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科研机构
兰州理工大学 [26]
内容类型
期刊论文 [26]
发表日期
2017 [26]
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共26条,第1-10条
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发表日期:2017
内容类型:期刊论文
专题:兰州理工大学
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Phase-field modeling and electronic structural analysis of flexoelectric effect at 180 degrees domain walls in ferroelectric PbTiO3
期刊论文
JOURNAL OF APPLIED PHYSICS, 2017, 卷号: 122, 期号: 22
作者:
Wang, Yu-Jia
;
Li, Jiangyu
;
Zhu, Yin-Lian
;
Ma, Xiu-Liang
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  |  
浏览/下载:0/0
  |  
提交时间:2019/11/15
Phase-field modeling and electronic structural analysis of flexoelectric effect at 180° domain walls in ferroelectric PbTiO3
期刊论文
Journal of Applied Physics, 2017, 卷号: 122, 期号: 22
作者:
Wang, Yu-Jia
;
Li, Jiangyu
;
Zhu, Yin-Lian
;
Ma, Xiu-Liang
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2020/11/14
Calculations
Electric fields
Ferroelectric materials
Ferroelectricity
Lead titanate
Polarization
Structural analysis
Titanium compounds
Electronic charge density
Electronic mechanisms
First-principles calculation
Flexoelectric effects
Nano scale
Phase field models
Phase-field simulation
Spontaneous polarizations
Li-decorated β12-borophene as potential candidates for hydrogen storage: A first-principle study
期刊论文
Materials, 2017, 卷号: 10, 期号: 12
作者:
Liu, Tingting
;
Chen, Yuhong
;
Wang, Haifeng
;
Zhang, Meiling
;
Yuan, Lihua
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2020/11/14
Calculations
Density functional theory
Electronic structure
Molecules
Adsorption energies
Adsorption site
First-principle study
First-principles calculation
Hydrogen storage capacities
Hydrogen storage properties
Numerical calculation
Storage performance
A first-principles study of gas molecule adsorption on borophene
期刊论文
AIP ADVANCES, 2017, 卷号: 7, 期号: 12
作者:
Liu, Tingting
;
Chen, Yuhong
;
Zhang, Meiling
;
Yuan, Lihua
;
Zhang, Cairong
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2019/11/15
Adsorption
Ammonia
Calculations
Chemisorption
Electronic properties
Gases
Molecules
Nitrogen oxides
Adsorption energies
Anisotropic structure
Electrical conductivity
Electron acceptor
First-principles study
Gas molecule adsorption
Research interests
Two-dimensional materials
Li-Decorated (12)-Borophene as Potential Candidates for Hydrogen Storage: A First-Principle Study
期刊论文
MATERIALS, 2017, 卷号: 10, 期号: 12
作者:
Liu, Tingting
;
Chen, Yuhong
;
Wang, Haifeng
;
Zhang, Meiling
;
Yuan, Lihua
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2019/11/15
(12)-borophene
Li-decorated
hydrogen storage
first-principles calculations
Electronic and optical properties of the wurtzite-ZnO/CH3NH3PbI3 interface: first-principles calculations
期刊论文
Journal of Materials Science, 2017, 卷号: 52, 期号: 24, 页码: 13841-13851
作者:
Si, Fengjuan
;
Hu, Wei
;
Tang, Fuling
;
Cheng, Yuwen
;
Xue, Hongtao
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  |  
浏览/下载:32/0
  |  
提交时间:2022/02/17
Binding energy
Calculations
Charge transfer
Electronic properties
II-VI semiconductors
Lattice mismatch
Optical properties
Oxide minerals
Semiconductor quantum wells
Zinc oxide
Zinc sulfide
Atomic charge
Charge density difference
Electronic and optical properties
First-principles calculation
Optical and electronic properties
Orbitals
Wurtzite zno
Electronic and optical properties of the wurtzite-ZnO/CH3NH3PbI3 interface: first-principles calculations
期刊论文
JOURNAL OF MATERIALS SCIENCE, 2017, 卷号: 52, 期号: 24, 页码: 13841-13851
作者:
Si, Fengjuan
;
Hu, Wei
;
Tang, Fuling
;
Cheng, Yuwen
;
Xue, Hongtao
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2019/11/15
Theoretical investigation on the high-pressure physical properties of ZnN in cubic zinc blende, rock salt, and cesium chloride structures
期刊论文
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 2017, 卷号: 110, 页码: 70-75
作者:
Tian, J. H.
;
Song, T.
;
Sun, X. W.
;
Wang, T.
;
Jiang, G.
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/11/15
ZnN
Phase transition
Thermodynamic property
High pressure
Effect of structural phase transformations under pressure on electronic and optical properties of CuInS2
期刊论文
Current Applied Physics, 2017, 卷号: 17, 期号: 11, 页码: 1564-1569
作者:
Gao, Bo
;
Xue, Hong-Tao
;
Tang, Fu-Ling
;
Cheng, Yu-Wen
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2022/02/17
Calculations
Copper compounds
Electronic properties
Energy gap
Free energy
Gibbs free energy
Growth rate
High pressure engineering
Indium compounds
Light absorption
Optical materials
Phase transitions
Structural properties
CuInS2
Electronic and optical properties
Experimental values
First-principles calculation
Plane wave calculations
Semiconductor compounds
Structural phase transformations
Structural phase transition
Effect of structural phase transformations under pressure on electronic and optical properties of CuInS2
期刊论文
CURRENT APPLIED PHYSICS, 2017, 卷号: 17, 期号: 11, 页码: 1564-1569
作者:
Gao, Bo
;
Xue, Hong-Tao
;
Tang, Fu-Ling
;
Cheng, Yu-Wen
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2019/11/15
CuInS2
First-principles calculation
Pressure-induced structural phase transition
Electronic properties
Optical absorption spectra
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