Origin of Water-Induced Deactivation of MnO2-Based Catalyst for Room-Temperature NO Oxidation: A First-Principles Microkinetic Study

Yuan, HY; Yang, HG; Hu, P; Wang, HF

Wang, HF (corresponding author), East China Univ Sci & Technol, Key Lab Adv Mat, Res Inst Ind Catalysis, Shanghai 200237, Peoples R China.; Wang, HF (corresponding author), East China Univ Sci & Technol, Ctr Computat Chem, Shanghai 200237, Peoples R China.

ACS CATALYSIS, 2021; 11 (12): 6835

Abstract

MnO2-based catalysts exhibit remarkable activities in a room-temperature NO oxidation reaction (RT-NOR) but are challenged by water-induced deactivati......

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