段阿冰,博士,湖南大學環境科學與工程學院助理教授、碩士生導師。
基本介紹
- 中文名:段阿冰
- 畢業院校:美國加州大學洛杉磯分校
- 學位/學歷:博士
- 專業方向:計算有機化學
- 任職院校:湖南大學
人物經歷,研究領域,科研成果,學術成果,學術論文,國際會議,
人物經歷
2017.9~至今 湖南大學環境科學與工程學院 助理教授
2015.9~2017.3 美國加州大學洛杉磯分校 聯合培養博士
專業:計算有機化學 導師:K. N. Houk教授(美國科學院院士)
專業:計算與量子化學 導師:顧鳳龍教授
研究領域
主要從事小分子反應機理的理論計算,如不對稱催化反應、過渡金屬催化、周環反應、取代反應、自由基反應等等,以及酶催化、光催化等反應的機理研究,選擇性,催化劑設計。
科研成果
參與主要研究項目(國家自然科學基金)
[1] 國家自然科學基金面上項目(21673085)基於非正交定域分子軌道計算非線性光學性質的程式開發和套用 (2017-2020)
[2] 國家自然科學基金面上項目(21571068)球形結構化半導體-石墨烯類複合材料的光化學構築與光催化性能研究(2016-2019)
[3] 國家自然科學基金青年基金(21403074)QM/MM 方法研究溶劑效應對立體選擇性反應的影響(2015-2017)
[4] 國家自然科學基金青年基金(21303059)快速相對論量子化學方法研究與程式實現(2014-2016)
[5] 中央高校基本科研業務費項目,2017-2020,在研,主持;
[6] 湖南省自然科學基金青年基金項目,新型N-雜環卡賓催化交叉安息香縮合反應機理和非對映選擇性研究,2019-2021,在研,主持;
[7] 華南師範大學環境理論化學教育部重點實驗室開放研究基金,新型鎳催化非活化烷基鹵代物與CO2的還原羧化反應的理論研究,2019-2021,在研,主持。
學術成果
學術論文
[1] Abing Duan, Peiyuan Yu, Fang Liu, Huang Qiu, Feng Long Gu, Michael P. Doyle* and K. N. Houk*; Diazo Esters as Dienophiles in Intramolecular (4+2) Cycloadditions: Computational Explorations of Mechanism. J. Am. Chem. Soc., 2017, 139(7), 2766?2770.(SCI IF:14.357)
[2] Qiao Zhang?,Tao Li?, Abing Duan?, Shengyi Dong*, Wanxiang Zhao*,and Peter J.stang*;Formation of a Supramolecular Polymeric Adhesive via Water? Participant Hydrogen Bond Formation. J. Am. Chem. Soc., DOI: 10.1021/jacs.9b02677.(共同一作,SCI IF:14.357)
[3] Abing Duan, Liang Peng, Daoling Peng, and Feng Long Gu*; Theoretical Study on the Mechanism of Stereoselective Synthesis of Oxazolidinones. J. Org. Chem., 2013,78(24), 12585-12592.(SCI IF:4.805)
[4] Shu-Shan Gao, Abing Duan, Wei Xu, Peiyuan Yu, Leibniz Hang, K. N. Houk* and Yi Tang*; Phenalenone Polyketide Cyclization Catalyzed by Fungal Polyketide Synthase and Flavin-Dependent Monooxygenase. J. Am. Chem. Soc., 2016, 138 (12), 4249–4259.(SCI IF:14.357)
[5] Xueqiang Wang,* Chenchen Li, Xia Wang, Qingli Wang, Xiu-Qin Dong, Abing Duan,* and Wanxiang Zhao*; Metal-Free Etherification of Aryl Methyl Ether Derivatives by C?OMe Bond Cleavage. Org. Lett., 2018, 20(14), 4267–4272.(SCI IF:6.492)
[6] Chao Chen, Yu Hao, Ting-Yu Zhang, Jin-Long Pan, Jun Ding, Heng-Ye Xiang, Man Wang, Tong-Mei Ding, Abing Duan,* and Shu-Yu Zhang*; Experimental and Computational Studies on Copper-Catalyzed Selective Cascade C-H/N-H Annulation of Electron-Deficient Acrylamide with Arynes. Chem. Commun., 2019, 55, 755-758.(封面論文)(SCI IF:6.29)
[7] Chen Zhang*, Wenjun Wang, Abing Duan*, Guangming Zeng, Danlian Huang, Cui Lai, Xiaofei Tan, Min Cheng, Rongzhong Wang, Chengyun Zhou, Weiping Xiong, Yang Yang; Adsorption behavior of engineered carbons and carbon nanomaterials for metal endocrine disruptors: Experiments and theoretical calculation. Chemosphere, 2019, 222:184-194.(SCI IF: 4.427)
[8] Shu-Shan Gao, Marc Garcia Borràs, Joyann Barber, Yang Hai, Abing Duan, K. N. Houk* and Yi Tang*; Enzyme-Catalyzed Intramolecular Enantioselective Hydroalkoxylation. J. Am. Chem. Soc., 2017, 139(10), 3639?3642.(SCI IF:14.357)
[9] Piao Xu, Cui Lai, Guangming Zeng*, Danlian Huang, Ming Chen, Biao Song, Xin Peng, Jia Wan, Liang Hu, Abing Duan, Wangwang Tang; Enhanced bioremediation of 4-nonylphenol and cadmium co-contaminated sediment by composting with Phanerochaete chrysosporium inocula. Bioresource Technology, 2017, 250 (2018) 625–634. (SCI IF: 5.807)
[10] Chengyun Zhou#,Danlian Huang#,Piao Xu#,Guangming Zeng*,Jinhui Huang*,Tianzhe Shi,Cui Lai,Chen Zhang,Min Cheng,Yue Lu,Abing Duan,Weiping Xiong,Man Zhou;Efficient visible light driven degradation of sulfamethazine and tetracycline by salicylic acid modified polymeric carbon nitride via charge transfer.Chem. Eng. J.2019, https://doi.org/10.1016/j.cej.2019.03.279 (SCI IF 6.735)
[11] Chengyun Zhou#,Danlian Huang#,Piao Xu#,Guangming Zeng?,Jinhui Huang?,Tianzhe Shi,Cui Lai,Chen Zhang,Min Cheng,Yue Lu,Abing Duan,Weiping Xiong,Man Zhou;Efficient visible light driven degradation of sulfamethazine and tetracycline by salicylic acid modified polymeric carbon nitride via charge transfer. Chemical Engineering Journal,370(2019):1077-1086.(SCI IF 6.735)
[12] Piao Xu,Ming Chen,Guangming Zeng?,Danlian Huang?,Cui Lai,Ziwei Wang,Ming Yan, Zhenzhen Huang,Xiaomin Gong,Biao Song, Tao Li,Abing Duan;Effects of multi-walled carbon nanotubes on metal transformation and natural organic matters in riverine sediment. Journal of Hazardous Materials. 374(2019):459-468.(SCI IF 6.434)
[13] Rong-Zhong Wang, Dan-Lian Huang?, Yun-Guo Liu?, Chen Zhang, Cui Lai,Xin Wang, Guang-Ming Zeng, Xiao-Min Gong, Abing Duan, Qing Zhang, Piao Xu;Recent advances in biochar-based catalysts: Properties, applications and mechanisms for pollution remediation. Chemical Engineering Journal,371(2019):380-403.(SCI IF 6.735)
[14] Qingyun He,Piao Xu,Chen Zhang,Guangming Zeng*,Zhifeng Liu*,Dongbo Wang,Wangwang Tang,Haoran Dong,Xiaofei Tan, Abing Duan; Influence of surfactants on anaerobic digestion of waste activated sludge: acid and methane production and pollution removal, Critical Reviews in Biotechnology, DOI: 10.1080/07388551.2018.1530635.(SCI IF 5.239)
國際會議
[1] Theoretical Study of Diastereoselective N-Heterocyclic Carbene Catalyzed Cross-Benzoin Reactions(Poster). 251st American Chemical Society National Meeting & Exposition, San Diego, CA, USA, Marth 13th-17th, 2016.
[2] Diazo Esters as Dienophiles in Intramolecular (4+2) Cycloadditions: Computational Explorations of Mechanism (Poster). 2016 Seaborg Symposium and Medal Award, Department of Chemistry & Biochemistry, University of Carlifornia, Los Angeles, CA, USA, Saturday, November 12, 2016.
[3] Two-component Relativistic Calculations of Nuclear Magnetic Resonance Spectroscope Constants(Poster). THE 15th International Congress of Quantum Chemistry, New Tsinghua Amphitheatre, Beijing, China. June 8-13, 2015.