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The Effect of Impact Load on the Atomistic Scale Fracture Behavior of Nanocrystalline bcc Iron 期刊论文
NANOMATERIALS, 2024, 卷号: 14, 期号: 4, 页码: 11
作者:  Zhao ZF(赵志福);  Wang, Zhen;  Bie, Yehui;  Liu XM(刘小明);  Wei, Yueguang
收藏  |  浏览/下载：8/0  |  提交时间：2024/04/02
molecular dynamics simulation  nanocrystalline iron  impact load  fracture resistance  fracture ductility  
Molecular Simulation of Nitrogen Adsorption in Multidimensional Nanopores and New Insights into the Inversion of Pore Size Distribution for Gas Shale 期刊论文
ENERGIES, 2023, 卷号: 16, 期号: 24, 页码: 20
作者:  Chen Z(陈卓);  Lin M(林缅);  Jiang WB(江文滨);  Cao GH(曹高辉)
Adobe PDF(6169Kb)  |  收藏  |  浏览/下载：51/2  |  提交时间：2024/02/05
shale  pore size distribution  molecular simulation  low-temperature nitrogen adsorption  
Atomistic insights into the influence of hydrogen on crack propagation in tungsten 期刊论文
FUSION ENGINEERING AND DESIGN, 2023, 卷号: 197, 页码: 11
作者:  Shi, Jun;  Li, Bingchen;  Li, Lei;  Liu, Yifan;  Fan, Xinyue;  Peng Q(彭庆);  Liang, Linyun;  Jin, Shuo;  Lu, Guanghong
Adobe PDF(27292Kb)  |  收藏  |  浏览/下载：101/1  |  提交时间：2023/12/11
Molecular dynamics simulation  Hydrogen  Crack propagation  Plasma-facing materials  Tungsten  
Assessment of the Interatomic Potentials of Beryllium for Mechanical Properties 期刊论文
CRYSTALS, 2023, 卷号: 13, 期号: 9, 页码: 19
作者:  Yang, Chengzhi;  Wu, Bin;  Deng, Wenmin;  Li, Shuzhen;  Jin, Jianfeng;  Peng Q(彭庆)
Adobe PDF(9145Kb)  |  收藏  |  浏览/下载：64/1  |  提交时间：2023/10/30
beryllium  molecular dynamics simulation  MEAM  Finnis-Sinclair and Tersoff potentials  
Excellent impact resistance of multilayer metallic glass films subjected to micro-ballistic impact by overcoming dynamic size effects 期刊论文
EXTREME MECHANICS LETTERS, 2023, 卷号: 63, 页码: 8
作者:  Cheng YJ(程玉洁);  董金磊Dong, Jinlei;  Shen, Yidi;  Li, Fucheng;  An, Qi;  Jiang MQ(蒋敏强);  Liu, Yanhui;  Huang CG(黄晨光);  Goddard, William A.;  Wu XQ(吴先前)
Adobe PDF(2053Kb)  |  收藏  |  浏览/下载：87/1  |  提交时间：2023/10/30
Multilayered metallic glass  Impact resistance  Size effect  Micro-ballistic impact  Molecular dynamics simulation  
Diffusion coefficient and the volume swelling of CO2/light oil systems: Insights from dynamic volume analysis and molecular dynamics simulation 期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2023, 卷号: 382, 页码: 121943
作者:  Luo, Yongcheng;  Xiao, Hanmin;  Liu, Xiangui;  Zheng TY(郑太毅);  Wu, Zhenkai
Adobe PDF(8257Kb)  |  收藏  |  浏览/下载：38/0  |  提交时间：2023/07/17
CO2-light oil system  Diffusion coefficient  Swelling factor  Molecular dynamics simulation  
Enhancing the Mechanical Stability of 2D Fullerene with a Graphene Substrate and Encapsulation 期刊论文
NANOMATERIALS, 2023, 卷号: 13, 期号: 13, 页码: 1936
作者:  Yu, Taotao;  Li, Jianyu;  Han, Mingjun;  Zhang, Yinghe;  Li, Haipeng;  Peng Q(彭庆);  Tang, HoKin
Adobe PDF(9854Kb)  |  收藏  |  浏览/下载：17/0  |  提交时间：2023/09/05
monolayer fullerene  fracture behavior  molecular dynamics simulation  tensile property  pre-crack system  graphene substrate  
Atomic-level analysis of migration and transformation of organic sodium in high-alkali coal pyrolysis using reactive molecular dynamics simulations 期刊论文
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING, 2023, 卷号: 11, 期号: 3, 页码: 110189
作者:  Sun C(孙岑);  Zhu, Aixue;  Xu, Tong;  Wei XL(魏小林);  Hong, Dikun;  Si, Tong
Adobe PDF(8251Kb)  |  收藏  |  浏览/下载：37/0  |  提交时间：2023/09/05
Inherent organic sodium  ReaxFF  Pyrolysis  Molecular simulation  Py-GC/MS  
Effects of oxidizers on the ignition and combustion characteristics of aluminum nanoparticles 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2023, 卷号: 223, 页码: 112116
作者:  Zhou, Yintao;  Shi, Baolu;  Chu, Qingzhao;  Liao LJ(廖丽涓)
Adobe PDF(8464Kb)  |  收藏  |  浏览/下载：72/1  |  提交时间：2023/04/20
Aluminum nanoparticles  Oxidizer atmospheres  Ignition and combustion  Energy release  Reactive molecular dynamic simulation  
Flow and slip process of Santotrac 50-based lubricant under high shear by molecular dynamic simulation 期刊论文
LUBRICATION SCIENCE, 2023, 卷号: 35, 期号: 3, 页码: 163-170
作者:  Zhao X(赵欣);  Wei, Chao;  Yin, Zhenxin;  Ma, Wenjie
Adobe PDF(1549Kb)  |  收藏  |  浏览/下载：172/36  |  提交时间：2022/11/14
carbon-chain lubricant  high shear rate  molecular dynamics simulation  slip