Density Functional Theory Calculations for Insight into the Heterocatalyst Reactivity and Mechanism in Persulfate-Based Advanced Oxidation Reactions

Panpan Zhang; Yangyang Yang; Xiaoguang Duan; Yunjian Liu; Shaobin Wang

doi:10.1021/acscatal.1c03099

journal article Aug 23, 2021

Density Functional Theory Calculations for Insight into the Heterocatalyst Reactivity and Mechanism in Persulfate-Based Advanced Oxidation Reactions

Panpan Zhang

Yangyang Yang Xiaoguang Duan

Yunjian Liu

Shaobin Wang

ACS Catalysis Vol. 11 No. 17 pp. 11129-11159 · American Chemical Society (ACS)

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References

Details

Published: Aug 23, 2021
Vol/Issue: 11(17)
Pages: 11129-11159
License: View

Authors

P

Panpan Zhang

School of Material Science and Engineering, Jiangsu University, Zhenjiang 212013, China; School of Chemical Engineering and Advanced Materials, The University of Adelaide, Adelaide, South Australia 5005, Australia

Y

Yangyang Yang

School of Chemical Engineering and Advanced Materials, The University of Adelaide, Adelaide, South Australia 5005, Australia

X

Xiaoguang Duan

School of Chemical Engineering and Advanced Materials, The University of Adelaide, Adelaide, South Australia 5005, Australia

Y

Yunjian Liu

School of Material Science and Engineering, Jiangsu University, Zhenjiang 212013, China

S

Shaobin Wang

School of Chemical Engineering and Advanced Materials, The University of Adelaide, Adelaide, South Australia 5005, Australia

Funding

Australian Research Council Award: DP190103548

Cite This Article

Panpan Zhang, Yangyang Yang, Xiaoguang Duan, et al. (2021). Density Functional Theory Calculations for Insight into the Heterocatalyst Reactivity and Mechanism in Persulfate-Based Advanced Oxidation Reactions. ACS Catalysis, 11(17), 11129-11159. https://doi.org/10.1021/acscatal.1c03099

Density Functional Theory Calculations for Insight into the Heterocatalyst Reactivity and Mechanism in Persulfate-Based Advanced Oxidation Reactions

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