Density functional study of acetylene and ethylene adsorption on Ni(111)

Surface Science

Volumn 371, Issue 1, 1997, Pages 53-62

  Fahmi, A ^a   Van Santen, R A ^a  

^a EINDHOVEN UNIVERSITY OF TECHNOLOGY   (Netherlands)

Author keywords

Alkenes; Alkynes; Chemisorption; Density functional calculations; Nickel; Single crystal surfaces

Indexed keywords

ACETYLENE; ADSORPTION; CALCULATIONS; CHEMISORPTION; ELECTRONS; ETHYLENE; MOLECULAR ORIENTATION; NICKEL; OLEFINS; PARAFFINS;

ADSORBATE FRONTIER ORBITALS; DENSITY FUNCTIONAL CALCULATIONS; METAL CLUSTER ORBITALS; SINGLE CRYSTAL SURFACES;

SURFACES;

EID: 0030833993     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(96)00974-0     Document Type: Article

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