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A novel ion-pair strategy for efficient separation of lithium isotopes using crown ethers 期刊论文
SEPARATION AND PURIFICATION TECHNOLOGY, 2021, 卷号: 274, 页码: 12
Authors:  Cui, Li;  Li, Shasha;  Kang, Jin;  Yin, Caixia;  Guo, Yanxia;  He, Hongyan;  Cheng, Fangqin
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Lithium Isotopes  Crown Ethers  Ion Pair  Urey Model  Dft Calculation  
Visualized Reaction Tracking and Physical Property Analysis for a Picked 3D Area in a Reactive Molecular Dynamics Simulation System 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2021, 卷号: 37, 期号: 10, 页码: 11
Authors:  Tang, Yujie;  Zheng, Mo;  Ren, Chunxing;  Li, Xiaoxia;  Guo, Li
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ReaxFF MD  Regional reaction tracking  Physical property  Visualization  
ReaxFF Molecular Dynamics Simulations of Thermal Reactivity of Various Fuels in Pyrolysis and Combustion 期刊论文
ENERGY & FUELS, 2021, 卷号: 35, 期号: 15, 页码: 11707-11739
Authors:  Li, Xiaoxia;  Zheng, Mo;  Ren, Chunxing;  Guo, Li
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Prediction of the Liquid-Liquid Extraction Properties of Imidazolium-Based Ionic Liquids for the Extraction of Aromatics from Aliphatics 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2021, 卷号: 61, 期号: 7, 页码: 3376-3385
Authors:  Yu, Tianhao;  Olsson, Emilia;  Lian, Guoping;  Liu, Lei;  Huo, Feng;  Zhang, Xiangping;  Cai, Qiong
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Molecular dynamics study on the stability of foot-and-mouth disease virus particle in salt solution 期刊论文
MOLECULAR SIMULATION, 2021, 页码: 8
Authors:  Li, Chen;  Chen, Wei;  Lin, Xuan;  Zhang, Songping;  Wang, Yufei;  He, Xianfeng;  Ren, Ying
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Foot-and-mouth disease virus  saline solution  stability  molecular dynamics simulation  free energy calculation  
Abnormal Enhanced Free Ions of Ionic Liquids Confined in Carbon Nanochannels 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2021, 卷号: 12, 期号: 26, 页码: 6078-6084
Authors:  Wang, Mi;  Wang, Yanlei;  Wang, Chenlu;  Gan, Zhongdong;  Huo, Feng;  He, Hongyan;  Zhang, Suojiang
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Exploring NH3 Transport Properties by Tailoring Ionic Liquids in Pebax-Based Hybrid Membranes 期刊论文
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2021, 卷号: 60, 期号: 26, 页码: 9570-9577
Authors:  Yang, Bingbing;  Bai, Lu;  Wang, Zhenlei;  Jiang, Haiyan;  Zeng, Shaojuan;  Zhang, Xiaochun;  Zhang, Xiangping
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Mechanistic insight into morphological transition of Pluronic aggregates in aqueous solution via tuning hydrogen bonding strength 期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2021, 卷号: 333, 页码: 9
Authors:  Luo, Haiyan;  Jiang, Kun;  Wang, Xiaotian;  Liang, Xiangfeng;  Liu, Huizhou;  Li, Yingbo
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Morphology  Block copolymer  Hydrogen bonding  Strength  Mechanism  
The study of the optical phonon frequency of 3C-SiC by molecular dynamics simulations with deep neural network potential 期刊论文
JOURNAL OF APPLIED PHYSICS, 2021, 卷号: 129, 期号: 24, 页码: 11
Authors:  Chen, Wei;  Li, Liang-Sheng
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A Bubble-Assisted Approach for Patterning Nanoscale Molecular Aggregates 期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2021, 页码: 8
Authors:  Min, Fanyi;  Zhou, Peng;  Huang, Zhandong;  Qiao, Yali;  Yu, Changhui;  Qu, Zhiyuan;  Shi, Xiaosong;  Li, Zheng;  Jiang, Lang;  Zhang, Zhen;  Yan, Xuehai;  Song, Yanlin
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Bubble Template  High-resolution Patterning  Interface Confined Assembly  Molecular Aggregate  Organic Molecules