P-Tu-BRC-39 Theory of Alkyl Adsorption on Transition Metal Surfaces: Effects of Metal Composition and Adsorbate Structure

Tuesday, June 4, 2013
Ballroom C (Galt House Hotel)
Matthew M. Montemore and J. Will Medlin, University of Colorado, USA.
We propose modifications to both the d-band model and scaling relations to improve their accuracy and scope. The resulting models are useful for screening catalytic surfaces, and we apply them to hydrocarbons and atomic H on a wide variety of transition metal surfaces.

Extended Abstracts: