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Aggregation of nanoparticles and their effect on mechanical properties of carbon nanotube networks 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2022, 卷号: 202, 页码: 8
Authors:  Wu, Yue;  Wang C(王超);  Yang T(杨田)
Favorite  |  View/Download:79/0  |  Submit date:2022/01/12
Carbon nanotube networks  Nanoparticles  Microstructure  Mechanical properties  Coarse-grained molecular dynamics  
SPONGE: A GPU-Accelerated Molecular Dynamics Package with Enhanced Sampling and AI-Driven Algorithms 期刊论文
CHINESE JOURNAL OF CHEMISTRY, 2022, 卷号: 40, 期号: 1, 页码: 160-168
Authors:  Huang YP;  Xia YJ;  Yang LJ;  Wei JC(韦佳辰);  Yang YI;  Gao YQ
Favorite  |  View/Download:27/0  |  Submit date:2022/01/13
Molecular dynamics  Molecular modeling  Enhanced sampling  Machine learning  Computational chemistry  
Molecular Dynamics Simulation of the Soret Effect on Two Binary Liquid Solutions with Equimolar n-Alkane Mixtures 期刊论文
ACS OMEGA, 2021, 页码: 10
Authors:  Zhong, Jun;  Zhao, Renbao;  欧阳文泽;  Xu SH(徐升华)
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Interfacial behavior of phospholipid monolayers revealed by mesoscopic simulation 期刊论文
BIOPHYSICAL JOURNAL, 2021, 卷号: 120, 期号: 21, 页码: 4751-4762
Authors:  Zhu YZ(朱勇铮);  Bai X(白轩);  Hu GQ(胡国庆)
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Mechanical Properties and Deformation Mechanisms of Graphene Foams with Bi-Modal Sheet Thickness by Coarse-Grained Molecular Dynamics Simulations 期刊论文
MATERIALS, 2021, 卷号: 14, 期号: 19, 页码: 14
Authors:  Liu, Shenggui;  Lyu, Mindong;  Wang C(王超)
Favorite  |  View/Download:49/0  |  Submit date:2021/11/29
graphene foam materials  microstructure  bi-modal sheet thickness  stress-strain curve  coarse-grained molecular dynamics  
Strain Hardening in Graphene Foams under Shear 期刊论文
ACS OMEGA, 2021, 卷号: 6, 期号: 35, 页码: 22780-22790
Authors:  Yang T(杨田);  Wang C(王超);  Wu ZB(武作兵)
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Microscopic deformation mechanism and main influencing factors of carbon nanotube coated graphene foams under uniaxial compression 期刊论文
NANOTECHNOLOGY, 2021, 卷号: 32, 期号: 34, 页码: 11
Authors:  Wang, Shuai;  Wang C(王超);  Khan, Muhammad Bilal;  Chen, Shaohua
Favorite  |  View/Download:122/0  |  Submit date:2021/08/03
carbon nanotube-coated graphene foam  uniaxial compression  numerical experiment  mechanical property  microscopic deformation mechanism  
Modelling aggregates of cetyltrimethylammonium bromide on gold surfaces using dissipative particle dynamics simulations 期刊论文
MOLECULAR SIMULATION, 2021, 页码: 10
Authors:  Liu, Yawei;  Wei JC(韦佳辰);  Frenkel, Daan;  Widmer-Cooper, Asaph
Favorite  |  View/Download:25/0  |  Submit date:2021/08/16
Gold nanorod  cetyltrimethylammonium bromide  dissipative particle dynamics  ligand  bilayer  
二维材料冲击动力学行为的多尺度研究 学位论文
博士论文,北京: 中国科学院大学, 2021
Authors:  肖凯璐
Adobe PDF(11197Kb)  |  Favorite  |  View/Download:332/23  |  Submit date:2021/06/07
二维材料  动态力学性能  能量耗散机制  微尺度冲击  多尺度模拟  
水气界面磷脂单层膜的介观模拟及实验研究 学位论文
硕士论文,北京: 中国科学院大学, 2021
Authors:  朱勇铮
Adobe PDF(6086Kb)  |  Favorite  |  View/Download:276/4  |  Submit date:2021/06/02
肺表面活性剂磷脂单层膜,多体耗散粒子动力学,粗粒化分子动力学模拟,约束液滴表面张力测量仪, 表面压力-面积等温线