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Plane wave study on the localized-extended transition in the one-dimensional incommensurate systems 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 188, 页码: 9
作者:  Chen, Huajie;  Zhou, Aihui;  Zhou, Yuzhi
收藏  |  浏览/下载：156/0  |  提交时间：2021/04/26
Incommensurate systems  Localized-extended transition  Plane waves  
First-principles investigation of monatomic gold wires under tension 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2020, 卷号: 171, 页码: 7
作者:  He, Lianhua;  Liu, Fang;  Li, Ju;  Rignanese, Gian-Marco;  Zhou, Aihui
收藏  |  浏览/下载：145/0  |  提交时间：2020/05/24
First-principles calculations  Gold nanowires  Phonons  Kohn anomalies  Peierls instability  
A local Quantum-Atomistic-Continuum model for mechanical behaviors at micro-nano scale 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 109, 页码: 312-322
作者:  Han, Tiansi;  Cui, Junzhi;  Yu, Xingang;  Yang, Yantao
收藏  |  浏览/下载：191/0  |  提交时间：2018/07/30
Atomistic-to-continuum model  Density functional theory  Quantum strain energy density  Basic deformation element  Constitutive relation  
Molecular dynamics study on diffusion behavior of Li in alpha-Fe 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 107, 页码: 42-47
作者:  Yu Xingang;  Gan Xianglai;  Han Tiansi;  Tian Xia
收藏  |  浏览/下载：132/0  |  提交时间：2018/07/30
Liquid lithium  Bcc iron  Diffusion  Vacancy  Molecular dynamics  
The statistical second-order two-scale method for thermomechanical properties of statistically inhomogeneous materials 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2009, 卷号: 46, 期号: 3, 页码: 654-659
作者:  Han, Fei;  Cui, Junzhi;  Yu, Yan
收藏  |  浏览/下载：139/0  |  提交时间：2018/07/30
Thermomechanical properties  Statistically inhomogeneous materials  Statistical second-order two-scale method  
The statistical second-order two-scale analysis method for heat conduction performances of the composite structure with inconsistent random distribution 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2009, 卷号: 46, 期号: 1, 页码: 151-161
作者:  Yu, Yan;  Cui, Junzhi;  Han, Fei
收藏  |  浏览/下载：125/0  |  提交时间：2018/07/30
The SSOTS method  Composite structure with inconsistent random distribution  Meso-structure  Heat conduction properties  Functional gradient materials  Numerical technique