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Publications

2025

45. Nan Jiang#; Yajie Meng#; Pu Xin; Changyi Zhu; Shuhan Tan; Yanhong Xu*; Youliang Zhu*; Jiawei Xu; Martin R. Bryce*, Nonconventional Full-Color Luminescent Polyurethanes: Luminescence Mechanism at the Molecular Orbital Level. ACS Materials Letters 2025, 7, 24-31.

44. Man Li; Qian Xie; Fangxi Xu; Yan Zhang; Zechao Zhuang; Jiawei Xu; Hai Xiang; Yongfu Li; Yanjiang Cai; Zuliang Chen*; Bing Yu*, Screening of Metal-Modified Biochars for Practical Phosphorus Recovery. Science of the Total Environment 2024, 956, 177342.

43. Yajie Meng; Xi Chen; Yingqi Li; Yunlong Shang; Yulin Guo; Yong Wu*; Haiyan Wei*; Jiawei Xu*, Marcus Inverted Region in Organic Long-Persistent Luminescence Host-Guest Systems Designed from Thermally Activated Delayed Fluorescence Molecule: A Mechanism Study. Journal of Materials Chemistry C 2024, Advance Article.

42. Xi Chen; Xueyuan Yan*; Zihan Liu; Tao Yuan; Caijie Bu; Yunlong Shang; Yong Wu; Haiyan Wei*; Jiawei Xu*, Electronic Structure Determines Geometry: Bond Length Alternating in Cyclo[2n]carbons. The Journal of Physical Chemistry A 2024, 128 (41), 8825-8832.

41. Xiaotian Zhang; Xi Chen; Zhoujie Zhang; Tao Yuan; Xueyuan Yan; Min Fang*; Yong Wu*; Jiawei Xu*, Why is Acyl Fluoride Favored in NHC/Photoredox Catalysis? Journal of Catalysis 2024, 439, 115776.

40. Nan Jiang; Yajie Meng; Changyi Zhu; Kexin Li; Xin Li; Yanhong Xu*; Jiawei Xu*; Martin R. Bryce*, Nonconjugated Polyurethane Derivatives with Aggregation-Induced Luminochromism for Multicolor and White Photoluminescent Films. ACS Macro Letters 2024, 13 (10), 1226-1232.

39. Junkai Xia#; Jiawei Xu#; Bing Yu*; Xiao Liang; Zhen Qiu; Hao Li; Huajun Feng; Yongfu Li; Yanjiang Cai; Haiyan Wei; Haitao Li; Hai Xiang; Zechao Zhuang*; Dingsheng Wang*, A Metal–Sulfur–Carbon Catalyst Mimicking the Two-Component Architecture of Nitrogenase. Angewandte Chemie International Edition 2024, 63 (45), e202412740.

38. Suwen Wang; Zechao Zhuang; Jiawei Xu; Cheng Fu; Zhen Qiu; Huajun Feng; Hai Xiang; Zuliang Chen; Hui Li; Lei Zhang; Yongfu Li; Yanjiang Cai; Tianyi Ma*; Bing Yu*, Non-Rigid Metal-Oxygen Bonding Empowered Nitrate Reduction on Ruthenium Catalysts. Nano Energy 2024, 130, 110088.

37. Kexin Li; Yajie Meng; Changyi Zhu; Nan Jiang*; Jiawei Xu*; Yanhong Xu*, Tunable Multicolor Fluorescence of Polyurethane Derivatives Induced by Molecular Weight. Polymer Chemistry 2024, 15 (22), 2235-2239.

36. Guangwei Li; Jiawei Xu; Yajie Meng; Jian Hao; Caijie Bu; Jing Wei*; Minyi Zhang*, Theoretical Insights into the Formation of Oxygen Activation Sites with the Affection of Protein Microenvironment in Flavin-Dependent Monooxygenases MsuD. Chemical Physics Letters 2024, 846, 141319.

35. Jiawei Xu; Jian Hao; Caijie Bu; Yajie Meng; Minyi Zhang*; Chunsen Li*, XMECP: Reaching State-of-the-Art MECP Optimization in Multi-Scale Complex Systems. Journal of Chemical Theory and Computation 2024, 20 (9), 3590-3600. (ACS Editors’ Choice)

34. Xingchao You; Jiawei Xu (co-first); Zechao Zhuang; Junkai Xia; Suwen Wang; Haiyan Wei; Yongfu Li; Yanjiang Cai; Hai Xiang; Bing Yu*, Ru-Ni alloy nanosheets as tandem catalysts for electrochemical reduction of nitrate to ammonia. Nano Research 2024, 17 (6), 4815-4824.

33. Kai Lu; Hui Qiu; Xi Chen; Taoyue Yuan; Fei Xue*; Mengtao Ma*, Synthesis of Asymmetrical β-Diketiminate Magnesium Methyl Complexes and their Catalytic Application in Cyanosilylation of Ketones. Journal of Molecular Structure, 2024, 1295, 136796.

32. Yu Xu; Xin Lin; Xianxin Chen; Xing Ke; Hao Wu; Yilei Fan; Jing Zhou*; Jiawei Xu*, Structural Confirmation of Position Isomers 2-MAPB and 5-MAPB: A Combined Mass Spectrometric and Computational Study. Rapid Communications in Mass Spectrometry, 2024, 38 (4), e9688.

31. Yunlong Shang; Zhoujie Zhang; Mengping Huang; Na Shu; Hanyu Luo; Qiyan Cao; Bingbing Fan; Yu Han; Min Fang*; Yong Wu*; Jiawei Xu*, Computational Study of the Photophysical Properties and Electronic Structure of Iridium(III) Photosensitizers Complexes with Electron-Withdrawing Groups. Physical Chemistry Chemical Physics, 2023, 25 (47), 32666-32674.

30. Ke Zhang; Xi Chen (co-first); Zhoujie Zhang; Caijie Bu; Yong Wu*; Jiawei Xu*, Exploring α Electron-Deficiency Induced [1,2]-Fluorine Migration. Organic & Biomolecular Chemistry, 2023, 21 (43), 8675-8689.

29. Tao Dong; Yihan Tang; Gavin Chit Tsui*, Thermal N-O bond heterolysis of TEMPO-CF2CF3 towards trifluoroacetylation of alcohols and amines. Organic Chemistry Frontiers, 2023, 10 (20), 5092-5098.

28. Yilei Fan; Xin Lin; Xianxin Chen; Hao Wu; Jiawei Xu*; Yu Xu*, Application of Mass Spectrometry Fragmentation Patterns for Rapid Screening and Structure Identification of Fentanyl Analogues in Suspicious Powder. Forensic Chemistry, 2023, 33 (5), 100485.

27. Jinlian Wang; Ziwei Luo; Yili Wu; Yihan Tang; Xinkan Yang*; Gavin Chit Tsui*, Copper-Catalyzed Visible-Light-Induced Allylic Difluoromethylation of Unactivated Alkenes Using Difluoroacetic Acid. Organic Letters, 2023, 25 (6), 1045-1049.

26. Yu Xu; Jiawei Xu; Xianxin Chen; Yilei Fan*; Hao Wu*, Structural Confirmation of Synthetic Cannabinoids in Seized Electronic Cigarette Oil: A Combined Mass Spectrometric and Computational Study. Rapid Communications in Mass Spectrometry, 2023, 37 (8), e9485.

25. Xingxuan Xia; Xi Chen; Binlin Zhao; Yu Yuan*, Iron-catalyzed intermolecular C–C bond vinylation of cycloketoximes promoted by diboron. Tetrahedron, 2023, 130 (9), 133179.

24. Kang Lv, Zixi Xie, Xi Chen, Weiwei Yao, and Mengtao Ma*, Catalyst-Free Green Synthesis of Phthalazinones at Room Temperature. Heterocycles, 2023, 106 (1), 135-149.

23. Tan Hao; Yuwei Zong; Yihan Tang; Gavin Chit Tsui*, Stereoselective Rhodium(I)-Catalyzed C–F Bond Arylation of Tri- and Tetrasubstituted gem-Difluoroalkenes with Boronic Acids. Organic Letters, 2023, 25 (5), 877-882.

22. Kai Lu; Haoqi Qu; Xi Chen; Hui Qiu; Jing Zheng*; Mengtao Ma*, Catalyst-free and Solvent-free Hydroboration of Alkynes and Alkenes with Catecholborane. Chinese Journal of Organic Chemistry, 2023, 43(6): 2197-2205.

21. Yuwei Zong; Yihan Tang; Gavin Chit Tsui*, Rhodium(I)-Catalyzed Defluorinative Coupling of Boronic Acids with Monofluoroalkenes. Organic Letters, 2022, 24 (35), 6380-6385.

20.刘偌曦; 王乐遥; 刘苏能; 曾贝衍; 毕瑞敏; 张致慧*, 一道无机化学习题的量子化学研究——P42-团簇的结构搜索与性质. 大学化学, 2022, 37 (11), 2112011.

19. Yihan TangPu Yang; Mengyuan Chen; Yuru Wang; Jiaxin Wang; Jiawei Xu*Seeing Delocalized π36 Bond in OX2 (X=Halogen) Molecules. Chinese Journal of Chemical Physics, 202235 (3), 542-550.

18. Yunlong ShangNa ShuZhoujie ZhangPu YangJiawei Xu*Comment on “Realization of the Zn3+ oxidation state” by H. Fang, H. Banjade, Deepika and P. Jena, Nanoscale, 2021, 13, 14041-14048. Nanoscale202214 (24), 8875-8880.

17.Jialiang Chen; Chichao Li; Xi Chen; Xuming Zhang; Hongbing Jia; Zhenyang Luo; Yanlong Luo*, Insights into the Preparation and Performance of SiO2@graphene Oxide/epoxidized Solution-polymerized Styrene Butadiene Rubber Composites through Experiments and Molecular Simulations. Journal of Applied Polymer Science, 2022, 139 (26), e52432.

16.Man Luo; Jinyi Shi; Xi Chen; Zhenghan Guo; Haoqi Qu; Weiwei Yao*; Junling Song*; Mengtao Ma*, Calcium-Catalyzed Hydroboration of Alkenes. ACS Sustainable Chemistry & Engineering, 2022, 10 (15), 5015–5023

15.Yanhui Wang; Yihan Tang (co-first); Yuwei Zong; Gavin Chit Tsui*, Highly Selective C–F Bond Functionalization of Tetrasubstituted gem-Difluoroalkenes and Trisubstituted Monofluoroalkenes Using Grignard Reagents. Organic Letters, 2022, 24 (22), 4087–4092.

14.Chunbao Miao*; Hongrong Guan; Yihan Tang; Kun Wang; Wenlong Ren; Xinyu Lyu; Changsheng Yao; Haitao Yang*, Copper-Catalyzed Bisannulations of Malonate-Tethered O-Acyl Oximes with Pyridine, Pyrazine, Pyridazine, and Quinoline Derivatives for the Construction of Dihydroindolizine-Fused Pyrrolidinones and Analogues. Organic Letters, 2021, 23 (22), 8699-8704.

13. Man Luo; Yi Qin; Xi Chen; Qian Xiao; Binlin Zhao; Weiwei Yao*; Mengtao Ma*, ZnBr2-Catalyzed Dehydrogenative Borylation of Terminal Alkynes. The Journal of Organic Chemistry, 2021, 86 (23), 16666–16674.

12. 杨普; 徐嘉伟*学科融合背景下生物学与化学跨学科教学的问题与建议. 生物学教学202247 (2), 79-80.

11. Rongji ZhuXi Chen (co-first); Na ShuYunlong ShangYichen Wang; Pu Yang; Yihan Tang; Fei Wang*; Jiawei Xu*Computational Study of Photochemical Relaxation Pathways of Platinum(II) Complexes. The Journal of Physical Chemistry A2021125 (47), 10144-10154.

10. 杨松; 汤义涵; 徐嘉伟; 刘偌曦; 薛冰; 张致慧*, 绝对硬度的量化探究——介绍一个计算化学实验. 大学化学, 202136 (08), 2010036.

9.Yihan Tang; Wang Chen; Ruoxi Liu; Leyao Wang; Yating Pan; Ruimin Bi; Xuejun Feng; Mingyang He; Qun Chen; Zhihui Zhang*, Solvent‐Free CO2 Fixation Reaction Catalyzed by MOFs Composites Containing Polycarboxylic Acid Ligands. ChemistrySelect20216, 5350.

8. Jiawei XuPu Yang; Like Deng; Na ShuYunlong Shang; Wanjie Zhou; Jianchun Bao; Min Fang*; Yong Wu*, Theoretical Investigation into Thermodynamics and Electronic Structure of an Ammonia-productive Molybdenum-centered Catalyst. Inorganic Chemistry202160 (16), 11878-11882.

7. 汤义涵徐嘉伟; 王佳鑫; 王钰如; 薛冰; 张致慧*, 第33届江苏省化学竞赛选拔赛有机试题解析. 大学化学, 202136 (04), 301-308.

6. 徐嘉伟; 邓力克; 陈晓峰; 包建春; 方敏; 吴勇*, 化学平衡解题通用方法探讨. 化学教育(中英文), 202041 (23), 100-103.

5. Jiawei Xu; Like Deng; Haozhe Zhang; Huanyu Zhang; Yucheng Luo; Xinya Yan; Jianchun Bao; Yong Wu*; Min Fang*, Verifying Principle of Electroneutrality by NBO Charge Calculations. Chinese Journal of Inorganic Chemistry, 202036 (11), 2157-2168.

4. Yihan TangJiawei Xu; Fei Wang; Yifan Zheng; Zhihui Zhang*, Mechanism study on the oxidation of ethylbenzene: A theoretical and computational approach. Computational and Theoretical Chemistry, 20201188, 112974.

3. 杨普徐嘉伟*生物学联赛试题背景探讨——以2019年第14题为例. 生物学教学, 2020, 45 (9), 62-64.

2. 汤义涵; 邵莺*, 第32届江苏省化学竞赛选拔赛有机化学试题解析. 化学教育(中英文), 2020, 41 (15), 99-103

1. 徐嘉伟; 陈晓峰; 包建春; 方敏; 吴勇*, 一道可燃冰晶体结构化竞试题的分析. 中学生数理化, 201939 (05), 84-85+97.