Ethanol adsorption on SrTiO3 surfaces

Using a quantum chemical method developed for crystalline systems and a periodic large unit cell (LUC) model, ethanol, CH3CH2OH, adsorption on the SrTiO3 (001) surfaces is studied, considering both cubic and tetragonal lattices of the crystal. The investigation is carried out for the ethanol molecul...

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Bibliographic Details
Main Author: Stashans, A. (author)
Other Authors: Torres, J. (author), Viteri, R. (author)
Format: article
Published: 2006
Subjects:
Online Access:http://dspace.utpl.edu.ec/handle/123456789/19215
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