Computational Studies on Battery and Fuel Cell Materials - Low Temperature Fuel Cell

Monday, May 12, 2014: 08:00-09:20
Indian River, Ground Level (Hilton Orlando Bonnet Creek)
Chairs:
Deryn Chu and Donald Tryk
08:00
659
ORR on the Different Surfaces with Different Adsorbents: First Principles Molecular Dynamics Simulations
T. Ikeshoji (Fuel Cell Cutting-Edge Center Technology Research Association, National Institute of Advanced Industrial Science and Technology), M. Otani (National Institute of Advanced Industrial Science and Technology), and Y. Qian (Fuel Cell Cutting-Edge Center Technology Research Association)
08:20
660
Experimental Challenges to the Theory of the Oxygen Reduction Reaction on Pt and Pt Alloys
D. A. Tryk (Fuel Cell Nanomaterials Center, University of Yamanashi), J. Omura (Interdisciplinary Graduate School of Medicine and Engineering), H. Yano, M. Wakisaka (Fuel Cell Nanomaterials Center, University of Yamanashi), T. Tsuneda (Fuel Cell Nanomaterials Center, University of Yamanashi, Japan), H. Uchida (Clean Energy Research Center, University of Yamanashi), and M. Watanabe (Fuel Cell Nanomaterials Center, University of Yamanashi)
08:40
661
Structure and Reactivity of Sub-Monolayer Pt on CeO2 Surface from First Principles Thermodynamics
A. Khetan, H. Pitsch (Institut für Technische Verbrennung), and B. Han (DGIST)
09:00
662
First Principles Modeling of Metal Nanoislands on Metal Substrates
J. A. Santana (Materials Science and Technology Division, Oak Ridge National Laboratory, Department Chemie & Catalysis Research Center, Technische Universität München), S. Krüger (Department Chemie & Catalysis Research Center, Technische Universität München), and N. Rösch (Institute of High Performance Computing, Agency for Science, Technology and Research, Singapore, Department Chemie & Catalysis Research Center, Technische Universität München)