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Adsorption of transition metal atoms on the NiO(100) surface and on NiO/Ag(100) thin films

โœ Scribed by Fabrizio Cinquini; Livia Giordano; Gianfranco Pacchioni


Publisher
Springer
Year
2008
Tongue
English
Weight
408 KB
Volume
120
Category
Article
ISSN
1432-2234

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Atomโ€“Molecule Interactions on Transition
โœ Davy L. S. Nieskens; Daniel Curulla-Ferrรฉ; J. W. Niemantsverdriet ๐Ÿ“‚ Article ๐Ÿ“… 2006 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 322 KB ๐Ÿ‘ 1 views

## 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