study

Quantum chemical calculations have been carried out of the energetic and geometric characteristics of the lithium hydroxide molecular models within the frameworks of both semiempirical (the MNDO method) and ab initio (the STO-3G and 6-31G basises being used) approaches. The adsorption of water molec...

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Bibliographic Details
Main Author: Grebenyuk, A.G.
Format: Article
Language:English
Published: Інститут хімії поверхні ім. О.О. Чуйка НАН України 2002
Series:Поверхность
Subjects:
Surface properties of inorganic materials
Online Access:http://dspace.nbuv.gov.ua/handle/123456789/126354
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http://dspace.nbuv.gov.ua/handle/123456789/126354

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