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Adsorption of tetralin and hydrogenated intermediates and products on the (100) surfaces of Ir, Pt and Pd: a DFT study

✍ Scribed by Xiang Li; Madaliene S. M. Wong; Kok Hwa Lim


Book ID
105886488
Publisher
Springer
Year
2010
Tongue
English
Weight
728 KB
Volume
127
Category
Article
ISSN
1432-2234

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## Abstract Density functional theory (DFT) calculations have been performed to determine the interaction energy between a CO probe molecule and all atoms from the first three rows of the periodic table coadsorbed on Rh(100), Pd(100) and Ir(100) metal surfaces. Varying the coverage of CO or the coa