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个人信息Personal Information
教授
性别：男
在职信息：不在职
所在单位：化学与化工学院
入职时间：1968-07-01
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- [101] 刘永军 , 刘成卜 and 高军. Molecular dynamics simulation of the interaction between protein tyrosine phosphatase 1B and aryl diketoacid derivatives. Journal of Molecular Graphics and Modelling, 38, 186, 2012.
- [102] 高军 , 刘成卜 and 张冬菊. Hydrogen bond network of 1-alkyl-3-methylimidazolium ionic liquids: a network theory analysis. Journal of Theoretical and Computational Chemistry, 11, 587, 2012.
- [103] 朱荣秀 and 刘成卜. A DFT study on the mechanism and regio selectivity of the tandem O-nitroso aldol/Michael reaction of nitrosobenzene and cyclohexenone. JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 815, 105, 2007.
- [104] 马玉臣 , 刘成卜 and 陈廷威. Origin of the deep band-gap state in TiO2: dd sigma bonds between Ti-Ti pairs. Physical review B, 98, 2018.
- [105] 刘成卜 , 张冬菊 and 朱有涛. Cleavage of the -O-4 bond in a lignin model compound using the acidic ionic liquid 1-H-3-methylimidazolium chloride as catalyst: a DFT mechanistic study. Journal of Molecular Modeling, 24, 2018.
- [106] 朱荣秀 , 刘成卜 , 张冬菊 and 靖亚茹. Theoretical Elucidation of the Mechanism and Kinetic Experimental Phenomena on the Esterification of α-Tocopherol with Succinic Anhydride: Catalys. J. Org. Chem., 82, 12267, 2017.
- [107] 朱荣秀 , 刘成卜 , 张冬菊 and 刘艳红. The Dual Role of Gold(I) Complexes in Photosensitizer-Free Visible-Light-Mediated Gold-Catalyzed 1,2-Difunctionalization of Alkynes: A DFT Study. Chemistry-A European Journal, 24, 14119, 2018.
- [108] 刘成卜 , 张冬菊 and 靖亚茹. Theoretical investigation on the mechanism of glucose-to-fructose isomerization synergistically catalyzed by MnCl2 and [C4SO3HMIM][CH3SO3] in [BMIM]Cl. New Journal of Chemistry , 43, 4022, 2019.
- [109] 朱荣秀 , 刘成卜 , 张冬菊 and 杨一莹. Theoretical Insight into the Au(I)-Catalyzed Intermolecular Condensation of Homopropargyl Alcohols with Terminal Alkynes: Reactant Stoichiometric Ratio-Controlled Chemodivergence. The Journal of Organic Chemistry, 84, 579, 2019.
- [110] 刘成卜 , 张冬菊 and 靖亚茹. Mechanistic insight into beta-O-4 linkage cleavage of lignin model compound catalyzed by a SO3 H-functionalized imidazolium ionic liquid: An unconventional E1 elimination. MOLECULAR CATALYSIS, 463, 140, 2019.
- [111] 刘成卜 , 张冬菊 and 穆雪丽. Mechanistic Insights into Formaldehyde-Blocked Lignin Condensation: A DFT Study. The Journal of Physical Chemestry C, 123, 8640, 2019.
- [112] 刘成卜 and 朱荣秀. Theoretical study on the origin of enantioselectivity in the primary amine–Br？nsted acid catalyzed epoxidation of cyclic enones. Tetrahedron: Asymmetry, 2013.
- [113] 刘成卜 and 苑世领. Mesoscopic. simulation on the interaction between polymer PVP and surfactant AOT. CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHIN, 24, 1048, 2003.
- [114] 刘成卜 and 朱荣秀. Theoretical study on the enantioselective alpha-amination reaction of 1,3-dicarbonyl compounds catalyzed by a bifunctional-urea. TETRAHEDRON-ASYMMETRY, 18, 1655, 2007.
- [115] 刘永军 , 张冬菊 , 刘成卜 and 高军. The reaction mechanism of hydroxyethylphosphonate dioxygenase: a QM/MM study. Organic & Biomolecular Chemistry, 10, 1014, 2012.
- [116] 刘成卜 and 朱荣秀. Theoretical study on the ring-opening polymerization of D-lactide catalyzed by bifunctional thiourea catalyst. Acta Chimica Sinica, 66, 885, 2008.
- [117] 刘建强 , 刘成卜 and 张冬菊. A New Family of Heterofullerenes: Stoichiometric TiO2 Nanoclusters. JOURNAL OF PHYSICAL CHEMISTRY C, 113, 21, 2009.
- [118] 张恒 , 刘成卜 , 苑世领 and 刘刚. Monte Carlo模拟研究有机分子的模板诱导定位沉积. 中国科学：化学, 45, 1271, 2015.
- [119] 刘成卜 and 朱荣秀. Theoretical study on the mechanism of selective fluorination of aromatic compounds with Selectfluor. RSC advances, 2015.
- [120] 高军 , 刘成卜 and 张冬菊. Mechanistic insight into the hydrodesulfurization of thiophene by a molecular tungsten complex W(PMe3)4(η2-CH2PMe2)H . Appl. Catal. A-Gen, 2014.