个人简介
1997年6月毕业于河北师范大学化学系，获理学学士学位；2000年6月研究生毕业于河北师范大学化学系，获理学硕士学位；2005年1月毕业于中国科学院研究生院物理化学专业，获理学博士学位。2000年7月参加工作，2005年11月评为教授。
研究领域
1. 采用电子密度拓扑分析方法研究特殊化学键（氢键、卤键等弱相互作用体系、自由基体系、生命体系中的化学键等）及各类化学反应过程中的化学键的变化规律；
2. 借助紫外光电子能谱实验手段，获得大气瞬态变物种和自由基，给出电离能等数据，结合量子化学手段研究瞬态物种和自由基的性质和电子结构，讨论大气中瞬态自由基的相关反应机理，为消除环境污染提供可能的途径和方法。
近期论文
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1. Wei Li, Yanli Zeng,* Xiaoyan Li, Zheng Sun, Lingpeng Meng*
Insight into the pseudo π-hole interactions in the M3H6···(NCF)n (M = C, Si, Ge, Sn, Pb; n = 1, 2, 3) complexes
Phys. Chem. Chem. Phys., 2016, 18, 24672–24680.
2. Lei Gao, Yanli Zeng,* Xueying Zhang, and Lingpeng Meng*
Comparative Studies on Group III σ-Hole and π-Hole Interactions
J. Comput. Chem. 2016, 37(14), 1321–1327. (Cover image)
3. Wei Li, Yanli Zeng*, Xiaoyan Li, Zheng Sun, Lingpeng Meng*
The Competition of Y···O and X···N Halogen Bonds to Enhance the Group V σ-hole Interaction in the NCY···O=PH3···NCX and O=PH3···NCX···NCY (X, Y = F, Cl, and Br) Complexes
J. Comput. Chem. 2015, 36, 1349–1358.
4. Shasha Zhao, Baoen Xu, Nannan Sun, Zheng Sun, Yanli Zeng*, and Lingpeng Meng*
Improvement in dehydrogenation performance of Mg(BH4)2×2NH3 doped with transition metal: First-principles investigation
Int. J. Hydrogen Energ., 2015, 40, 8721-8731.
5. Wenjie Wu, Xiaoyan Li, Lingpeng Meng, Shijun Zheng, Yanli Zeng*
Understanding the Properties of Inorganic Benzenes Based on π-Electron Densities
J. Phys. Chem. A 2015, 119, 2091−2097.
6. Wei Li, Yanli Zeng*, Xueying Zhang, Shijun Zheng, Lingpeng Meng*
The Enhancing Effects of Group V σ-hole Interactions on the F···O Halogen Bond
Phys. Chem. Chem. Phys., 2014, 16, 19282-19289.
7. Na Han, Yanli Zeng*, Cuihong Sun, Xiaoyan Li, Zheng Sun, Lingpeng Meng*
N···I Halogen Bonding Interactions: The Influence of Lewis Bases on Their Strength and Characters
J. Phys. Chem. A, 2014, 118, 7058−7065.
8. Na Han, Yanli Zeng*, Xiaoyan Li, Shijun Zheng, Lingpeng Meng*
Enhancing Effects of Electron-Withdrawing Groups and Metallic Ions on Halogen Bonding in the YC6F4X···C2H8N2 (X = Cl, Br, I; Y = F, CN, NO2, LiNC+, NaNC+) Complex
J. Phys. Chem. A, 2013, 117 (48), pp 12959–12968.
9. Yanli Zeng, Wenjie Wu, Xiaoyan Li, Shijun Zheng, Lingpeng Meng*
Influence of the Li···π Interaction on the H/X···π Interactions in HOLi···C6H6···HOX/XOH (X = F, Cl, Br, I) Complexes
ChemPhysChem, 2013, 14(8): 1591–1600.
10. Yanli Zeng, Min Zhu, Xiaoyan Li, Shijun Zheng, Lingpeng Meng*
Assessment of intermolecular interactions at three sites of the arylalkyne in phenylacetylene-containing lithium-bonded complexes: Ab initio and QTAIM studies
J. Comput. Chem. 2012, 33, 1321-1327.
11. Yanli Zeng, Xueying Zhang, Xiaoyan Li, Lingpeng Meng, Shijun Zheng
The role of molecular electrostatic potentials in the formation of halogen bond in furan∙∙∙XY and thiophene∙∙∙XY (X=Cl, Br; Y=F, Cl and Br) complexes
ChemPhysChem, 2011, 12, 1080-1087.
12. Yanli Zeng, Min Zhu, Lingpeng Meng, Shijun Zheng
The role of π electrons in the formation of benzene-containing lithium-bonded complexes
ChemPhysChem, 2011, 12, 3584-3590.
13. Yanli Zeng, Jing Hao, Shijun Zheng, Lingpeng Meng
Cooperativity between S∙∙∙π and Rg∙∙∙π in the OCS∙∙∙C6H6∙∙∙Rg (Rg = He, Ne, Ar, and Kr) van der Waals Complexes
J. Phys. Chem. A 2011, 115, 11057–11066.
14. Yanli Zeng, Ke Fan, Xiaoyan Li, Baoen Xu, Xiaozhen Gao, Lingpeng Meng
First-principles studies of the structures and properties of Al- and Ag-substituted Mg2Ni alloys and their hydrides
Int. J. Hydrogen Energ. 2010, 35, 10349-10358.
15. Yanli Zeng, Lingpeng Meng, Xiaoyan Li, Shijun Zheng
Topological characteristics of electron density distribution in SSXY→XSSY (X or Y = F, Cl, Br, I) isomerization reactions
J. Phys. Chem. A 2007, 111, 9093-9101.
16. Yanli Zeng, Shijun Zheng, Lingpeng Meng
Studies on reactions INCX→IXCN(X=O, S, and Se)
Inorg. Chem., 2004, 43, 5311-5320.
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