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科研机构
西安交通大学 [9]
内容类型
期刊论文 [9]
发表日期
2018 [9]
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发表日期:2018
专题:西安交通大学
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Porosity effects on oxygen ions diffusion in the yttria-stabilized zirconia (YSZ) by molecular dynamics simulation
期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2018, 卷号: 265, 页码: 31-35
作者:
Wang, Xuezhi
;
Huang, Wei
;
Zhu, Chao
;
Chen, Qingying
;
Pilla, Srikanth
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2019/11/19
Molecular dynamic simulations
Yttria-stabilized zirconia
Porosity
Tetragonal structure
Diffusion coefficient
Molecular Dynamic Simulation of Hydrogen Production by Catalytic Gasification of Key Intermediates of Biomass in Supercritical Water
期刊论文
JOURNAL OF ENERGY RESOURCES TECHNOLOGY-TRANSACTIONS OF THE ASME, 2018, 卷号: 140
作者:
Jin, Hui
;
Chen, Bin
;
Zhao, Xiao
;
Cao, Changqing
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/11/26
supercritical water
DFT
ReaxFF
furfural
anthracene
Dynamic mechanical behaviors of calcium silicate hydrate under shock compression loading using molecular dynamics simulation
期刊论文
JOURNAL OF NON-CRYSTALLINE SOLIDS, 2018, 卷号: 500, 页码: 482-486
作者:
Lin, Weihui
;
Zhang, Chao
;
Fu, Jia
;
Xin, Hao
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/11/26
Calcium silicate hydrate
Dynamic mechanical behaviors
Molecular dynamics
Influence of oxidation on the dynamics in amorphous ethylene-propylene-diene-monomer copolymer: A molecular dynamics simulation
期刊论文
POLYMER DEGRADATION AND STABILITY, 2018, 卷号: 147, 页码: 187-196
作者:
Wang, Weiwang
;
Tanaka, Yasuhiro
;
Takada, Tatsuo
;
Iwata, Shinya
;
Uehara, Hiroaki
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/11/26
Oxidation
EPDM
Relaxation time
Molecular dynamics simulation
Chain dynamic
Molecular dynamics simulation of tensile strain-altered hydrogen behaviour and its effects on local plasticity
期刊论文
MOLECULAR SIMULATION, 2018, 卷号: 44, 页码: 173-178
作者:
Zheng, Yao-Ting
;
He, Min
;
Cheng, Guang-xu
;
Zhang, Zaoxiao
;
Xuan, Fu-Zhen
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/11/26
hydrogen embrittlement
cluster
local plasticity
Molecular dynamic simulation
external strain
Strain Coupling and Dynamic Relaxation in a Molecular Perovskite-Like Multiferroic Metal–Organic Framework
期刊论文
Advanced Functional Materials, 2018, 卷号: 28
作者:
Xin, Lipeng
;
Zhang, Zhiying
;
Carpenter, Michael A.
;
Zhang, Ming
;
Jin, Feng
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2019/11/26
ferroelastic
ferroelectric
magnetoelastic coupling
metal&ndash
organic frameworks
multiferroic
perovskite
strain
Structure, thermal expansion coefficient and phase stability of La-2(Zr0.7Ce0.3)(2)O-7 studied by molecular dynamic simulation and experiment
期刊论文
CHEMICAL PHYSICS LETTERS, 2018, 卷号: 697, 页码: 48-52
作者:
Che, JunWei
;
Liu, XiangYang
;
Wang, XueZhi
;
Liang, GongYing
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/11/26
Thermal barrier coatings
Thermal expansion coefficient
LZ7C3
Structure
Phase stability
Molecular dynamics simulation of self-assembly and viscosity behavior of PAM and CTAC in salt-added solutions
期刊论文
Journal of Molecular Liquids, 2018, 卷号: 268, 页码: 131-139
作者:
Liu, Dongjie
;
Liu, Fei
;
Zhou, Wenjing
;
Chen, Fei
;
Wei, Jinjia
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2019/11/26
Cetyltrimethylammonium chloride
Coarse-grained molecular dynamics
Coarse-grained molecular dynamics simulations
Interconnected network
Molecular dynamics simulations
Non equilibrium molecular dynamic (NEMD)
Nonionic polymers
Radial distribution functions
Nanoindentation and deformation behaviors of silicon covered with amorphous SiO2: a molecular dynamic study
期刊论文
RSC ADVANCES, 2018, 卷号: 8, 页码: 12597-12607
作者:
Chen, Juan
;
Shi, Junqin
;
Wang, Yunpeng
;
Sun, Jiapeng
;
Han, Jing
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/11/26
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