研究领域
纳米功能材料的理论模拟
主要从新颖纳米功能材料的表面修饰，及其光、电、磁及化学性能的调控
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Y.Chen, Junqian Li, Prediction of Chemical Anisotropy on Sidewall of Boron Nitride Nanotubes: A New Application of Directional Curvature Theory, J.Phys.Chem.C 2008, 112, 18787-18792.
Y.Chen, ChunLi Hu, Junqian Li, Guixiao Jia, Yong-fan Zhang, Theoretical Study of O2 Adsorption and Reactivity on SWBNNTs, Chem.Phys.Lett. 2007, 449 149-154.
Y.Chen, ChunLi Hu, Junqian Li, Adsorption of Fe(CO)(4) on the sidewall of boron nitride nanotubes: A periodic DFT study. Chinese J. Struct.Chem., 2008, 27, 1009-1012.
Y.Chen, Junqian Li, An Efficient Critetion for the Formation Enegies and Reactivities of Defects in CNTs and BNNTs, J.Theor.Comput.Chem. 2008,7,681-695.
Junqian Li, Guixiao Jia, Yongfan Zhang, and Yong Chen, Bond-curvature effect of sidewall [2+1] cycloadditions of single-walled carbon nanotubes: A new criterion to the adduct structures, Chem. Mater. 2006, 18, 3579-3584.
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