Kinetic Modeling of Nitrous Oxide Decomposition on Fe-Zsm-5 Based on Parameters Obtained from a Comprehensive Dft Study
Andreas Heyden1, Alexis T. Bell2 and Frerich J. Keil1, (1)Department of Chemical Engineering, Hamburg University of Technology, Hamburg, D-21073, Germany, (2)University of California, Berkeley, Department of Chemical Engineering, 107 Gilman Hall, Berkeley, CA 94720 |
Nano-Scale Effects in the Reactivity of Pt Clusters toward Co Oxidation
Ye Xu, Computer Science and Mathematics Division, Oak Ridge National Laboratory, P.O. Box 2008, MS-6367, Oak Ridge, TN 37831-6367, William A. Shelton Jr., Computer Science and Mathematics Division, Oak Ridge National Laboratory, P.O. Box 2008, MS-6367, Oak Ridge, TN 37831-6367 and William F. Schneider, University of Notre Dame, 182 Fitzpatrick Hall, Notre Dame, IN 46556 |
Heterogeneous Catalysis by Gold: Dft Investigations of O2 Interactions with Oxide Supported Gold Materials
Suljo Linic, Siris Laursen and Peter Larkowski, Department of Chemical Engineering, University of Michigan, 2300 Hayward, Ann Arbor, MI 48109-2125 |
Promotional Effect of Fe on the Wgs Activity of Pd and Pt Based Catalysts
Shampa Kandoi, Lutz Koerner, Franz Keller, James A. Dumesic and Manos Mavrikakis, Department of Chemical Engineering, University of Wisconsin - Madison, 1415 Engineering Dr., Madison, WI 53706 |
Insights into the Electrochemical Oxygen Reduction Reaction through Density Functional Theory
Matthew P. Hyman and Will Medlin, University of Colorado, Dept. of Chemical and Biological Engineering, ECCH 111, UCB 424, Boulder, CO 80309 |
Light Alkane Dehydrogenation Activity for [Gah]2+ Sites Involving Two Framework Aluminum in Ga-Hzsm-5 Catalysts: a Dft Pathway Analysis
Yogesh V. Joshi, Purdue University, FRNY 117B 480 Stadium Mall Drive, West Lafayette, IN 47907-2100 and Kendall T. Thomson, School of Chemical Engineering, Purdue University, FRNY 117B 480 Stadium Mall Drive, West Lafayette, IN 47907-2100 |
Catalytic Role of Defective Carbon Substrates in the Dissociation of Water
Milen K. Kostov, Erik E. Santiso, Aaron M. George, Marco B. Nardelli and Keith E. Gubbins, North Carolina State University, Raleigh, NC 27695 |
Theoretical Studies of Oxygen Reduction Intermediates on Pt - Co Alloys
Eduardo J. Lamas and Perla B. Balbuena, Chemical Engineering, Texas A&M, 3122 TAMU, College Station, TX 77843 |