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- W2980963837 endingPage "333" @default.
- W2980963837 startingPage "287" @default.
- W2980963837 abstract "Computational simulation has become an important ingredient of the modern catalysis research, which aims at the elucidation of the structure-performance relationship for the rational design of catalysts. Here, we provide an in-depth analysis of the catalytic mechanisms of the oxidative coupling of methane (OCM) and the selective oxidation of methanol (SOM) reactions over metal oxide catalysts based on computational studies, together with available experimental evidence. These two reactions are of significant importance for the valorization of natural gas and methanol to produce advanced chemicals and fuels. Major challenges and future perspectives in mechanistic studies of oxide-catalyzed reactions are highlighted." @default.
- W2980963837 created "2019-10-25" @default.
- W2980963837 creator A5041685367 @default.
- W2980963837 creator A5089126712 @default.
- W2980963837 date "2019-01-01" @default.
- W2980963837 modified "2023-10-07" @default.
- W2980963837 title "Mechanism of oxide-catalyzed selective oxidation: A computational perspective" @default.
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