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Emergent failure transition of pearlitic steel at extremely high strain rates 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2023, 卷号: 219, 页码: 13
作者:  Liang LW(梁伦伟);  Dai SC(戴仕诚);  Chen Y(陈艳);  Wang HY(汪海英);  Wang YJ(王云江);  Dai LH(戴兰宏)
Adobe PDF(20162Kb)  |  收藏  |  浏览/下载：106/0  |  提交时间：2023/03/20
Pearlitic steels  Fracture  Crack  Dislocation nucleation  Molecular dynamics  
Constitutive behavior predictions of mushy zone during solidification by phase field model and coupled Eulerian-Lagrangian method 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2022, 卷号: 201, 页码: 6
作者:  Li, Longfei;  Zhang, Ruijie;  Wu XQ(吴先前);  Gu ZP(谷周澎);  Wang, Changsheng;  Jiang, Haitao
Adobe PDF(8355Kb)  |  收藏  |  浏览/下载：315/70  |  提交时间：2021/11/01
Phase Field Model  Mushy Zone  Constitutive Behavior  Coupled Eulerian-Lagrangian  
Modeling of atomistic scale shear failure of Ag/MgO interface with misfit dislocation network 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 170, 页码: UNSP 109151
作者:  Fu XQ(付雪琼);  Liang LH(梁立红);  Wei YG(魏悦广)
浏览  |  Adobe PDF(3150Kb)  |  收藏  |  浏览/下载：423/81  |  提交时间：2019/12/17
Interface energy  Interface slip  Dislocation network  Atomistic simulation  
Formation and migration of helium pair in bcc Fe from first principle calculations 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 170, 页码: UNSP 109192
作者:  Li LL;  Shi JY;  Peng L;  Jiang W;  Qian GA(钱桂安)
浏览  |  Adobe PDF(1512Kb)  |  收藏  |  浏览/下载：251/92  |  提交时间：2019/12/17
First-principle  Helium pair  Migration  Bcc Fe  
Temperature-dependent phase transformation of ice-1h under ultrafast uniaxial compression: A molecular dynamics simulation 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 162, 页码: 340-348
作者:  Yin QY(殷秋运);  Hu LL;  Wu XQ(吴先前);  Xiao KL(肖凯璐);  Huang CG(黄晨光)
浏览  |  Adobe PDF(5581Kb)  |  收藏  |  浏览/下载：276/72  |  提交时间：2019/05/29
Ice  Phase transformation  Dynamic behaviour  Molecular dynamics  
Atomistic simulation study on the shear behavior of Ag/MgO interface 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 155, 页码: 116-128
作者:  Fu X Q;  Liang LH(梁立红);  Wei YG(魏悦广)
浏览  |  Adobe PDF(4995Kb)  |  收藏  |  浏览/下载：250/94  |  提交时间：2018/12/12
Metal/oxide interface  Interface stress  Interface shear displacement  Misfit dislocation  Atomistic simulation  
Study on failure mechanism of Cu-polyethylene-Cu sandwich structure by molecular dynamics simulation 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 154, 页码: 315-324
作者:  Meng CY(孟昶宇);  Liao LJ(廖丽涓);  Huang CG(黄晨光)
浏览  |  Adobe PDF(3952Kb)  |  收藏  |  浏览/下载：367/134  |  提交时间：2018/10/30
Failure Mechanism  Sandwich Structure  Molecular Dynamics  Thickness-dependence  Micro-void Nucleation  Dihedral Distribution  
The atomistic simulation study of Ag/MgO interface tension fracture 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 142, 页码: 277-284
作者:  You XM(尤雪梅);  Liang LH(梁立红);  Wei YG(魏悦广);  Liang, LH;  Wei, YG
浏览  |  Adobe PDF(1527Kb)  |  收藏  |  浏览/下载：385/124  |  提交时间：2017/12/18
Interface Fracture  Stress  Displacement  Molecular Simulation  
Using graphene to simplify the adsorption of methane on shale in MD simulations 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2017, 卷号: 133, 页码: 99-107
作者:  Lin K;  Yuan QZ(袁泉子);  Zhao YP(赵亚溥);  Zhao, YP (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(2550Kb)  |  收藏  |  浏览/下载：493/214  |  提交时间：2017/07/24
Graphene  Shale  Adsorption Isotherms  Adsorption Heat  Simulations  
Effects of alloying on the behavior of B and S at Sigma 5 (210) grain boundary in gamma-Fe 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2016, 卷号: 115, 页码: 170-176
作者:  Li YP;  Han C;  Zhang CL;  Jia K;  Han PD;  Wu XL(武晓雷);  Li, YP;  Zhang, CL (reprint author), Taiyuan Univ Technol, 79 West Yingze St, Taiyuan 030024, Peoples R China.
浏览  |  Adobe PDF(1941Kb)  |  收藏  |  浏览/下载：418/100  |  提交时间：2016/03/21
Alloying  Impurities Segregation  Gamma-fe  Grain Boundary Cohesion  Dft