Yue Liu
Yue Liu(刘越)
Senior Postdoctoral Researcher
- Institute of Functional Nano & Soft Materials Soochow University
- office: 912-408
- Soochow University Dushu-Lake Campus Box 33, 199 Ren’ai Rd, Suzhou Industrial Park Suzhou, Jiangsu, 215123, P.R. China
- Email: yliu1992@suda.edu.cn
Experience
- 2020.08 - now.
Postdoc Researcher.
Institute of Functional Nano & Soft Materials.
Soochow University.
Education
-
2014.9 - 2020.6
Ph.D.in Physical Chemistry
College of Chemistry and Molecular Sciences
Wuhan University, China
Advisor: Prof. Baoshan Wang -
2010.9 - 2014.6
B.S.in Polymer materials and engineering.
College of Materials Science and Engineering.
Wuhan Institute and Technology, China.
Publications
- Yue Liu, Yu Wu, Qintao Sun, Bingyun Ma, Peiping Yu, Liang Xu, Miao Xie, Hao Yang, Tao Cheng*. Formation of Linear Oligomers in Solid Electrolyte Interphase via Two-Electron Reduction of Ethylene Carbonate. Advanced Theory and Simulations, 2022, 2100612.
- Yue Liu, Qintao Sun, Peiping Yu, Bingyun Ma, Hao Yang, Jiayi Zhang, Miao Xie, Tao Cheng*. In Situ Formation of Circular and Branched Oligomers in a Localized High Concentration Electrolyte at the Lithium-Metal Solid Electrolyte Interphase: A Hybrid ab initio and Reactive Molecular Dynamics Study. Journal of Materials Chemistry A, 2022, 10, 632-639.
- Yue Liu, Peiping Yu, Qintao Sun, Yu Wu, Miao Xie, Hao Yang, Tao Cheng*, William A Goddard III. Predicted Operando Polymerization at Lithium Anode via Boron Insertion. ACS Energy Letter 2021, 6, 2320−2327.
- Yue Liu, Qintao Sun, Peiping Yu, Yu Wu, Liang Xu, Hao Yang, Miao Xie, Tao Cheng*, William A Goddard III. Effects of High and Low Salt Concentrations in Electrolytes at Lithium−Metal Anode Surfaces Using DFT-ReaxFF Hybrid Molecular Dynamics Method. Journal of Physical Chemistry Letters 2021, 12, 2922−2929.
- Yue Liu, Peiping Yu, Yu Wu, Hao Yang, Miao Xie, Liyuan Huai, William A Goddard III, Tao Cheng. The DFT-ReaxFF Hybrid Reactive Dynamics Method with Application to the Reductive Decomposition Reaction of the TFSI and DOL Electrolyte at a Lithium−Metal Anode Surface. Journal of Physical Chemistry Letters 2021, 12, 1300−1306.
- Yue Liu, Hua Hou, Baoshan Wang, Theoretical Study on Cycloaddition Reaction of Epoxides with CO2 Catalyzed by Metal-Porphrin Complexes: Reaction Mechanisms and Structure Impacts on Catalytic Activity. Journal of Organometallic Chemistry, 2020, 911,121123.
- Yue Liu, Hua Hou, Baoshan Wang, Thermal decomposition of vegetable insulating oils from reactive molecular dynamics. Chemical Physics Letters, 2020, 746, 137248.
- Yue Liu, Jiayi Hu, Hua Hou, Baoshan Wang, ReaxFF Reactive Force Field Development and Application for Molecular Dynamics Simulations of Heptafluoroisobutyronitrile Thermal Decomposition. Chemical Physics Letters, 2020, 751, 137554.
- Yue Liu, Jiayi Hu, Hua Hou, Baoshan Wang, Development and Application of a ReaxFF Reactive Force Field for Molecular Dynamics of Perfluorinatedketones Thermal Decomposition. Chemical Physics, 2020, 538, 110888.
- Weirong Wu, Yue Liu, Jiayi Hu, Jiageng Xiong, Hua Hou, Mechanistic Insight into the Rhodium(III)-Catalyzed Ortho-Selective Coupling of Diverse Arenes with 4-Acyl-1-Sulfonyltriazoles: A Computational Study. International Journal of Quantum Chemistry, 2020, 120, e26119.
- Miao Xie, Yu Wu, Yue Liu, Peiping Yu, Jia Ran, William A Goddard III, Tao Cheng, Pathway of in situ polymerization of 1,3-dioxolane in LiPF6 electrolyte on Li metal anode. Materials Today Energy, 2021, 100730.
- Peiping Yu, Qintao Sun, Yue Liu, Bingyun Ma, Hao Yang, Miao Xie, Tao Cheng*, Multiscale Simulation of Solid Electrolyte Interface Formation in Fluorinated Diluted Electrolytes with Lithium Anodes. ACS Applied Material Interfaces, 2022, https://doi.org/10.1021/acsami.1c22610.
- Yu Wu, Qintao Sun, Yue Liu, Peiping Yu, Bingyun Ma, Hao Yang, Miao Xie, Tao Cheng*, Reduction Mechanism of Solid Electrolyte Interphase Formation on Lithium Metal Anode: Fluorine-Rich Electrolyte. Journal of The Electrochemical Society, 2022, 169, 010503.
- Yanyan Zhang, Yue Liu, Yiming Lu, Peiping Yu, Wenxuan Du, Bingyun Ma, Miao Xie, Hao Yang, Tao Cheng*, Multi-scale Simulation Reveals the Decomposition Mechanism of Electrolyte on Lithium Metal Electrode, Journal of Electrochemistry, 2021, 27(0).