Modeling II

Friday, 28 July 2017: 08:20-12:00
Atlantic Ballroom 1/2 (The Diplomat Beach Resort)
Chairs:
Michihisa Koyama and Yixiang Shi
08:20
328
Towards Quantification of Local Electrochemical Parameters in Microstructures of Solid Oxide Fuel Cell Electrodes using High Performance Computations
T. Hsu, R. Mahbub (Carnegie Mellon University, U.S. DOE National Energy Technology Laboratory), W. K. Epting (Oak Ridge Institute for Science and Education, U.S. DOE National Energy Technology Laboratory), H. Abernathy (AECOM, U.S. DOE National Energy Technology Laboratory), G. A. Hackett (U.S. DOE National Energy Technology Laboratory), A. D. Rollett, S. Litster (Carnegie Mellon University, U.S. DOE National Energy Technology Laboratory), and P. A. Salvador (U.S. DOE National Energy Technology Laboratory, Carnegie Mellon University)
08:40
329
Linking Initial Microstructure to Microstructure Evolution and Conductivity Change in SOFC Electrodes: A Phase Field Simulation
Y. Lei, T. L. Cheng, and Y. Wen (National Energy Technology Laboratory)
09:00
330
Investigation of La0.6Sr0.4Co0.2Fe0.8O3-δ Electrode Performance and Microstructural Evolutions Based on Three Dimensional Microstructure Reconstruction and Electrochemical Simulation
T. Shimura, A. He, Y. Kim, Z. Jiao, and N. Shikazono (Institute of Industrial Science, The University of Tokyo)
09:20
331
Density Functional Theory Modeling of A-site Cation Diffusion in Bulk LaMnO3±δ for Solid Oxide Fuel Cell Cathodes
Y. L. Lee, Y. Duan (US Dept of Energy: National Energy Technology Laboratory), D. Morgan (University of Wisconsin - Madison), D. Sorescu (US Dept of Energy: National Energy Technology Laboratory), H. Abernathy (AECOM), and G. A. Hackett (U.S. DOE National Energy Technology Laboratory)
09:40
332
First-Principles Studies of Oxygen Vacancy Interactions and Their Impact on Oxygen Migration in Lanthanum Strontium Ferrite
T. Das, J. D. Nicholas, and Y. Qi (Michigan State University)
10:00
Break
10:20
337
Full Atomistic Kinetic Monte Carlo and First Principles Study on Electromotive Force of SOFC with Direct Counting Approach
T. Tada (Tokyo Institute of Technology)
10:40
334
Predicting MSR Rates in SOFCs Using Experimental Data and CFD Methods
L. van Biert, A. Thallam Tattai, and P. V. Aravind (Delft University of Technology)
11:00
335
Multi-Scale, Multi-Physics Approach for Solid Oxide Fuel Cell Anode Reaction
S. Liu, S. Liu, L. C. Saha (INAMORI Frontier Research Center, Kyushu University), A. M. Iskandarov (Tokyo Institute of Technology, Japan), Z. Jiao (Institute of Industrial Science, The University of Tokyo), S. Hara (Faculty of Engineering, Chiba Institute of Technology), T. Ishimoto (Hiroshima University), T. Tada (Tokyo Institute of Technology), Y. Umeno, N. Shikazono (Institute of Industrial Science, The University of Tokyo), S. Matsumura (The Ultramicroscopy Research Center, Kyushu University), and M. Koyama (INAMORI Frontier Research Center, Kyushu University, GREEN, National Institute for Materials Science)
11:20
336
Numerical Analysis of Ammonia-Fueled Planar Solid Oxide Fuel Cells
M. Kishimoto, T. Kume, H. Iwai, and H. Yoshida (Kyoto University)
11:40
333
Modified Butler-Volmer Type Model Which Accounts for Triple and Double Phase Boundary Reaction Pathways
J. H. Mason (U.S. DOE, National Energy and Technology Laboratory, Oak Ridge Associated Universities), I. B. Celik (West Virginia University, U.S. DOE, National Energy Technology Laboratory), H. Abernathy (U.S. DOE National Energy Technology Laboratory, AECOM), and G. A. Hackett (U.S. DOE National Energy Technology Laboratory)
See more of: I01: Fifteenth International Symposium on Solid Oxide Fuel Cells
See more of: Fuel Cells, Electrolyzers, and Energy Conversion
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