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Changli Shen, Dr. Huiying Li, Jun Yu, Prof. Guisheng Wu, Prof. Dongsen Mao and Prof. Guanzhong Lu A First-Principles DFT Study on the Active Sites of Pd-Cu-Clx/Al2O3 Catalyst for Low-Temperature CO Oxidation ChemCatChem 5

Article first published online: 24 JUL 2013 | DOI: 10.1002/cctc.201300356

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A tandem cycle ride: The catalytic reaction mechanism of CO oxidation over Pd-Cu-Clx/γ-Al2O3 is proposed based on DFT studies. There are two catalytic cycles in the CO oxidation process, the palladium cycle ( (green)) and the copper cycle ( (red)).

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