杜本妮 - 江苏师范大学 - 化学与材料科学学院

研究领域

1. 挥发性有机化合物的大气降解机理； 2. 分子间的弱相互作用等。

近期论文

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Benni Du、Weichao Zhang ,Theoretical study on the reaction mechanism of the OH-initiated oxidation of CH2=C(CH3)CH2CH2OH. Structure Chemistry, 2011,22, 589-604. Benni Du、Weichao Zhang ,Theoretical mechanistic study of OH-initiated atmospheric oxidation reaction of allyl alcohol in the presence of O2 and NO. Computational and Theoretical Chemistry, 2011, 977(1-3), 111-122. Benni Du、Changjun Feng、Weichao Zhang、Lailong Mu, Theoretical study on the mechanism for the reaction of OH with CH2=CHCH2CH2OH. Chemical Physics, 2010,367(1),52–61. Benni Du、Changjun Feng、Weichao Zhang, Theoretical studies on the reaction mechanisms and rate constants for OH radicals with CF3CF=CH2. Chemical Physics Letters, 2009,479(1-3), 37-42. Benni Du、Weichao Zhang、Lailong Mu、Changjun Feng、Zhenglong Qin, Computational study of the reaction mechanism of benzylperoxy radical with HO2 in the gas phase. Chemical Physics Letters, 2007, 445(1-3), 17-21. Benni Du、Weichao Zhang, Ab initio quantum chemical studies on the reactions of CF3O2 with OH. Chemical Physics, 2006, 327(1), 10-14. Benni Du、Weichao Zhang, Ab initio MO study of potential energy surface of NH2 with CN reaction. International Journal of Quantum Chemistry, 2006,106(8), 1827-1843. Benni Du、Weichao Zhang、Changjun Feng, Theoretical study on the mechanism and rate constants for the gas phase reaction of OH radicals with trans-CF3CHCHF. Journal of Molecular Structure: THEOCHEM, 2008,856(1-3),30-37. Benni Du、Weichao Zhang、Lailong Mu、Changjun Feng, Reaction of NH ( ) radical with C2H4: A theoretical study. Journal of Molecular Structure: THEOCHEM, 2007,816(1-3), 21-29. Benni Du、Weichao Zhang、Lailong Mu、Changjun Feng、Zhenglong Qin, G3(MP2) study of the reaction of O(3P) with CF3CH=CH2. Journal of Molecular Structure: THEOCHEM, 2007, 821(1-3), 82-88.