2014 AIChE Annual Meeting

Session: Fundamentals of Supported Catalysis I

This session seeks contributions on understanding the fundamentals of reactivity of supported heterogeneous catalysts based on kinetic, spectroscopic and theoretical studies. Contributions can potentially include kinetic and mechanistic studies of supported metal or bulk oxide structures as well as organic-inorganic catalyst systems.

Chair

Hari Nair, Exxon Mobil

Co-Chair

David Flaherty, University of Illinois At Urbana-Champaign

Presentations

03:15 PM

(188a) Quantitative Analysis of Light-Off Profiles for Kinetic Parameters
Daniel Coller, Susannah L. Scott

03:35 PM

(188b) Prevalence of Bimolecular Activation Routes for CO, NO, and O2 at Catalytically Relevant Coverages on Metal Catalysts
David D. Hibbitts, Enrique Iglesia

03:55 PM

(188c) Multi-Scale Investigation of Pd/Ceria Catalysts Via Density Functional Theory and Classical Reaxff Simulations
Thomas Patrick Senftle, Adri C.T. van Duin, Michael J. Janik

04:15 PM

(188d) Catalyst/Support Interactions Between Pt Nanoparticles and Amorphous Silica Using Density Functional Theory
Christopher S. Ewing, MichaelJ. Hartmann, Daniel S. Lambrecht, Götz Veser, Joseph J. McCarthy, J. Karl Johnson, Allison M. Musto, Elliott M. Weiss, Kaitlin R. Martin, Surya Padinjarekutt

04:35 PM

(188e) Kinetic Study of Propane Dehydrogenation over Chromia-Alumina Catalyst
Shuai Tan, Seung-Won Choi, Seok-Jhin Kim, David Sholl, Sankar Nair, Christopher Jones, Jason Moore, Yujun Liu, Ravindra Dixit, John Pendergast

04:55 PM

(188f) Experimental and Simulation Study of Selective Ammonia Oxidation on Multi-Functional Washcoated Monolith Catalysts
Sachi Shrestha, Michael P. Harold, Aleksey Yezerets, Krishna Kamasamudram

05:15 PM

(188g) Magnetic Nano-Fe3O4-Supported Organocatalysts By Click Reaction: Asymmetric Reduction of Imines with Trichlorosilane Catalyzed By Valine-Derived Formamide Immobilized Onto Magnetic Nano-Fe3O4
Chao Qian, Xinzhi Chen, Yunbin Chen, Lie Feng, Xin Ge