[P] P269~P297

[P293] Design High-Performance High-Entropy Alloy Electrocatalyst for Methanol Fuel Cells via DFT Calculations, Machine Learning, and Experimental Validation

*Ho　Ngoc Nam¹, Ravi Nandan², Quan　Manh Phung¹, Yusuke Yamauchi¹ (1. Nagoya University, 2. NIMS)

Keywords:

High-entropy alloys,Electrocatalyst,Fuel Cells,Computational Materials Design,Metallic alloys

Here, a bottom-up research strategy using quantum simulations, machine learning, and experimental validation to design quinary high-entropy alloys for methanol conversion application in fuel cells.