First principles insights into the interaction mechanism of iron doped thermally activated kaolinite with Cd and Pb pollutants in organic solid waste incineration flue gas

[Display omitted] •The interaction mechanisms between Cd/Pb and kaolinite surfaces are explored.•The adsorption stability on the -H + Fe surface follows CdCl2 

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Bibliographic Details
Published in:Waste management (Elmsford) 2023-11, Vol.171, p.365-374
Main Authors: Wu, Yang-wen, Guo, Rong, Sun, Li-juan, Zhou, Xin-yue, Zhou, Jia-le, Zhao, Hai-yuan, Yu, Yi-fei, Hu, Zhuang, Hu, Bin, Liu, Ji, Zhang, Bing, Zhao, Li, Lu, Qiang
Format: Article
Language:English
Subjects:
Adsorption
Cadmium
Density functional theory
Kaolinite surface
Lead
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Summary:[Display omitted] •The interaction mechanisms between Cd/Pb and kaolinite surfaces are explored.•The adsorption stability on the -H + Fe surface follows CdCl2 
ISSN:0956-053X
1879-2456
DOI:10.1016/j.wasman.2023.09.025