标题：赵存元
人物简介
赵存元，男，1962年9月出生，籍贯：甘肃正宁，博士，教授，博士生导师。主要从事催化反应机理及团簇材料分子设计方面的理论研究，在《J. Am. Chem. Soc.》、《 J. Phy. Chem.A》、《 J. Chem. Phys.》、《Organometallics》、《J. Org. Chem.》、《Inorg. Chem.》、《Chem. Eur. J. 》等重要刊物发表论文40多篇[1]
教育背景
1997年11月毕业于南京大学配位化学研究所，理论无机化学专业，获理学博士学位。
1987年7月毕业于西北师范大学化学化工学院，物理化学专业，获理学硕士学位。
1984年7月毕业于西北师范大学化学化工学院，获理学学士学位。
工作简历：
2004.09 - 至今：中山大学化学与化学工程学院，教授；博士生导师。
2002.02-2004.09：香港大学化学系，博士后。
2000.09-2002.02：美国戴维斯加州大学，博士后。
1999.09-2000.09：香港科技大学化学系，博士后。
1996.12-1999.09：西北师范大学化学化工学院，副教授。
1987.07-1996.12：西北师范大学化学化工学院，助教、讲师。
主要研究方向
1. 金属类卡宾化合物、金属氮宾的反应性能、环丙烷化反应及其不对称催化选择性机理的理论研究。
2. 金属团簇及团簇离子的基态和激发态的电子结构、性能及金属团簇光电磁等物理化学性质的分子设计研究。
3. 卤代烃在水溶液中的光化学反应机理的理论研究。
4. 有机张力分子的张力评价及化学键的理论研究。
讲授的主要课程
本科生课程：结构化学， 现代化学实验与技术。
研究生课程：应用量子化学。
论著一览
1. Z. Guo, Z.F. Ke, D.L. Phillips,C. Y. Zhao, Organometallics, 27, 181 (2008), Intrinsic Reaction Coordinate Analysis of the Activation of CH4 by Molybdenum Atoms: A Density Functional Theory Study of the Crossing Seams of the Potential Energy Surfaces.
2. Z. Guo, C. Y. Zhao, D.L. Phillips, E.G. Robertsonc, D. McNaughtonc, J. Phys. Chem. A, 2008, accepted, An Experimental and Theoretical Study of NSCl Decomposition in the Presence of Trace Amounts of Water.
3. 李志伟，赵存元，陈六平，物理化学学报，24, 755 (2008), As ,[As5M]、[As5MAs5] (M=Ti, Zr, Hf)的结构和芳香性
4. Z.W. Li, C. Y. Zhao, L.P. Chen, THEOCHEM, 854, 46 (2008), Structure and aromaticity of Bi , Bi5M (M = Li, Na, K) and Bi5M (M = Be, Mg, Ca) clusters.
5. Z. Guo, X.F. Lin, C. Y. Zhao, D.L. Phillips, THEOCHEM, 848, 119 (2008), Density functional theory study of water-assisted deprotonation of the C8 intermediate in the reaction of the 2-fluorenylnitrenium ion with guanosine to form a C8 adduct.
6. Z.F. Ke, Y. B. Zhou, H. Gao, C. Y. Zhao, D.L. Phillips, Chem. Eur. J., 13, 6724 (2007), On the Mechanism and Stereochemistry of Chiral Lithium Carbenoid Promoted Cyclopropanation Reactions.
7. Z.F. Ke, C. Y. Zhao, D.L. Phillips, J. Org. Chem. 72, 848(2007), Methylene Transfer or Carbometalation? A Theoretical Study to Determine the Mechanism of Lithium Carbenoid Promoted Cyclopropanation Reactions in Aggregation and Solvation States.
8. R. Fang, Z.F. Ke; Y. Shen, C. Y. Zhao; D.L. Phillips, J. Org. Chem., 72, 5139 (2007), Concurrent Cyclopropanation by Carbenes and Carbanions? A Density Functional Theory Study on the Reaction Pathways.
9. X.F. Lin, C. Y. Zhao, C.-M. Che, Z.F. Ke, D.L. Phillips, Chem. Asian. J., 2, 1101 (2007), A DFT Study on the Mechanism of Rh2II,II –Catalyzed Intramolecular Amidation of carbamates (封面论文) .
10.Z.H. Li, Z.F. Ke, C. Y. Zhao, Z.Y. Geng, Y.C. Wang, D.L. Phillips, Organometallics, 25, 3735 (2006), A Density Functional Theory Study of Aluminum Carbenoid (CH3)2AlCH2X (X = Cl, Br, I) Promoted Cyclopropanation Reactions Compared to IMCH2I (M = Li, Sm, Zn) Carbenoids.
11.Z.W. Li, C. Y. Zhao, L.P. Chen, THEOCHEM, 807, 17 (2007), Structure and arom aticity of Sb5− and Sb5M (M=Li, Na, and K) clusters.
12.Z.W. Li, C. Y. Zhao, L.P. Chen, THEOCHEM, 809, 45 (2007), Spectroscopic properties of aromatic heterocyclic systems: XAl3 (X=Si, Ge, Sn, Pb) and their anions and cations.
13. Z.W. Li, C. Y. Zhao, L.P. Chen, THEOCHEM, 810, 1 (2007), Sandwich complexes of the P42- aromatic ring with the first row transition metal.
14. Z.W. Li, C. Y. Zhao, L.P. Chen, J. Theo. Comp. Chem., 2, 363 (2007), Theoretical study of sandwich complexes [Fe(η4-E4)2]2- (E=N, P, As, Sb, and Bi) .
15. 李志伟，赵存元，陈六平，化学进展，18, 1599 (2006)， 芳香性团簇的结构和光谱性质的理论研究进展
16. 周玉炳，柯卓锋，赵存元，化学学报，20, 2071 (2006)， Ru(II)催化有机叠氮与炔反应机理的理论研究
17. C. Y. Zhao, X,F. Lin, W.M. Kwok, X.G. Guan, Y. Du, D.Q. W.K. Fa Hung and D. Lee Phillips, Chem. Eur. J., 11, 1093 (2005), Water-Catalyzed Dehalogenation Reactions of the Isomer of CBr4 and its Reaction Products and a Comparison to Analogous Reactions of the Isomers of Di- and Trihalomethane.s
18. D. L. Phillips, C. Y. Zhao, D. Wang,，J. Phys. Chem. A., 109, 9053 (2005). A Theoretical Study of the Mechanism of the Water Catalyzed HCl Elimination Reactions of CHXCl(OH) (X=H, Cl) and HClCO in the Gas Phase and in Aqueous Solution.
19. X.F. Lin, C. Y. Zhao, D. L. Phillips, J. Org. Chem., 70, 9279 (2005), Modeling SN2 Reactions in Methanol Solution by ab Initio Calculation of Nucleophile Solvent-Substrate Clusters.
20. R. Fang, Z.Y. Geng, Y.C. Wang, C.Y. Zhao, L.Z. Yang, X.H. Zhang Phys. Chem. Lett. 414, 174(2005), Theoretical study of the insertion reaction of CH3O-H by singlet alkylidenecarbenes.
21. X. Q.Guan, X.F. Lin, D. Yong, Y.L. Li, W. M. Kwok, C. Y. Zhao, D.Q. Wang, D. L. Phillips, J. Phys. Chem. A, 109, 1247 (2005), Ultraviolet photolysis of CH2I2 in methanol: O-H insertion and HI elimination reactions to form a dimethoxymethane product.
22. X.F. Lin, X. Q.Guan, W. M. Kwok, C. Y. Zhao, D. Yong, Y.L. Li, D. L. Phillips, J. Phys. Chem. A, 109, 981 (2005), Water-catalyzed O-H Insertion/HI elimination reactions of isodihalomethanes (CH2X-I, where X = Cl, Br, I) with water and the dehalogenation of dihalomethanes in water-solvated environment.s
23. X.F. Lin, C. Y. Zhao, D. L. Phillips, MOLECULAR SIMULATION 31, 483 (2005) An ab initio study of the reactions of CH2X-X (X = Cl, Br, I) isopolyhalomethanes with nCH3OH.
24. W. M. Kwok, C. Y. Zhao, Y-L Li, X., Guan, D. Q. Wang, D. L. Phillips, J. Am. Chem. Soc., 126, 3119 (2004), 水催化异溴仿(CHBr3)脱卤反应及其产物，Water-Catalyzed Dehalogenation Reactions of Isobromoform and Its Reaction Products
25. C. Y. Zhao, K. Balasubramanian, J. Chem. Phys., 22，10501 (2004), Spectroscopic Properties of Novel Aromatic Metal Clusters: NaM4 (M=Al, Ga, I) and their cations and anions.
26. D. Wang, C. Y. Zhao, and D. L. Phillips, Organometallics, 23, 1953 (2004), Theoretical Study of Divalent Lanthanide (Sm and Yb) Complexes with A Triazacyclononane– Functionalized Tetramethyly-clopentadienyl Ligand.
27. D. Wang, C. Y. Zhao, and D. L. Phillips, J. Org. Chem., 69, 5512 (2004), Samarium(III) Carbenoid as a Competing Reactive Species in Samarium-Promoted Cyclopropanation Reactions.
28. X.F. Lin, C. Y. Zhao, D. L. Phillips, Phys. Chem. Lett. 397, 488(2004), Ab initio investigation of the O-Y (Y = CH3, H) insertion/HI elimination reactions of CH2I-I with CH3OH and H2O: comparison of methanol and water catalyzed reactions.
29. C. Y. Zhao, D. Wang, and D. L. Phillips, J. Am. Chem. Soc., 125, 15200 (2003), 钐类卡宾化合物与乙烯环丙烷反应机理及溶剂效应的理论研究，Theoretical Study of Samarium (II) Carbenoid (ISmCH2I) Promoted Cyclopropanation Reactions with Ethylene and the Effect of THF Solvent on the Reaction Pathways.
30. C. Y. Zhao, D. Wang, and D. L. Phillips, J. Theo. Comp. Chem., 2, 357 (2003), Density Functional Theory Study of Selected Mono Zinc and Gem-Dizinc Radical Carbenoid Cyclopropanation Reactions: Observation of an Efficient Radical Zinc carbenoid Cyclopropanation Reaction and the Influence of the Leaving Group on Ring closure.
31. C. Y. Zhao, D. Wang, and D. L. Phillips, J. Am. Chem. Soc., 124, 12903 (2002), 高活性偕二锌及单锌类卡宾化合物与乙烯环丙烷反应性能的密度泛函研究，A Density Functional Theory Investigation of the Remarkable Reactivity of Geminal Dizinc Carbenoids (RZn)2CHI (R=Et or I) as Cyclopropanation Reagents with Olefins Compared to Mono Zinc Carbenoids RZnCHI2, EtCHIZnR (R=Et or I).
32. C. Y. Zhao and K. Balasubramanian, J. Chem. Phys., 116, 10287 (2002), 铅六聚体及其离子的结构及光谱性质，Geometries and Spectroscopic Properties of Lead Hexamer and its ions (Pb6, Pb and Pb).
33. C. Y. Zhao and K. Balasubramanian, J. Chem. Phys., 116, 3690 (2002), 硅五、六聚体及其离子的结构及光谱性质，Geometries and Spectroscopic Properties of Silicon Clusters (Si5, Si , Si ,Si6, Si , and Si).
34. C. Y. Zhao and K. Balasubramanian, J. Chem. Phys., 115, 3121(2001), 锗、锡六聚体及其离子的结构及光谱性质，Geometries and Spectroscopic Properties of Germanium and Tin Hexamers (Ge6, Ge, Ge ,Sn6, Sn , and Sn).
35. Charles Edwin Webster, Michael B. Hall, D. A. Singleton, M.J. Szymanski, C. Y. Zhao, Guochen Jia and Zhenyang Lin, J. Am. Chem. Soc., 123, 9822 (2001), Minimum Energy Structure of Hydridotris(pyrazolyl)borato Iridium(V) Tetrahydride Is Not a C3v Capped Octahedron.
36. Zhitao Xu, C. Y. Zhao and Zhenyang Lin, J. Chem. Soc. Perkin Trans. II, 2319-2323 (2000), A New Approach to the Distortion of the Tetrahedral Geometry at E in the E(ZXY2)4 Compounds.
37. C. Y. Zhao, Wenshan Duan, Yong Zhang, Xiao-Zeng You,J. Chem. Res., 156-157, 耦合常数与键角的关系， Correlation of Coupling Constants JCH and Bond Force Angles in Strained Organic Molecules.
38. Yong Zhang, C. Y. Zhao, Wei-Hai Fang, Zu-Hong Lu, J. Mol. Struc. THEOCHEM, 454 (1), 31-40 (1998), High accuracy studies on the ground state and transition state of SiC2.
39. C. Y. Zhao, Yong Zhang, Xiao-Zeng You,J. Phys. Chem. A, 101, 5174-5182 (1997), 有机张力分子弯键特征和张力评价的理论研究， Theoretical Evaluation of Bent Bond, Strain and Bonding Behavior of Strained Organic Molecules.
40. Yong Zhang, C. Y. Zhao, Xiao-Zeng You, J. Phys. Chem. A, 101, 2879-2885 (1997), A Systematic Study On Structures And Bondings of the Charge-Transfer Complexes of Ammonia With HX, XY And X2 (X And Y Are Halogens).
41. Yong Zhang, C. Y. Zhao, Wei-Hai Fang, Xiao-Zeng You, Theor. Chem. Acc., 96, 129-134 (1997), A Molecular Design View on the First Hyperpolarizability of Salicyli-deneaniline Derivatives.
42. Tian Yu-peng, Duan Chun-ying, C. Y. Zhao, Lu Zhong-lin and You Xiao-zeng, Inorg. Chem., 36, 1247-1252 (1997), Synthesis, Crystal Structure and Second-order Optical Nonlinearity of the bis(2-chlorobenzaldehyde Thiosemicarbazone)Cadmium Halide (CdL2X2) (X=Br, I).
43. Yong Zhang, C. Y. Zhao, Xiao-Zeng You, Chin. Chem. Lett., 8, 323 (1997), Theoretical Study on the Structures, Vibrational Spectra, and the nature of the Intermediate Hydrogen Bond of Schiff Bases.
44. C. Y. Zhao, Yong Zhang, Wei-Hai Fang, Xiao-Zeng You, J. Mol. Struct. (Theochem), 367, 73-82 (1996), A Theoretical Study On The Hyperpolarizabilities Of Dicyanovinyl And Tricyanovinyl Substituted Benzenes, Stilbenes, Styrenes And Azobenzenes.
45. C. Y. Zhao,Yong Zhang, Wei-Hai Fang, Xiao-Zeng You, Chin. J. Chem., 14, 393 (1996), Semiempirical Prediction of the Hyperpolarizabilities for Cyanovinyl-substituted Donor-Acceptor Molecules.
46. 赵存元，萧泰，许先芳，游效曾，17, 769 (1996)， 含环有机分子耦合常数与键角的关系，高等学校化学学报.
47. 赵存元，邱文元，许先芳等，高等学校化学学报, 16, 1587 (1995)，有机张力分子弯键特征的理论研究.
48. 赵存元，王永成，邱文元，韦统师, 科学通报, 36, 331-333 (1992)， 多面体碳烷的结构与张力特性研究.
49. 赵存元，王永成，韦统师，化学学报, 50, 228-332 (1992)，宝塔烷电子结构与张力的ab initio研究.
50. C. Y. Zhao, Tongshi Wei, Chin. Sci. Bull., 37, 1529-1532 (1992), Studies on Structures and Strain Behaviors of Polyhedranes (CH)n .
51. 赵存元，韦统师，邱文元，化学学报，49, 546-552 (1991)，小螺桨烷的弯键研究.
52. 赵存元，韦统师，邱文元，高等学校化学学报，12, 932-934 (1991)，小螺桨烷C-C中心键的量子化学研究.