Miao, B. Wu, Z. Xu, H. Zhang, M. Chen, Y. Wang, L. text xx 9999 monographic und

electronic

Current catalysts used for ethanol oxidation reaction (EOR)cannot effectively prevent CH3COOH formation, and thus become a major hindrance for direct ethanol fuel cell applications. We report an Ir catalyst that shows great promise for a complete EOR based on density functional theory calculations using PBE functional. The reaction barrier on Ir(1 0 0)was found to be 2.10 eV for CH3COOH formation, which is much higher than currently used Pd and Pt, and 0.57 eV for C C bond cleavage in CHCO species, which are comparable to Pd and Pt. The result suggests future directions for studying optimal complete EOR catalysts. https://drive.google.com/file/d/1hG8mmz6UkBBIRNDtXnzGmWaUwwJ252t_/view?usp=drivesdk https://drive.google.com/file/d/1hG8mmz6UkBBIRNDtXnzGmWaUwwJ252t_/view?usp=drivesdk 250602 20260521091711.0