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Concentration fluctuation due to reaction-diffusion coupling near an isolated active site on catalyst surfaces 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2019, 卷号: 373, 页码: 744-754
Authors:  Li, Yanping;  Zhao, Mingcan;  Li, Chengxiang;  Ge, Wei
Favorite  |  View/Download:5/0  |  Submit date:2019/09/03
Molecular dynamics simulation  Reaction-diffusion coupling  Isolated active sites  Concentration fluctuation  Hard sphere model  
A multilevel-skin neighbor list algorithm for molecular dynamics simulation 期刊论文
COMPUTER PHYSICS COMMUNICATIONS, 2018, 卷号: 222, 期号: 00, 页码: 59
Authors:  Zhang, Chenglong;  Zhao, Mingcan;  Hou, Chaofeng;  Ge, Wei
Adobe PDF(1986Kb)  |  Favorite  |  View/Download:85/0  |  Submit date:2018/01/19
High Performance Computing  Molecular Dynamics Simulation  Neighbor-list-based Algorithm  Searching Efficiency  
Simulation Study on the Reaction-Diffusion Coupling in Simple Pore Structures 期刊论文
LANGMUIR, 2017, 卷号: 33, 期号: 42, 页码: 11804-11816
Authors:  Li, Yanping;  Zhao, Mingcan;  Li, Chengxiang;  Ge, Wei
Adobe PDF(9829Kb)  |  Favorite  |  View/Download:61/0  |  Submit date:2017/12/20
Computer virtual experiment on fluidized beds using a coarse-grained discrete particle method-EMMS-DPM 期刊论文
CHEMICAL ENGINEERING SCIENCE, 2016, 卷号: 155, 期号: NOV, 页码: 314-337
Authors:  Lu, Liqiang;  Xu, Ji;  Ge, Wei;  Gao, Guoxian;  Jiang, Yong;  Zhao, Mingcan;  Liu, Xinhua;  Li, Jinghai
Adobe PDF(8415Kb)  |  Favorite  |  View/Download:113/1  |  Submit date:2016/12/13
Fluidization  Coarse-graining  Discrete Particle Method (Dpm)  Energy-minimization Multi-scale (Emms) Model  Virtual Process Engineering (Vpe)  Real Time Simulation  3d Full-loop Simulation  Residence Time Distribution (Rtd)