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兰州理工大学 [26]
金属研究所 [1]
合肥物质科学研究院 [1]
西安光学精密机械研究... [1]
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期刊论文 [29]
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2021 [29]
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Effects of vertical strain and electric field on the electronic properties and interface contact of graphene/InP vdW heterostructure
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 198
作者:
Lu, Xuefeng
;
Li, Lingxia
;
Guo, Xin
;
Ren, Junqiang
;
Xue, Hongtao
收藏
  |  
浏览/下载:5/0
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提交时间:2021/10/14
Graphene
InP
Heterostructure
Vertical strain
Electric field
Schottky barrier
Enhanced electrochemical performance and storage mechanism of LiFePO4 doped by Co, Mn and S elements for lithium-ion batteries
期刊论文
ELECTROCHIMICA ACTA, 2021, 卷号: 388
作者:
Cui, Zhihong
;
Guo, Xin
;
Ren, Junqiang
;
Xue, Hongtao
;
Tang, Fuling
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2021/10/14
LiFePO4
Diffusion rate
Operating voltage
Discharge curve
Electrochemical performance
Electronic and optical properties of the SnO2/CsPbI3 interface: Using first principles calculations
期刊论文
CATALYSIS TODAY, 2021, 卷号: 374, 页码: 208-213
作者:
Hu, Wei
;
Si, Fengjuan
;
Xue, Hongtao
;
Tang, Fuling
;
Li, Wensheng
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2021/10/14
First principles calculations
SnO2 (110) /CsPbI3 interface
Electronic properties
Optical properties
Shear-strain induced structural relaxation of Cu Sigma 3 [110](112) symmetric tilt grain boundary: The role of foreign atoms and temperature
期刊论文
CURRENT APPLIED PHYSICS, 2021, 卷号: 28, 页码: 19-25
作者:
Li, Yang
;
Xue, Hongtao
;
Zhou, Xin
;
Tang, Fuling
;
Li, Xiuyan
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2021/10/14
Grain boundary relaxation
Cu Sigma 3 [110](112) symmetric tilt grain boundary
Shear strain
Grain boundary stability
Molecular dynamics
First-principles study on the adsorption structure and electrical properties of P2S5-adsorbed Li2S(110) surface
期刊论文
Surface Science, 2021, 卷号: 710
作者:
Zhao, Fenning
;
Xue, Hongtao
;
Wei, Chengdong
;
Li, Zhou
;
Tang, Fuling
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2021/06/03
Calculations
Cathodes
Composite structures
Electric conductivity
Electronic properties
Lithium batteries
Lithium sulfur batteries
Molecules
Stability
Adsorption energies
Adsorption structures
Electronic conductivity
First-principles calculation
First-principles study
High electrical conductivity
High performance composites
Structural stabilities
Shear-strain induced structural relaxation of Cu Σ3 [110](112) symmetric tilt grain boundary: The role of foreign atoms and temperature
期刊论文
Current Applied Physics, 2021, 卷号: 28, 页码: 19-25
作者:
Li, Yang
;
Xue, Hongtao
;
Zhou, Xin
;
Tang, Fuling
;
Li, Xiuyan
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2022/02/17
Alloying elements
Atoms
Copper
Molecular dynamics
Nanocrystals
Shear flow
Shear strain
Cu σ3 [110](112) symmetric tilt grain boundary
Foreign atoms
Grain boundaries relaxations
Grain boundary stability
Grain-boundaries
Nanocrystallines
Pure fe
Strain induced
Symmetrics
Tilt grain boundary
Electronic property of intrinsic point defect system on beta-Si3N4 (0001) surface
期刊论文
MODERN PHYSICS LETTERS B, 2021, 卷号: 35, 期号: 21
作者:
Li, Lingxia
;
Lu, Xuefeng
;
Luo, Jianhua
;
Guo, Xin
;
Ren, Junqiang
收藏
  |  
浏览/下载:22/0
  |  
提交时间:2021/10/14
beta-Si3N4
electrical property
vacancy
interstitial defect
Shear deformation mechanical performance of Ni-Co alloy nanoplate by molecular dynamics simulation
期刊论文
MODERN PHYSICS LETTERS B, 2021, 卷号: 35, 期号: 19
作者:
Gao, Qing
;
Lu, Xuefeng
;
Guo, Xin
;
Ren, Junqiang
;
Xue, Hongtao
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2021/10/14
Ni-Co alloy
shear deformation
dislocation
molecular dynamic simulation
Structure-composition-property correlations of symmetrical tilt grain boundaries in copper-based binary alloys
期刊论文
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 2021, 卷号: 154, 页码: 9
作者:
Xue, Hongtao
;
Lei, Chao
;
Tang, Fuling
;
Li, Xiuyan
;
Luo, Yaqiao
收藏
  |  
浏览/下载:53/0
  |  
提交时间:2021/10/15
Alloys
Ab initio calculations
Electronic structure
Thermodynamic properties
Mechanical properties
Structure-composition-property correlations of symmetrical tilt grain boundaries in copper-based binary alloys
期刊论文
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 2021, 卷号: 154
作者:
Xue, Hongtao
;
Lei, Chao
;
Tang, Fuling
;
Li, Xiuyan
;
Luo, Yaqiao
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2021/10/14
Alloys
Ab initio calculations
Electronic structure
Thermodynamic properties
Mechanical properties
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