Methyl chemisorption on Ni(111) and C-H-M multicentre bonding: A density functional theory study

Surface Science

Volumn 437, Issue 3, 1999, Pages 362-376

  Michaelides, A ^a   Hu, P ^a  

^a QUEEN'S UNIVERSITY BELFAST   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; CRYSTAL ORIENTATION; CRYSTAL SYMMETRY; FUNCTIONS; GAS ADSORPTION; MAGNETIC MATERIALS; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; NICKEL;

DENSITY FUNCTIONAL THEORY (DFT); METHYL; THREE-CENTER BONDING;

CHEMISORPTION;

EID: 0032659704     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(99)00700-1     Document Type: Article

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