Abstract: Catalytic Ethanol Decomposition: a Case Study in Reducing Brute-Force DFT Work for Surface Reactivity by Combining BEP and Scaling Relations (21st National Annual Meeting (June 7-12, 2009))

Monday, June 8, 2009: 11:00 AM

Bayview Room (Hyatt Regency San Francisco)

Peter A. Ferrin , Chemical and Biological Engineering, University of Wisconsin-Madison, Madison, WI

Dante A. Simonetti , Chemical and Biological Engineering, University of Wisconsin-Madison, Madison, WI

Shampa Kandoi , Chemical and Biological Engineering, University of Wisconsin-Madison, Madison, WI

James A. Dumesic , Chemical and Biological Engineering, University of Wisconsin Madison, Madison, WI

Jens K. Nørskov , Department of Physics, Technical University of Denmark, Lyngby, Denmark

Manos Mavrikakis , Chemical and Biological Engineering, University of Wisconsin Madison, Madison, WI

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OE05 Catalytic Ethanol Decomposition: a Case Study in Reducing Brute-Force DFT Work for Surface Reactivity by Combining BEP and Scaling Relations