研究兴趣

理论与计算光化学

代表性文章

1. Qian Wang, Xiao-Ying Xie, Juan Han,* and Ganglong Cui*，QM and QM/MM Studies on Excited-State Relaxation Mechanisms of Unnatural Bases in Vacuo and Base Pairs in DNA，J. Phys. Chem. B 2017, 121, 10467−10478
2. Juan Han, Lin Shen, Xuebo Chen* and Weihai Fang*, Phosphorescent mechanism for single-dopant white OLED of FPt: electronic structure and electron exchange-induced energy transfer , J. Mater. Chem. C, 2013, 1, 4227-4235
3. Juan Han, Xuebo Chen, Lin Shen, Yue Chen, Weihai Fang and Haobin Wang. Energy transfer tunes phosphorescent color of single-dopant white OLED, Chem. Eur. J., 2011, 17, 13971.
4. Yue Chen, Juan Han and Weihai Fang，Mechanism of water oxidation to molecular oxygen with osmocene as photocatalyst: A theoretical study, Inorg. Chem. Accepted
5. Qiu Fang, Juan Han, Jieling Jiang, Xuebo Chen and Weihai Fang. The conical intersection dominates the generation of tropospheric hydroxyl radicals from NO2 and H2O, J. Phys. Chem. A, 2010, 114, 4601.
6. Wensheng Zou, Juan Han and Weijun Jin. Concentration-dependent Br…O halogen bonding between carbon tetrabromide and oxygen-containing organic solvents, J. Phys. Chem. A, 2009, 113, 10125.