Photovoltaics literature survey (No. 110)

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چکیده

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IJMCM Vol 2, No 7 p 110-117 Dr Zabihi

1. Dental Materials Research Center, School of Dentistry, Babol University of Medical Sciences, Babol, Iran. 2. Department of Bacteriology and Virology, School of Medicine, Alborz University of Medical Sciences, Karaj, Iran. 3. Cellular and Molecular Biology Research Center (CMBRC), Babol University of Medical Sciences, Babol, Iran. 4. Department of Pharmacology & Physiology, School of Medicine...

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DFT–LDA study of NO adsorption on Rh(110) surface

We examine the interaction between NO and the Rh(110) surface using ab initio DFT–LDA pseudo-potential plane-wave total energy calculations. Four different adsorption sites for perpendicular NO are considered. The short-bridge site with linear NO is found to be the optimal adsorption configuration. It is also possible for NO to bond parallel to the surface, and this may be the precursor to NO d...

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NO adsorption and diffusion on hydroxylated rutile TiO2(110).

We report a computational study of NO adsorption and diffusion on the hydroxylated rutile TiO2(110) surface performed with density functional theory (DFT) calculations corrected by on-site Coulomb corrections and long-range dispersion interactions. NO prefers to adsorb with its N-end down at surface Ti5c sites. The excess electron that is located at a subsurface site for the hydroxylated surfac...

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ژورنال

عنوان ژورنال: Progress in Photovoltaics: Research and Applications

سال: 2014

ISSN: 1062-7995

DOI: 10.1002/pip.2492