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王斌 2017级本科生     进组时间: 2017年9月    离组时间: 2021年6月

辽宁大连人,现于布鲁塞尔自由大学攻读博士学位。

发表论文:

1.Nature and origin of γ-gauche effect in sulfoxides: A density functional theory and information-theoretic approach study, Bin Wang, Donghai Yu, Dongbo Zhao, Chunying Rong, Shubin Liu, Chem. Phys. Lett. 730, 451 – 459 (2019).

2.A comparative study to predict regioselectivity, electrophilicity and nucleophilicity with Fukui function and Hirshfeld charge, Bin Wang, Chunying Rong, Pratim K. Chattaraj, and Shubin Liu, Theor. Chem. Acc. 138, 124 (2019).

3.Information‐theoretic approach in density functional theory and its recent applications to chemical problems, Chunying Rong, Bin Wang, Dongbo Zhao, and Shubin Liu, WIREs Comput. Mol. Sci. 2019: e1461 (2019) News Report.

4.Quantifications and Applications of Relative Fisher Information in Density Functional Theory, Bin Wang, Dongbo Zhao, Tian Lu, Shubin Liu, Chunying Rong, J. Phys. Chem. A 125, 3802–3811 (2021).

5.Changes in Structure and Reactivity of Ng2 Encapsulated in Fullerenes: A Density Functional Theory Study, Meng Li, Xin He, Bin Wang, Dongbo Zhao, Chunying Rong, Pratim K. Chattaraj and Shubin Liu, Front. Chem. 8, 566 (2020).

6.Towards Understanding Metal Aromaticity in Different Spin States: A Density Functional Theory and Information-Theoretic Approach Analysis, Xin He, Donghai Yu, Jingyi Wu, Bin Wang, Chunying Rong, Pratim K. Chattaraj, and Shubin Liu, Chem. Phys. Lett. 761, 138065 (2020).

7.Density Functional Theory and Information-Theoretic Approach Study on the Origin of Homochirality in Helical Structures, Meng Li, Xin He, Jie Chen, Bin Wang, Shubin Liu, and Chunying Rong, J. Phys. Chem. A. 125, 1269–1278 (2021).

8.Using Bases as Initiators to Isomerize Allylic Alcohols: Insights from Density Functional Theory Studies, Lin Zhang, Bin Wang,Yaqi Zhao, Min Pu, Shubin Liu and Ming Lei, J. Phys. Chem. A 125, 2316 – 2323 (2021).

9.Conformational changes for porphyrinoid derivatives: an information-theoretic approach study, Xin He, Ming Li, Donghai Yu, Bin Wang, Dongbo Zhao, Chunying Rong, and Shubin Liu, Theor. Chem. Acc. 140, 123 (2021).

10.Density Functional Theory Studies of Boron Clusters with Exotic Properties in Bonding, Aromaticity and Reactivity, Zhao Dongbo, Xin He, Meng Li, Bin Wang, Chunna Guo, Chunying Rong, Pratim Chattaraj and Shubin Liu, Phys. Chem. Chem. Phys. 23, 24118 – 24124 (2021).