A comprehensive exploration about the effects of O2, SO2 and NO on As2O3 adsorption over Cu/γ-Al2O3 SCR catalyst: A DFT study

Xing, Jiaying; Wang, Chunbo; Huang, Yangen; Li, Shun; Zhang, Yue

doi:10.1016/j.ces.2021.117260

Chemical Engineering Science

2022

DOI: 10.1016/j.ces.2021.117260

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A comprehensive exploration about the effects of O2, SO2 and NO on As2O3 adsorption over Cu/γ-Al2O3 SCR catalyst: A DFT study

Jiaying Xing

Chunbo Wang

Yangen Huang

et al.

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Cited by 9 publications

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Theoretical studies of metal-organic frameworks: Calculation methods and applications in catalysis, gas separation, and energy storage

Hai

Wang²

2022

Coordination Chemistry Reviews

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A comprehensive exploration about the effects of O2, SO2 and NO on As2O3 adsorption over Cu/γ-Al2O3 SCR catalyst: A DFT study

Cited by 9 publications

References 38 publications

Theoretical studies of metal-organic frameworks: Calculation methods and applications in catalysis, gas separation, and energy storage

Theoretical studies of metal-organic frameworks: Calculation methods and applications in catalysis, gas separation, and energy storage

The effect of W and Mo modification on arsenic adsorption over Cu/γ-Al2O3 catalyst: Experimental and theoretical analysis

Mechanistic assessment of arsenic capture by aluminum-promoted calcium oxide and its consequences for As2O3 oxidation

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