發(fā)表論文目錄 1. Xiaomin Sun,Tingli Sun, Qingzhu Zhang(通訊作者), Wenxing Wang A Theoretical study on the Degradation Mechanism of TeCDD in aqueous solution by Fe(II)/H2O2/UV system, Sci. Total Environ., 2008, 402, 123。IF=2.182 2. Xiaohui Qu, Qingzhu Zhang(通訊作者), Wenxing Wang Theoretical study on NO3-initiated oxidation of acenaphthene in the atmosphere Can. J. Chem., 2008, 86, 129. IF=1.204 3. Qingzhu Zhang, Xiaohui Qu, Wenxing Wang A Quantum Mechanical Study on the Formation of PCDD/Fs from 2-Chlorophenol as Precursor, Environ.Sci.Technol. Revised. IF=4.363 4. Qin Zhou, Qingzhu Zhang(通訊作者), Wenxing Wang Mechanism of OH-initiated Atmospheric Photooxidation of the Organophosphorus Insecticide (C2H5O)3PS, Environ.Sci.Technol. Submitted. IF=4.363 5. Qingzhu Zhang, Xiaohui Qu, Wenxing Wang Mechanism for OH-initiated Atmospheric Photooxidation of Dichlorvos: A Quantum Mechanical Study, Environ.Sci.Technol. 2007, 41, 6109. IF=4.363 6. Qingzhu Zhang, Tingli Sun, Shangqing Li, Wenxing Wang Ab initio and variational transition state approach to atmospheric photooxidation: mechanism and kinetics for the reaction of HN3 with OH radicals Chem. Phys. Lett., 2006, 428, 262. IF=2.207 7. Qingzhu Zhang, Shanqing Li, Wenxing Wang Mechanism and kinetics properties for the reaction of chloroethane with atomic O: A theoretical study Chem. Phys., 2006, 322, 279. IF=1.805 8. Qingzhu Zhang, Haining Wang, Tingli Sun, Wenxing Wang A theoretical investigation for the reaction of CH3CH2SH with atomic H: Mechanism and kinetics properties, Chem. Phys., 2006, 324, 298. IF=1.805 9. Xiaohui Qu, Qingzhu Zhang(通訊作者), Wenxing Wang Degradation mechanism of benzene by NO3 radicals in the atmosphere: A DFT study Chem. Phys. Lett. 2006, 426, 13. IF=2.207 10. Xiaohui Qu, Qingzhu Zhang(通訊作者), Wenxing Wang Theoretical study on mechanism for NO3-initiated atmospheric oxidation of naphthalene Chem. Phys. Lett. 2006, 432, 40. IF=2.207 11. Xiaohui Qu, Qingzhu Zhang(通訊作者), Wenxing Wang Mechanism for OH-initiated photooxidation of naphthalene in the presence of O2 and NOx: A DFT study, Chem. Phys. Lett., 2006, 429, 77. IF=2.207 12. Qingzhu Zhang, Shanqing Li, Tingli Sun, Xiaohui Qu, Wenxing Wang Rate parameters and branching ratios for the multiple-channel Reaction of dimethyl sulfide DMS with atomic H Chem. Phys. Lett., 2005, 414, 316. IF=2.207 13. Tingli Sun, Qingzhu Zhang(通訊作者), Xiaohui Qu, Wenxing Wang Mechanism and direct dynamics studies for the reaction of monoethylsilane EtSiH3 with atomic O (3P) Chem. Phys. Lett. 2005, 407, 527. IF=2.207 14. Qingzhu Zhang, Ruiqin Zhang Ab initio and variational transition state approach to β-C3N4 formation: kinetics for the reaction of CH3NH2 with H J. Phys. Chem. A 2005, 109, 9112. IF=2.918 15. Qingzhu Zhang, Ruiqin Zhang, Yueshu Gu Kinetics and mechanism of O (3P) with CH3CHF2, a theoretical study J. Phys. Chem. A, 2004, 108, 1064. IF=2.918 16. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Theoretical study on the reaction path dynamics and rate constants for the hydrogen-abstraction reaction of atomic O with CH2FCl Chem. Phys. Lett., 2004, 383, 304. IF=2.207 17. Qingzhu Zhang, Yueshu Gu, Shaokun Wang A computational study on mechanism and kinetics for the abstraction reaction of SiHCl3 with atomic O (3P) Chem. Phys. Lett., 2004, 383, 16. IF=2.207 18. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Theoretical studies on the variational transitional state theory rate constants for the hydrogen abstraction reaction of O with CH3Cl and CH2Cl2 J. Chem. Phys., 2003, 119, 4339. IF=3.044 19. Qingzhu Zhang, Shaokun Wang, Yueshu Gu A theoretical investigation on the mechanism and kinetics for the reaction of atomic O with CH3CHCl2 J. Chem. Phys., 2003, 119, 11172. IF=3.044 20. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Theoretical investigation on the mechanism and thermal rate constants for the reaction of atomic O with CHF2Cl J. Phys. Chem. A, 2003, 107, 3069. IF=2.918 21. Shaokun Wang, Qingzhu Zhang, Yueshu Gu Theoretical study on the abstraction reaction of O with CHFCl2 Chem. Phys. Lett., 2003, 373, 33. IF=2.207 22. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Kinetic and mechanistic studies on the abstraction reactions of atomic O with (CH3)3SiH and (CH3)2SiH2 J. Chem. Phys., 2003, 118, 633. IF=3.044 23. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Mechanism and interpolated variational transition state rate constant for the reaction of atomic H with monoethylsilane EtSiH3 J. Phys. Chem. A, 2003, 107, 8295. IF=2.918 24. Qingzhu Zhang, Shaokun Wang, Yueshu Gu A theoretical investigation on the mechanism and kinetics for the reaction of SiH2Cl2 with atomic O (3P) Chem. Phys. Lett., 2003,369,145. IF=2.207 25. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Ab initio mechanism and thermal rate constants for the reaction of atomic H with Ge2H6 New J. Chem., 2003, 27,289. IF=2.651 26. Qingzhu Zhang, Shaokun Wang, Yueshu Gu Direct ab initio and kinetic calculation for the abstraction reaction of atomic O with CH3Br Chem. Phys. Lett., 2002, 352, 521. IF=2.207 27. Qingzhu Zhang, Dongju Zhang, Shaokun Wang, Yueshu Gu. Ab initio and kinetic calculations for the reactions of H with (CH3)(4-n)GeHn (n=1,2,3,4) J. Phys. Chem. A, 2002,106, 122. IF=2.918 28. Qingzhu Zhang, Yueshu Gu, Shaokun Wang Theoretical investigation of the kinetics for the reactions of atomic hydrogen with GeH(4-n)Cln (n=0, 1, 2, 3) J. Phys. Chem. A, 2003, 107, 3884. IF=2.918 29. Qingzhu Zhang, Shaokun Wang, Jianhua Zhou, Yueshu Gu Ab initio and kinetic calculation for the abstraction reaction of atomic O (3P) with SiH4 J. Phys. Chem. A, 2002,106, 115. IF=2.918 30. Qingzhu Zhang, Shaokun Wang, Yueshu Gu Direct ab initio dynamics studies of the reactions of H With SiH(4-n)Cln (n=1~3) J. Phys. Chem. A, 2002,106, 3796. IF=2.918 31. Qingzhu Zhang, Shaokun Wang, Yueshu Gu Theoretical investigation of the kinetics for the reactions of H with GeH(4-n)Fn (n=0, 1, 2,3) J. Phys. Chem. A, 2002,106, 9071. IF=2.918 32. Qingzhu Zhang, Shaokun Wang, Jianhua Zhou, Yueshu Gu Ab initio and kinetic calculation for the abstraction reaction of atomic O (3P) with Si2H6 Chem. Phys. Lett., 2002, 354, 291. IF=2.207 33. Qingzhu Zhang, Shaokun Wang, Chunsheng Wang, Yueshu Gu Ab initio and kinetic calculations for the reactions of H with SiH(4-n)Fn Phys. Chem. Chem. Phys., 2001, 3, 4280. IF=3.343
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