Year 2003

28. Time-dependent wave packet theoretical study for D+HCN reaction with SVRT model
Wan-Yong Ma, Guang-Hui Yang, Jian-Hua Zhou, Ke-Li Han
高等学校化学学报, 2003, 24, 1274.
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27. Theoretical study on the ClO/ClO2 system electron-transfer reactivity by the Golden-rule
Shi-Hai Yan, Yu-Xiang Bu, Mei Qin, Li-Xiang Sun, Ke-Li Han
JOURNAL OF MOLECULAR STRUCTURE (THEOCHEM), 2003, 629, 105.

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26. Golden-rule treatment on the ClO/ClO+ electron-transfer system
Shi-Hai Yan, Yu-Xiang Bu, Mei Qin, Li-Xiang Sun, Ke-Li Han
JOURNAL OF MOLECULAR STRUCTURE (THEOCHEM), 2003, 629, 151.

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25. Time-dependent quantum wave packet calculation for nonadiabatic F(2P3/2 ,2P1/2)+H2 reaction
Yan Zhang, Ting-Xian Xie, Ke-Li Han, Zeng-Hui Zhang
JOURNAL OF CHEMICAL PHYSICS, 2003, 119, 12921.

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24. Ultrafast Vibrational and Thermal Relaxation of Dye Molecules in Solutions
Jian-Yong Liu, Wen-Hui Fan, Ke-Li Han, Wei-Qiao Deng, Da-Li Xu, Nan-Quan Lou
JOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107, 10857.

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23. Reactivity of the Ground and Excited Spin-Orbit States for the Reaction of the F(2P3/2,2P1/2) with D2
Yan Zhang, Ting-Xian Xie, Ke-Li Han
JOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107, 10893.

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22. Theoretical study of the C2(1Σ+g , 3Πu) + H2O reaction mechanism
Jia-Hai Wang, Ke-Li Han, Guo-Zhong He, Zhuang-Jie Li, Vernon R. Morris
JOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107, 9825.

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21. Density Functional Study on The Mechanism of Bicyclic Guanidine-Catalyzed Strecker Reaction
Jing Li, Wan-Yi Jiang, Ke-Li Han, Guo-Zhong He, Can Li
JOURNAL OF ORGANIC CHEMISTRY, 2003, 68, 8786.

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20. Theoretical study of the X+YCl (X,Y=H,D) reactions
Li Yao, Ke-Li Han, Dong-Hui Zhang
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2003, 50, 565.

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19. Time-department wave packet approach to Rabi oscillation in strong laser field
Qing-Tian Meng, Hui-Gaung Yang, Ke-Li Han
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2003, 95, 30.

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18. 氯原子与甲酸反应的反应路径和动力学研究
Guang-Hui Yang, Xiang Zhang, Hong-Xing Zhang, Ke-Li Han, Jia-Zhong Sun
化学学报, 2003, 61, 499.

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17. Theoretical study of the femtosecond-resolved photoelectron spectrum of the NO molecule
Qing-Tian Meng, Guang-Hui Yang, Hai-Lin Sun, Ke-Li Han, Nan-Quan Lou
Physical Review A, 2003, 67, 063202-1.

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16. 飞秒荧光亏蚀技术研究液相体系取向弛豫
Jian-Yong Liu, Wen-Hui Fan, Ke-Li Han, Da-Li Xu, Nan-Quan Lou
化学物理学报, 2003, 16, 161.

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15. Glycine–Zn+/Zn2+ and their hydrates: On the number of water molecules necessary to stabilize the switterionic glycine-Zn+/Zn2+ over the nonzwitterionic ones
Hong-Qi Ai, Yu-Xiang Bu, Ke-Li Han
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 10973.

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14. Photo-induced reactions in the ion-molecule complex Mg+-OCNC2H5
Ju-Long Sun, Hai-Chuan Liu, Ke-Li Han, Shi-He Yang
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 10455.

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13. Controlling the orientation and alignment of reagent molecules by polarized laser
Shu-Lin Cong, Ke-Li Han, Nan-Quan Lou
CHINESE PHYSICS LETTERS, 2003, 20, 1038.

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12. Quantum dynamics study of isotope effect for H+CH4 reaction using the SVRT model
Xin Zhang, Guang-Hui Yang, Ke-Li Han, Ming-Liang Wang, Zeng-Hui Zhang
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 9266.

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11. Close-coupling time-dependent quantum dynamics study of the H+HCl reaction
Li Yao, Ke-Li Han, He-Shan Song, Dong-Hui Zhang
JOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107, 2781.

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10. Accurate quantum mechanical calculation for the N+OH reaction
Mao-Du Chen, Bi-Yu Tang, Ke-Li Han, Nan-Quan Lou, Zeng-Hui Zhang
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 6852.

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9. Theoretical study of stereodynamics for the reactions Cl+H2/HD/D2
Mao-Du Chen, Ke-Li Han, Nan-Quan Lou
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 4463.

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8. MRCl potential curve and analytical potential energy function of the ground state of H2
Chuan-Lu Yang, Yu-Jun Huang, Xin Zhang, Ke-Li Han
JOURNAL OF MOLECULAR STRUCTURE (THEOCHEM), 2003, 625, 289.

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7. Photodissociation of nitrobenzene at 266 nm: Experimental and theoretical approach
Ya-Min Li, Ju-Long Sun, Hong-Ming Yin, Ke-Li Han, Guo-Zhong He
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 6244.

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6. Photodissociation dynamics of the S2 state of CH3ONO: State distributions and alignment effects of the NO(X2P) photofragment
Hong-Ming Yin, Ju-Long Sun, Ke-Li Han, Guo-Zhong He
JOURNAL OF CHEMICAL PHYSICS, 2003, 118, 8248.

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5. Calculations of the F+HD reaction on three potential energy surfaces
Ting-Xian Xie, Yan Zhang, Mei-Yu Zhao, Ke-Li Han
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2003, 5, 2034.

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4. Ultrafast dynamics of dye molecules in solution as a function of temperature
Jian-Yong Liu, Wen-Hui Fan, Ke-Li Han, Da-Li Xu, Nan-Quan Lou
JOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107, 1914.

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3. Orientation and alignment of reagent molecules by two-photon excitation
Shu-Lin Cong, Ke-Li Han, Nan-Quan Lou
PHYSICS LETTERS A, 2003, 306, 326.

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2. Photodissociation of m-bromotoluene at 266nm
Xi-Bin Li, Guang-Jun Wang, Jian-Hua Huang, Ke-Li Han, Guo-Zhong He, Nan-Quan Lou
CHEMICAL PHYSICS, 2003, 287, 285.

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1. Ab initio study of reaction mechanism of C2 + H2S
Jia-Hai Wang, Ke-Li Han, Guo-Zhong He, Zhuang-Jie Li
CHEMICAL PHYSICS LETTERS, 2003, 368, 139.

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