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Chemical Physics Letters

Volumn 408, Issue 4-6, 2005, Pages 252-257

Theoretical study of O2 and CO adsorption on Aun clusters (n = 5-10)

(3) Fernández, Eva M a Ordejón, Pablo b Balbás, Luis C a

a UNIVERSITY OF VALLADOLID (Spain)

b INSTITUT DE CIÈNCIA DE MATERIALS DE BARCELONA ICMAB CSIC (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON MONOXIDE; DISSOCIATION; ELECTRIC CHARGE; ELECTRONIC STRUCTURE; GOLD; NATURAL FREQUENCIES; OPTIMIZATION; OXYGEN; PHOTOELECTRON SPECTROSCOPY; POLARIZATION; PROBABILITY DENSITY FUNCTION;

DISSOCIATIVE ADSORPTION (DA); GENERALIZED GRADIENT APPROXIMATION (GGA); MOLECULAR ADSORPTION (MA); VIBRATIONAL FREQUENCIES;

ADSORPTION;

EID: 19744366839 PISSN: 00092614 EISSN: None Source Type: Journal
DOI: 10.1016/j.cplett.2005.04.058 Document Type: Article

Times cited : (92)

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