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EDL structure of ionic liquid-MXene-based supercapacitor and hydrogen bond role on the interface: a molecular dynamics simulation investigation 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 10, 页码: 5903-5913
Authors:  Wang, Ziyi;  Chen, Junwu;  Li, Yao;  Dong, Kun;  Yu, Yinghao
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Overall mechanism of JP-10 pyrolysis unraveled by large-scale reactive molecular dynamics simulation 期刊论文
COMBUSTION AND FLAME, 2022, 卷号: 237, 页码: 12
Authors:  Liu, Han;  Liang, Jinhu;  He, Ruining;  Li, Xiaoxia;  Zheng, Mo;  Ren, Chunxing;  An, Gaojun;  Xu, Ximeng;  Zheng, Zhe
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JP-10  ReaxFF MD  Shock tube  Pyrolysis mechanism  
Molecular dynamics studies on separation of CO2/CH4 by the ionic liquids encapsulated ZIF-8 期刊论文
JOURNAL OF MEMBRANE SCIENCE, 2022, 卷号: 644, 页码: 7
Authors:  Yu, Tianhao;  Cai, Qiong;  Lian, Guoping;  Liu, Lei
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Metal-organic frameworks  Ionic liquids  Molecular dynamics simulations  CO(2 )separation  
Exploration of the Adsorption Kinetics of Surfactants at the Water-Oil Interface via Grand-Canonical Molecular Dynamics Simulations 期刊论文
LANGMUIR, 2022, 卷号: 38, 期号: 3, 页码: 1277-1286
Authors:  Yang, Xue-Dan;  Chen, Wei;  Ren, Ying;  Chu, Liang-Yin
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p Exploration of the Adsorption Kinetics of Surfactants at the Water- Oil Interface via Grand-Canonical Molecular Dynamics Simulations 期刊论文
LANGMUIR, 2022, 页码: 10
Authors:  Yang, Xue-Dan;  Chen, Wei;  Ren, Ying;  Chu, Liang-Yin
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In Situ Network Electrolyte Based on a Functional Polymerized Ionic Liquid with High Conductivity toward Lithium Metal Batteries 期刊论文
ACS APPLIED ENERGY MATERIALS, 2021, 页码: 11
Authors:  Sha, Yifan;  Yu, Tianhao;  Dong, Tao;  Wu, Xing-long;  Tao, Haoyu;  Zhang, Haitao
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lithium metal batteries  polymerized ionic liquid  in situ  solid polymer electrolytes  high conductivity  
Reaction-Controlled Phase-Transfer Process of Polyoxometalate-Based Catalyst for Cellulose Esterification: A Molecular Dynamics Study 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2021, 卷号: 125, 期号: 46, 页码: 25478-25487
Authors:  Liu, Yubing;  Yao, Xiaoqian;  Liu, Xiaomin;  Chen, Wei;  Song, Yu-Fei
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Unraveling the Synergistic Coupling Mechanism of Li+ Transport in an "Ionogel-in-Ceramic" Hybrid Solid Electrolyte for Rechargeable Lithium Metal Battery 期刊论文
ADVANCED FUNCTIONAL MATERIALS, 2021, 页码: 13
Authors:  Song, Xianli;  Wang, Chenlu;  Chen, Junwu;  Xin, Sen;  Yuan, Du;  Wang, Yanlei;  Dong, Kun;  Yang, Lipeng;  Wang, Gongying;  Zhang, Haitao;  Zhang, Suojiang
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hybrid solid electrolytes  ionic bridges  ionogel-in-Ceramic  lithium metal batteries  poly(ionic liquid)s-in-salt  
Phthalocyanine-Triggered Helical Dipeptide Nanotubes with Intense Circularly Polarized Luminescence 期刊论文
SMALL, 2021, 页码: 9
Authors:  Wang, Xiqian;  Zhao, Luyang;  Wang, Chiming;  Feng, Xuenan;  Ma, Qing;  Yang, Gengxiang;  Wang, Tianyu;  Yan, Xuehai;  Jiang, Jianzhuang
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circularly polarized luminescence  dipeptides  nanotubes  phthalocyanines  supramolecular assembly  
Accelerating evaluation of the mobility of ionic liquid-modulated PEDOT flexible electronics using machine learning 期刊论文
JOURNAL OF MATERIALS CHEMISTRY A, 2021, 卷号: 9, 期号: 45, 页码: 25547-25557
Authors:  Ding, Wei-Lu;  Lu, Yumiao;  Peng, Xing-Liang;  Dong, Hao;  Chi, Wei-Jie;  Yuan, Xiaoqing;  Sun, Zhu-Zhu;  He, Hongyan
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