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大连理工大学 [199]
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期刊论文 [164]
会议论文 [34]
无文献类型 [1]
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2019 [18]
2018 [16]
2017 [18]
2016 [12]
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专题:大连理工大学
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Mechanical properties of bonded few-layered graphene via uniaxial test: A molecular dynamics simulation study
期刊论文
Computational Materials Science, 2020, 卷号: 172
作者:
Shi, Jiao
;
Hu, Chunwei
;
Shen, Jianhu
;
Cai, Kun
;
Wang, Jinbao
收藏
  |  
浏览/下载:44/0
  |  
提交时间:2019/12/02
Chlorine Passivation of Grain Boundary Suppresses Electron-Hole Recombination in CsPbBr3 Perovskite by Nonadiabatic Molecular Dynamics Simulation
期刊论文
ACS Applied Energy Materials, 2019, 卷号: 2, 页码: 3419-3426
作者:
Wang, Y.
;
He, J.
;
Yang, Y.
;
Zhang, Z.
;
Long, R.
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2019/12/02
Molecular dynamic simulation of rapid boiling of nanofluids on different wetting surfaces with depositional nanoparticles
期刊论文
INTERNATIONAL JOURNAL OF MULTIPHASE FLOW, 2019, 卷号: 115, 页码: 9-18
作者:
Yin, Xunyan
;
Hu, Chengzhi
;
Bai, Minli
;
Lv, Jizu
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/02
Rapid boiling
Depositional nanoparticle
Surface wettability
Molecular dynamics
Study on the singular stress field at the interface end of ZChSnSb/FeSn2/steel composites
期刊论文
TRIBOLOGY INTERNATIONAL, 2019, 卷号: 136, 页码: 240-249
作者:
Meng, Fanning
;
Wang, Jianmei
;
Zhang, Xiaotian
;
Hou, Dingbang
;
Li, Zhixiong
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/12/02
Composite materials
Singular stress field
Interface end
Molecular dynamics simulation
Insights into the atomistic behavior in diamond chemical mechanical polishing with center dot OH environment using ReaxFF molecular dynamics simulation
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 166, 页码: 136-142
作者:
Shi, Zhuoying
;
Jin, Zhuji
;
Guo, Xiaoguang
;
Yuan, Song
;
Guo, Jiang
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/12/02
Diamond
Chemical mechanical polishing
Removal mechanism
Molecular dynamics simulation
ReaxFF
Room temperature electrofreezing of water yields a missing dense ice phase in the phase diagram
期刊论文
NATURE COMMUNICATIONS, 2019, 卷号: 10, 页码: 1925
作者:
Zhu, Weiduo
;
Huang, Yingying
;
Zhu, Chongqin
;
Wu, Hong-Hui
;
Wang, Lu
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2019/12/02
ice
water, electric field
high pressure
ice
low temperature
molecular analysis
phase transition
temperature
water yield, Article
binding affinity
calculation
chemical parameters
conformational transition
crystal structure
dissociation
electric field
energy yield
enthalpy
entropy
freezing
hydrogen bond
kinetics
molecular dynamics
nonhuman
phonon
polarization
pressure
pressure volume curve
room temperature
simulation
structure analysis
thermodynamics
Molecular dynamics simulation on the effect of water uptake on hydrogen bond network for OH- conduction in imidazolium-g-PPO membrane
期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2019, 卷号: 44, 页码: 3760-3770
作者:
Huo, Jun
;
Qi, Wenxu
;
Zhu, Hongda
;
Yang, Boyun
;
He, Gaohong
收藏
  |  
浏览/下载:29/0
  |  
提交时间:2019/12/02
Imidazolium-g-PPO membrane
OH- conduction
Hydrogen bonding
Water uptake
Molecular dynamics simulation
A theoretical analysis on self-collapsing of nanotubes
期刊论文
INTERNATIONAL JOURNAL OF SOLIDS AND STRUCTURES, 2019, 卷号: 160, 页码: 51-58
作者:
Meng, Xianhong
;
Zhang, Bowen
;
Li, Hao
;
Li, Fengwei
;
Kang, Zhan
收藏
  |  
浏览/下载:32/0
  |  
提交时间:2019/12/02
Multi-wall carbon nanotubes
Collapse
Theoretical model
Critical diameter
Collapse profile
Molecular dynamics simulation
Coupling effect of twin boundary and void on the mechanical properties of bulk nanotwinned copper: an atomistic simulation
期刊论文
JOURNAL OF PHYSICS D-APPLIED PHYSICS, 2019, 卷号: 52
作者:
Wang, Lei
;
Sun, Jia
;
Li, Qian
;
Li, Zhiming
;
Zheng, Yonggang
收藏
  |  
浏览/下载:108/0
  |  
提交时间:2019/12/02
nanotwinned copper
nanovoid
mechanical property
molecular dynamics simulation
uniaxial tension
Strain-induced transformation between vacancy voids and stacking fault tetrahedra in Cu
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 158, 页码: 359-368
作者:
Xv, Hongbo
;
Zhao, Jie
;
Ye, Fei
;
Tong, Ke
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2019/12/02
Molecular dynamics
Atomistic simulation
Vacancy cluster
Stacking fault tetrahedra
Volumetric strain
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