Efficient CO2 capture and in-situ electrocatalytic conversion on MgO surface by metal single-atom engineering: A comprehensive DFT study

Yang, Jing; Xiao, Yi; Gu, Guo-yu-lin; Liu, Jun; Wang, Tao; Qiao, Fen; Wang, Junfeng

doi:10.1016/j.seppur.2024.126489

Separation and Purification Technology

2024

DOI: 10.1016/j.seppur.2024.126489

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Efficient CO2 capture and in-situ electrocatalytic conversion on MgO surface by metal single-atom engineering: A comprehensive DFT study

Jing Yang,

Yi Xiao,

Guo-yu-lin Gu

et al.

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Efficient CO2 capture and in-situ electrocatalytic conversion on MgO surface by metal single-atom engineering: A comprehensive DFT study

Cited by 3 publications

References 70 publications

CO2 adsorption by Cr, Mn, Fe, Co, Ni doped MgO(1 0 0) surfaces: A first-principles study

CO2 adsorption by Cr, Mn, Fe, Co, Ni doped MgO(1 0 0) surfaces: A first-principles study

Preparation of molten salt promoted MgO for efficient CO2 capture by microwave method: Performance evaluation and mechanism exploration

CO2 adsorption on a K-promoted MgO surface: A DFT theoretical study

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