Weak molecular chemisorption of  N2/Pt(111)

The ordering in a higher-order-commensurate monolayer solid of Pt(111)-(3 × 3)-4 N₂, which has coexisting physisorbed and weakly chemisorbed N₂ species, is analyzed with model calculations. Density functional theory calculations are also used to evaluate properties of chemisorbed N₂ in a (2 × 2) uni...

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Veröffentlicht in:Journal of physics. Condensed matter 2009-07, Vol.21 (26), p.264009
Hauptverfasser: Bruch, L W, Nabar, R P, Mavrikakis, M
Format: Artikel
Sprache:eng
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Zusammenfassung:The ordering in a higher-order-commensurate monolayer solid of Pt(111)-(3 × 3)-4 N₂, which has coexisting physisorbed and weakly chemisorbed N₂ species, is analyzed with model calculations. Density functional theory calculations are also used to evaluate properties of chemisorbed N₂ in a (2 × 2) unit cell on Pt(111). The relation of these results to the orientational ordering of N₂ on other metal surfaces is discussed.
ISSN:0953-8984
1361-648X
DOI:10.1088/0953-8984/21/26/264009