仇毅翔
办公电话：021-54745383
电子邮件：yxqiu@sjtu.edu.cn
通讯地址：上海市东川路800号化学化工学院A楼317室
个人主页： scce.sjtu.edu.cn
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教育背景
1994 – 1998：青岛化工学院塑料工程系，学士
1998 – 2001：贵州大学化学系，硕士
2001 – 2006：上海交通大学化学化工学院，博士 -
工作经历
2006/11 – 至今：上海交通大学化学化工学院，讲师
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研究方向
1、过渡金属配合物的结构与电子特性
2、过渡金属配合物催化反应机理的理论研究 -
代表性论文专著
论文
Reaction Mechanisms of Ethylene Hydrogenation Catalyzed by Gold(I) Complexes.
Qiu Yi-Xiang; Wan Ming-Da; Chen Xian-Yang; Wang Shu-Guang.
Acta Physico-Chimica Sinica, 29(2), pp 279-286, 2013.
Theoretical Investigations on Tris(pentamethylcyclopentadienyl) Rare Earth Metal Complexes (C5Me5)3Ln (Ln＝Sc, Y, La)
Qiu Yi-Xiang; Wang Shu-Guang.
Acta Chimica Sinica 2012, 70, 1930.
Theoretical Investigations of Phosphine-stabilization on Gold Cluster [Au@Au8(PR3)8]3+(R = Me, OMe, H, F, Cl, CN)
Qiu Yi-Xiang; Wang Shu-Guang.
Chemical Journal of Chinese Universities-Chinese 2012, 33, 2549.
Electronic Structures of Group IB Metal-Ethylene Complexes M-C2H4 (M=Cu, Ag, Au)
Qiu Yi-Xiang; Wang Shu-Guang.
Acta Physico-Chimica Sinica 2012, 28, 811.
Time-dependent Density Functional Theory Studies on the Electronic Spectra of Mo2 and W2 Quadruply Bonded Compounds
Qiu Yi-Xiang; Wang Shu-Guang.
Chemical Journal of Chinese Universities-Chinese 2011, 32, 161.
Theoretical Investigations on Ligand-stabilized Binary Transition-metal Cluster [PdAu8(PR3)8]2+ (R=Me, OMe, H, F, Cl, CN)
Qiu Yi-Xiang; Li Jia; Wang Shu-Guang.
Acta Chimica Sinica 2010, 68, 611.
Density functional theory study on the structures and electronic spectra of quadruply bonded metal compounds M2X4(PMe3)4 (M = Cr, Mo, W; X = F, Cl, Br, I)
Qiu Yi-Xiang; Wang Shu-Guang.
Acta Chimica Sinica 2006, 64, 1793.
Quantum chemical theoretical studies on Au complexes [Au(CH2)2PH2]2X2 (X = F, Cl, Br, I)
Qiu Yi-Xiang; Wang Shu-Guang.
Acta Chimica Sinica 2006, 64, 1416.
A time-dependent DFT study on the electronic excitation states of polycyclic aromatic compound of phenanthrene
Qiu, Yi-Xiang; Zhang Yong; Wang Shu-Guang
Acta Chimica Sinica 2004, 62, 2030.
Gold coated M@Au-12 nano-particles: assessment of different quantum chemical density functional approaches
Qiu Yi-Xiang; Wang Shu-Guang; Schwarz, WHE
Chemical Physics Letters 2004, 397, 374.
Theoretical studies on the structure of Hg-hydroiddic compounds
Qiu Yi-Xiang; Fang Hua; Zhang Yong; Wang Shu-Guang.
Acta Chimica Sinica 2004, 62, 556.
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教学工作
1、本科生：《物理化学》、《物理化学实验》
