Materials Discovery

Monday, May 29, 2023
P - Computations for materials – discovery, design and the role of data P01 8:45 AM > 10:00 AM Materials Discovery Londres 2 (Ground floor) P - Computations for materials – discovery, design and the role of data

8:45 AM 2323 Employing Chemical Heuristics in Computational Materials Design of Functional Materials > D. David SCANLON (London) 9:15 AM 1233 Molecular Dynamics Simulations of the Structure and Dynamics at Catalyst-Ionomer Interfaces > B. Binny A. DAVIS (Juelich) 9:30 AM 708 Influence of Exchange-Correlation Functional on Descriptors for High-Entropy Protonic Ceramic Fuel Cells > B. Benjamin HECKSCHER SJØLIN (Kongens Lyngby)

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