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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：286/75  |  提交时间：2019/05/29
Ice  Phase transformation  Dynamic behaviour  Molecular dynamics  
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：396/128  |  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：531/219  |  提交时间：2017/07/24
Graphene  Shale  Adsorption Isotherms  Adsorption Heat  Simulations  
Ploughing friction and nanohardness dependent on the tip tilt in nano-scratch test for single crystal gold 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 110, 页码: 54-61
作者:  Liu XM(刘小明);  Liu ZL;  Wei YG(魏悦广);  Liu, XM (reprint author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(4321Kb)  |  收藏  |  浏览/下载：375/161  |  提交时间：2016/01/08
Nano-friction  Tilt Effect  Pile-up  Local Plasticity  
Transition of mechanisms underlying the rate effects and its significance 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 98, 页码: 70-75
作者:  Xiao P(肖攀);  Wang J(王军);  Yang R(杨荣);  Ke FJ(柯孚久);  Bai YL(白以龙);  Xiao, P (reprint author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(1741Kb)  |  收藏  |  浏览/下载：284/90  |  提交时间：2015/03/17
Strain Rate Effect  Molecular Dynamics  Thermal Activation Model  Potential Landscapes  
Stress effects on stability and diffusion behavior of sulfur impurity in nickel: A first-principles study 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2014, 卷号: 90, 期号: 04, 页码: 137-142
作者:  Dong N;  Zhang CL;  Liu H;  Li J;  Wu XL(武晓雷);  Han PD;  Han, PD (reprint author), Taiyuan Univ Technol, Coll Mat Sci & Engn, 79 Yingze St, Taiyuan 030024, Peoples R China.
浏览  |  Adobe PDF(1505Kb)  |  收藏  |  浏览/下载：786/156  |  提交时间：2014/07/03
Nickel  Sulfur  First-principles  Diffusion  Stress Effect  
Size-dependent surface energy density of typically fcc metallic nanomaterials 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2014, 卷号: 82, 页码: 372-377
作者:  Zhang C(张存);  Yao Y(姚寅);  Chen SH(陈少华);  Chen, SH (reprint author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China.
Adobe PDF(1857Kb)  |  收藏  |  浏览/下载：832/339  |  提交时间：2014/02/13
Nanomaterials  Surface Energy Density  Surface Relaxation Parameter  Lagrangian Configuration  Eulerian Configuration  
Application of the complex network method in solid-state sintering 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2013, 卷号: 69, 页码: 14-21
作者:  Wang C(王超);  Chen SH(陈少华);  Chen, SH (reprint author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China.
Adobe PDF(5440Kb)  |  收藏  |  浏览/下载：735/228  |  提交时间：2013/03/25
Solid-state Sintering  Complex Network  Discrete Element Method  Force Chain  Microstructure Evolution  
Negative differential resistance behavior of silicon monatomic chain encapsulated in carbon nanotubes 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2012, 卷号: 62, 页码: 87-92
作者:  Zhang YY(张营营);  Wang FC(王奉超);  Zhao YP(赵亚溥);  Zhao, YP;  Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
Adobe PDF(1095Kb)  |  收藏  |  浏览/下载：959/289  |  提交时间：2013/01/18
Silicon Monatomic Chain  Size-selective Encapsulation  Electronic Transport Properties  Negative Differential Resistance  Transmission Spectrum  Field-effect Transistors  Single  Nanowires  Simulations  
The roles of crosslinks in the buckling behaviors and load transferring mechanisms of double-walled nanotubes under compression 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2012, 卷号: 55, 页码: 95-99
作者:  Peng B;  Li Y;  Liu S(刘珅);  Guo ZY;  Ding L;  Peng, B;  Univ Elect Sci & Technol China, Dept Mech Engn, Chengdu 611731, Peoples R China.
Adobe PDF(873Kb)  |  收藏  |  浏览/下载：715/235  |  提交时间：2013/01/18
Carbon Nanotube  Molecular Dynamics  Crosslink  Buckling Behavior  Load Transfer  Carbon Nanotubes  Molecular-dynamics  Strength  Bundles  Composites  Simulation  Defects  Tensile