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Mao, Xin, Bai, Xiaowan, Wu, Guanzheng, Qin, Qing, O’Mullane, Anthony P., Jiao, Yan, Du, Aijun (2024) Electrochemical Reduction of N2 to Ammonia Promoted by Hydrated Cation Ions: Mechanistic Insights from a Combined Computational and Experimental Study. Journal of the American Chemical Society, 146 (27) 18743-18752 doi:10.1021/jacs.4c06629

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Reference TypeJournal (article/letter/editorial)
TitleElectrochemical Reduction of N2 to Ammonia Promoted by Hydrated Cation Ions: Mechanistic Insights from a Combined Computational and Experimental Study
JournalJournal of the American Chemical Society
AuthorsMao, XinAuthor
Bai, XiaowanAuthor
Wu, GuanzhengAuthor
Qin, QingAuthor
O’Mullane, Anthony P.Author
Jiao, YanAuthor
Du, AijunAuthor
Year2024 (July 10)Volume146
Page(s)18743-18752Issue27
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jacs.4c06629Search in ResearchGate
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Mindat Ref. ID17504004Long-form Identifiermindat:1:5:17504004:1
GUID0
Full ReferenceMao, Xin, Bai, Xiaowan, Wu, Guanzheng, Qin, Qing, O’Mullane, Anthony P., Jiao, Yan, Du, Aijun (2024) Electrochemical Reduction of N2 to Ammonia Promoted by Hydrated Cation Ions: Mechanistic Insights from a Combined Computational and Experimental Study. Journal of the American Chemical Society, 146 (27) 18743-18752 doi:10.1021/jacs.4c06629
Plain TextMao, Xin, Bai, Xiaowan, Wu, Guanzheng, Qin, Qing, O’Mullane, Anthony P., Jiao, Yan, Du, Aijun (2024) Electrochemical Reduction of N2 to Ammonia Promoted by Hydrated Cation Ions: Mechanistic Insights from a Combined Computational and Experimental Study. Journal of the American Chemical Society, 146 (27) 18743-18752 doi:10.1021/jacs.4c06629
In(2024, July) Journal Of The American Chemical Society Vol. 146 (27) American Chemical Society (ACS)

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Mao, Xin; Bai, Xiaowan; Wu, Guanzheng; Qin, Qing; O’Mullane, Anthony P.; Jiao, Yan; Du, Aijun (2025) Correction to “Electrochemical Reduction of N2 to Ammonia Promoted by Hydrated Cation Ions: Mechanistic Insights from a Combined Computational and Experimental Study”. Journal of the American Chemical Society, 147 (26). doi:10.1021/jacs.5c08467
Jiang, Lin; Zhi, Xing; Bai, Xiaowan; Jiao, Yan (2025) Atomic-Level Insights into Cation-Mediated Mechanism in Electrochemical Nitrogen Reduction. Journal of the American Chemical Society, 147 (20). doi:10.1021/jacs.4c18622
Mao, Xin, Gong, Wanbing, Fu, Yang, Li, Jiayi, Wang, Xinyu, O’Mullane, Anthony P., Xiong, Yujie, Du, Aijun (2023) Computational Design and Experimental Validation of Enzyme Mimicking Cu-Based Metal–Organic Frameworks for the Reduction of CO2 into C2 Products: C–C Coupling Promoted by Ligand Modulation and the Optimal Cu–Cu Distance. Journal of the American Chemical Society, 145 (39) 21442-21453 doi:10.1021/jacs.3c07108
Fang, Qingchao, Yin, Hanqing, Mao, Xin, Han, Yun, Yan, Cheng, O’Mullane, Anthony P., Du, Aijun (2023) Theoretical Evaluation of Highly Efficient Nitrate Reduction to Ammonia on InBi. The Journal of Physical Chemistry Letters, 14 (9) 2410-2415 doi:10.1021/acs.jpclett.2c03900
Zhang, Jingyang, Kong, Wang-Yeuk, Guo, Wentao, Tantillo, Dean J., Tang, Yefeng (2024) Combined Computational and Experimental Study Reveals Complex Mechanistic Landscape of Brønsted Acid-Catalyzed Silane-Dependent P═O Reduction. Journal of the American Chemical Society, 146 (20) 13983-13999 doi:10.1021/jacs.4c02042
Sun, Mengmiao, Wu, Guanzheng, Jiang, Jiadi, Yang, Yidong, Du, Aijun, Dai, Lei, Mao, Xin, Qin, Qing (2023) Carbon‐Anchored Molybdenum Oxide Nanoclusters as Efficient Catalysts for the Electrosynthesis of Ammonia and Urea. Angewandte Chemie, 135 (19) doi:10.1002/ange.202301957
Liu, Sijia; Wu, Guanzheng; Jiang, Jiadi; Yang, Yidong; Du, Aijun; Zhang, Wuyong; Mao, Xin; Dai, Lei; Qin, Qing (2025) Electrochemical Lattice Engineering of Bismuthene for Selective Glycine Synthesis. Advanced Materials, 37 (21). doi:10.1002/adma.202500843
Sun, Mengmiao, Wu, Guanzheng, Jiang, Jiadi, Yang, Yidong, Du, Aijun, Dai, Lei, Mao, Xin, Qin, Qing (2023) Carbon‐Anchored Molybdenum Oxide Nanoclusters as Efficient Catalysts for the Electrosynthesis of Ammonia and Urea. Angewandte Chemie International Edition, 62 (19) doi:10.1002/anie.202301957
Mao, Xin, Li, Zhiheng, Li, Mengran, Xu, Xiaoyong, Yan, Cheng, Zhu, Zhonghua, Du, Aijun (2021) Computational Design and Experimental Validation of the Optimal Bimetal-Doped SrCoO3−δ Perovskite as Solid Oxide Fuel Cell Cathode. Journal of the American Chemical Society, 143 (25) 9507-9514 doi:10.1021/jacs.1c03441
Yuan, Jiangfeng, Yin, Hanqing, Jin, Xiaoxin, Zhao, Dan, Liu, Yuan, Du, Aijun, Liu, Xiaoqiang, O’Mullane, Anthony P. (2023) A practical FeP nanoarrays electrocatalyst for efficient catalytic reduction of nitrite ions in wastewater to ammonia. Applied Catalysis B: Environmental, 325. 122353 doi:10.1016/j.apcatb.2022.122353
Wu, Guanzheng, Zhang, Wuyong, Yu, Rui, Yang, Yidong, Jiang, Jiadi, Sun, Mengmiao, Du, Aijun, He, Wenhui, Dai, Lei, Mao, Xin, et al. (2024) p–d Orbital Hybridization in Ag‐based Electrocatalysts for Enhanced Nitrate‐to‐Ammonia Conversion. Angewandte Chemie, 136 (40). doi:10.1002/ange.202410251
 
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