754 Fundamentals of Surface Reactivity II

Thursday, November 1, 2012: 3:15 PM
317 (Convention Center )
Description:
The session is focused on intrinsic kinetics and reaction pathways on surfaces with studies on surface science, modeling and catalytic reactions. Specific topics include: adsorption of reactants; identification of transition states; electronic structure and geometry of catalytic surfaces; and development of experimental and theoretical methods.

Sponsor:
Catalysis and Reaction Engineering Division

Chair:
Eranda Nikolla
Email: erandan@wayne.edu

Co-Chair:
Suljo Linic
Email: linic@umich.edu


3:15 PM
(754a) Nanoscaling Effects On the Electronic Structure of TiO2 Supported Gold Nanoparticles and Their Impact On Electrocatalytic CO Oxidation
Benjamin N. Reinecke, Hirohito Ogasawara, Lin Li, Kendra P. Kuhl, Anders Nilsson and Thomas F. Jaramillo

3:35 PM
(754b) Surface Reactivity From First Principles: Modeling Temperature Programmed Desorption of Oxygen From Platinum Surfaces
Jason M. Bray, David J. Schmidt and William F. Schneider

3:55 PM
(754c) Surface Chemistry of TiO2: Hydrophilic or Hydrophobic
Liangliang Huang, Luzheng Zhang, Adri C.T. van Duin, Xiao-Hua Lu and Keith E. Gubbins

4:15 PM
(754d) A Combined Experimental and Theoretical Study On CO Oxidation Mechanism Over Au38-Derived Au/TiO2 Catalyst
Sarthak Gaur, Ming He, Zili Wu, David Bruce, Challa S.S.R. Kumar and James J. Spivey

4:35 PM
(754e) Mechanistic Studies On the Size Effect of Cobalt Nanoparticles On CO Oxidation
Nianthrini Balakrishnan, Bijith Mankidy, Vinay Gupta, Babu Joseph and Venkat Bhethanabotla

4:55 PM
(754f) Oxygen Vacancy-Promoted Formation of Enolate Species On Reduced CeO2-x(111) Surfaces
Ye Xu, Florencia C. Calaza, David R. Mullins and Steven H. Overbury

5:15 PM
(754g) Isoamyl Acetate Esterification: Kinetic and Adsorption Study
Yoshinori A. Casas, Natalia R. Montoya, Alvaro Orjuela and Gerardo Rodriguez
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