Chemisorption of small molecules on palladium in terms of local density functional calculations

Surface Science

Volumn 357-358, Issue , 1996, Pages 609-613

  Kito, T ^a   Eberhart, M E ^a  

^a Department of Geology and Geological Engineering   (United States)

Author keywords

Alcohols; Aldehydes; Catalysis; Density functional calculations; Palladium

Indexed keywords

ALDEHYDES; ALLOYING; CALCULATIONS; CATALYSTS; CHEMISORPTION; COMPUTER SIMULATION; DISSOCIATION; ELECTRONIC STRUCTURE; ETHANOL; METHANOL;

DENSITY FUNCTIONAL CALCULATIONS; ELECTRONIC STRUCTURE THEORY; HYBRIDIZATION;

PALLADIUM;

EID: 0030165242     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/0039-6028(96)00231-2     Document Type: Article

References (5)

1. C.N. Satterfield, Heterogeneous Catalysis in Industrial Practice, 2nd ed. (McGraw-Hill, New York, 1991).
2. D.T. Wickham, B.W. Logsdon, S.W. Cowley and C.D. Butler, J. Catal. 128 (1991) 198.
3. J. Wittayakun, MS Thesis, Colorado School of Mines (Golden, 1995).
4. K.H. Johnson, J. Chem. Phys. 45 (1966) 3085.
5. E.J. Cairns and A.D. Tevebaugh, J. Chem. Eng. Data 9 (1964) 453.