陈先阳副教授

办公电话:021-54745383
电子邮件:xychen@sjtu.edu.cn
通讯地址:上海市东川路800号化学化工学院A楼319室

  • 教育背景

    1986-1990:四川大学化学化工学院,学士
    1994-1999:南京大学化学化工学院,博士
    2007-2008:美国威斯康星大学麦迪逊分校化学系,博士后

  • 工作经历

    1999-2001:上海交通大学化学化工学院学院,讲师
    2001-至今:上海交通大学化学化工学院,副教授

  • 研究方向

    1、理论研究过渡金属配合物结构与反应机理;
    2、手性分子分离机理的理论研究

  • 科研项目

    参加国家自然科学基金、教育部留学回国人员科研启动基金等多项课题研究。

  • 代表性论文专著

    论文
    [1] Qiang Li, XianYang Chen, YiXiang Qiu, ShuGuang Wang, Investigation of Spin-Flip Reactions of Zr + CH3CN by Relativistic Density Functional Theory, J. Phys. Chem. A, 2012, 116, 5059.
    [2] Qiang Li, YiXiang Qiu, XianYang Chen, W. H. E Schwarz, Shu-Guang Wang, Investigation of spin-flip reactions of Nb + CH3CN by relativistic density functional theory, Phys. Chem. Chem. Phys., 2012, 14, 6833.
    [3] Jia Li,XianYang Chen, YiXiang Qiu, ShuGuang Wang, Spin-Flip Reaction of Re + CH4-A Relativistic Density Functional Theory Investigation,J. Phys. Chem. A, 2009, 113, 8471.
    [4] Juan Long , YiXiang Qiu, Xianyang Chen, ShuGuang Wang,Stable geometric and electronic structures of gold-coated nanoparticles M@Au-12 (M= d transition metals, from Hf to Hg): I-h or O-h?,J. Phys. chem. C, 2008, 112, 12646
    [5] D. A Pantazis, XianYang Chen, C.R. Landis, F. Neese, All-electron scalar relativistic basis sets for third-row transition metal atoms, J. Chem. Theor. Comput., 2008, 4, 908.
    [6]Dan Xu, Xianyang Chen, ShuGuang Wang. Reaction mechanism of platinum dimer cation with ammonia based on the relativistic density functional study, Int. J. Quantum Chem. 2007, 107, 1985.
    [7] Xianyang Chen, Yixin Zhao and Shuguang Wang. Relativistic DFT Study on the Reaction Mechanism of Second-Row Transition Metal Ru with CO2, J. Phys. Chem. A, 2006, 110, 3552-3558.
    [8] ShuGuang Wang, XianYang Chen, W.H.E. Schwarz. A Simple Density Functional Fractional Occupation Number Procedure to Determine the Low Energy Transition Region of Spin-Flip Reactions”, J. Chem. Phys. 2007, 126, 124109-1-8.
    专著
    《实验化学下》,方能虎、陈先阳、孟庆华,科学出版社,2004

  • 教学工作

    本科生:《物理化学》、《结构化学》、《物理化学实验》、《实验化学三》、《综合实验》

地址:上海市东川路800号 200240
电话:021-54742893
E-mail:sjtuscce@sjtu.edu.cn

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