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Insight into the Relationship between Viscosity and Hydrogen Bond of a Series of Imidazolium Ionic Liquids: A Molecular Dynamics and Density Functional Theory Study 期刊论文
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2019, 卷号: 58, 期号: 40, 页码: 18848-18854
Authors:  Jiang, Kun;  Liu, Lei;  Liu, Xiaomin;  Zhang, Xiaochun;  Zhang, Suojiang
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Potential-Energy Surface and Dynamics Simulation of THBDBA: An Annulated Tetraphenylethene Derivative Combining Aggregation-Induced Emission and Switch Behavior 期刊论文
CHEMPHOTOCHEM, 2019, 卷号: 3, 期号: 9, 页码: 814-824
Authors:  Ding, Wei-Lu;  Peng, Xing-Liang;  Cui, Gang-Long;  Li, Ze-Sheng;  Blancafort, Lluis;  Li, Quan-Song
Favorite  |  View/Download:29/0  |  Submit date:2019/11/12
aggregation-induced emission  conical intersections  density functional calculations  dynamics simulations  photoswitches  
Gas separation by ionic liquids: A theoretical study 期刊论文
CHEMICAL ENGINEERING SCIENCE, 2018, 卷号: 189, 页码: 43, 55
Authors:  Zhao, YS;  Pan, MG;  Kang, XJ;  Tu, WH;  Gao, HS;  Zhang, XP;  Zhao, Yongsheng;  Pan, Mingguang;  Kang, Xuejing;  Tu, Wenhui;  Gao, Hongshuai;  Zhang, Xiangping
Favorite  |  View/Download:35/0  |  Submit date:2018/12/29
Ionic liquids  HYDROGEN-BONDS  Gas separation  AB-INITIO  CO2 capture  ENERGY DECOMPOSITION  Mechanism  CO2  Hydrogen bond  ABSORPTION  COMPLEXES  MOLECULES  DENSITIES  DATABASE  CAPTURE  
An entropy criterion for the validity of Navier-Stokes order continuum theory for gas-solid flow: Kinetic theory analysis 期刊论文
CHEMICAL ENGINEERING SCIENCE, 2017, 卷号: 172, 期号: NOV, 页码: 297-309
Authors:  Zhao, Bidan;  Wang, Jing;  Wang, Junwu
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Entropy  Continuum Mechanics  Gas-solid Flow  Fluidization  Kinetic Theory  
Promoted bioelectrocatalytic activity of microbial electrolysis cell (MEC) in sulfate removal through the synergy between neutral red and graphite felt 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2017, 卷号: 327, 期号: NOV, 页码: 183-192
Authors:  Wang, Kai;  Cao, Zhiqin;  Chang, Junjun;  Sheng, Yuxing;  Cao, Hongbin;  Yan, Keping;  Zhang, Yi;  Xia, Zheng
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Microbial Electrolysis Cell  Neutral Red  Graphite Felt  Electron Transfer Efficiency  Sulfate Removal  Microbial Activity And Community  
Synthesis of nanosheet-constructed SnO2 spheres with efficient photocatalytic activity and high lithium storage capacity 期刊论文
IONICS, 2017, 卷号: 23, 期号: 11, 页码: 3177-3185
Authors:  Sun, Xiaolei;  Qiao, Li;  Qiao, Li;  Pang, Hua;  Li, Dan
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Sno2  Structural Materials  Nanostructures  Photocatalysis  Lithium-ion Batteries  
LiF as an Artificial SEI Layer to Enhance the High-Temperature Cycle Performance of Li4Ti5O12 期刊论文
LANGMUIR, 2017, 卷号: 33, 期号: 42, 页码: 11164-11169
Authors:  Zhang, Lan;  Zhang, Kaihang;  Shi, Zhaohui;  Zhang, Suojiang
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Reinforced As(III) oxidation by the in-situ electro-generated hydrogen peroxide on MoS2 ultrathin nanosheets modified carbon felt in alkaline media 期刊论文
ELECTROCHIMICA ACTA, 2017, 卷号: 252, 期号: OCT, 页码: 245-253
Authors:  Xue, Yudong;  Zheng, Shili;  Zhang, Yi;  Jin, Wei
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Mos2 Nanosheets  Heavy Metal Remediation  Oxygen Reduction  Arsenic Oxidation  Alkaline Media  
A grid-independent EMMS/bubbling drag model for bubbling and turbulent fluidization 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2017, 卷号: 326, 期号: OCT, 页码: 47-57
Authors:  Luo, Hao;  Lu, Bona;  Zhang, Jingyuan;  Wu, Hao;  Wang, Wei
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Fluidized Bed  Emms  Simulation  Grid Dependence  Drag Coefficient  Cfd  
Insight of Transmembrane Processes of Self-Assembling Nanotubes Based on a Cyclic Peptide Using Coarse Grained Molecular Dynamics Simulation 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2017, 卷号: 121, 期号: 38, 页码: 9006-9012
Authors:  Fu, Yankai;  Yang, Tingxuan;  Xu, Xia
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