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Volumn 513, Issue 2, 2002, Pages 315-327

Density functional study of the adsorption of 1,4-cyclohexadiene on Pt(1 1 1): Origin of the C-H stretch red shift

(4) Saeys, Mark a Reyniers, Marie Françoise a Marin, Guy B a Neurock, Matthew b

b University of Virginia (United States)

Author keywords

Alkenes; Aromatics; Chemisorption; Density functional calculations; Low index single crystal surfaces; Models of surface chemical reactions; Platinum; Single crystal surfaces; Vibrations of adsorbed molecules

Indexed keywords

ADSORPTION; CHEMICAL BONDS; CHEMISORPTION; CONFORMATIONS; MOLECULES; PROBABILITY DENSITY FUNCTION; SINGLE CRYSTALS; SURFACE REACTIONS; SURFACES;

AROMATICS;

PLATINUM;

EID: 0036645227 PISSN: 00396028 EISSN: None Source Type: Journal
DOI: 10.1016/S0039-6028(02)01775-2 Document Type: Article

Times cited : (27)

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