Adsorption and dissociation of methanol on Au(1 1 1) surface: A first-principles periodic density functional study

Journal of Molecular Structure: THEOCHEM

Volumn 770, Issue 1-3, 2006, Pages 87-91

  Chen, Wen Kai ^a   Liu, Shu Hong ^a   Cao, Mei Juan ^a   Yan, Qian Gu ^b   Lu, Chun Hai ^c  

^a FUZHOU UNIVERSITY   (China)

^b MISSISSIPPI STATE UNIVERSITY   (United States)

^c RESEARCH CENTER OF LASER FUSION   (China)

Author keywords

Adsorption; Density functional theory; Formaldehyde; Gold; Methanol; Vibrational frequencies

Indexed keywords

EID: 33748487131     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2006.05.040     Document Type: Article

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