研究领域
1、有机分子和组装体分子的红外、拉曼光谱的实验和理论研究，以及金银及半导体基底上拉曼增强光谱的实验、理论及其增强机理的研究；
2、小分子体系、复杂体系中的分子间相互作用以及生物分子有序聚集体的结构和功能的光谱和理论研究。
3、小分子自由基的光谱性质、解离性质、化学反应的机理及其动力学的理论研究；重要金属有机化合物的结构和性质以及反应机理的理论研究。
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（温馨提示：请注意重名现象，建议点开原文通过作者单位确认）
The prominent enhancing effect of a cation-? interaction on the halogen-hydride halogen bonding in M1···C6H5X···HM2 (M1 = Li+, Na+; X = Cl, Br; M2 = Li, Na, BeH, MgH) complex.ChemPhysChem12(2011): 2289-2295 (SCI=3.339) 3T/5（通讯作者）
Cooperativity between halogen bond and hydrogen bond in H3N???XY???HF (X, Y = F, Cl, and Br) complexes. ChemPhysChem 9(2008): 2265-2269. (SCI=3.636) 4T/6（通讯作者）
Big effect of alkali metals on MCCBr-NCM (M = Li and Na) halogen-bonded complexes. Journal of Physical Chemistry A 114(2010): 10320–10325. (SCI=2.732) 1/8（首位）
Gigantic blue shift of the H-Ar stretch vibration in π hydrogen-bonded C2H2···HArCCF complex. Journal of Physical Chemistry A 113(2009): 5235-5239. (SCI=2.899) 1/6（首位）
Density functional theory and two-dimensional correlation polarized infrared spectroscopy studies on the anti-ferroelectric liquid crystal (1-methylheptyl)4-(4 '-decyloxy-4-biphenyl) oxymethylene benzoate. Journal of Molecular Structure 889(2008): 45-53. (SCI=1.594) 1/5（首位）
The single-electron hydrogen, lithium, and halogen bonds with HBe, H2B, and H3C radicals as the electron donor: An ion-pair halogen bond Structural Chemistry 23 (2012): 411-416. (SCI=1.727) 5T/5（通讯作者）
Competition between dihydrogen bond and beryllium bond in complexes between HBeH and HArF: A huge blue shift of distant H-Ar stretch Spectrochimica Acta Part A 90 (2012): 135-140. (SCI=1.77) 4T/5（通讯作者）
The structure, properties, and nature of HArF-benzene complex: Redshift and blueshift of Ar–H stretch frequency and rare gas atomic number dependence of hydrogen bonds. Spectrochimica Acta Part A84(2011): 68-73. (SCI=1.77) 4T/6（通讯作者）
Theoretical study on the cooperativity of hydrogen bonds in (HNC)2···HF complexes. Journal of Molecular Structure (Theochem) 896(2009): 112-115. (SCI=1.216) 3T/6（通讯作者）
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