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期刊论文 [122]
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2019 [124]
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Construction of layered h-BN/TiO2 hetero-structure and probing of the synergetic photocatalytic effect
期刊论文
SCIENCE CHINA-MATERIALS, 2019
作者:
Li, Qun
;
Hou, Xinmei
;
Fang, Zhi
;
Yang, Tao
;
Chen, Junhong
收藏
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浏览/下载:253/0
  |  
提交时间:2019/12/31
layered nanostructure
h-BN flake
TiO2 nanoflake
photocatalytic activity
dye degradation
Effects of vacancy on the electronic and optical properties of beta-Si3N4 by first-principles
期刊论文
MODERN PHYSICS LETTERS B, 2019, 卷号: 33, 期号: 36
作者:
Lu, Xuefeng
;
Luo, Jianhua
;
Yang, Panfeng
;
Ren, Junqiang
;
Guo, Xin
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2020/06/02
beta-Si3N4
first principles
vacancy
electronic structure
optical properties
Formation and migration of helium pair in bcc Fe from first principle calculations
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 170, 页码: UNSP 109192
作者:
Li LL
;
Shi JY
;
Peng L
;
Jiang W
;
Qian GA(钱桂安)
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浏览/下载:66/0
  |  
提交时间:2019/12/17
First-principle
Helium pair
Migration
Bcc Fe
First-principles calculation of stability, electronic and optical properties of PCBM-adsorbed MAPbI3 surface
期刊论文
Materials Research Express, 2019, 卷号: 6, 期号: 11
作者:
Tian, Ying
;
Xue, Hongtao
;
Tang, Fuling
;
Wang, Lifu
;
Jiang, Haiyan
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  |  
浏览/下载:0/0
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提交时间:2020/11/14
Adsorption
Charge transfer
Electron transport properties
Electronic properties
Hall mobility
Hole mobility
Light absorption
Optical properties
Perovskite
Perovskite solar cells
Solar power generation
Stability
Charge density difference
Electron transport layers
Electronic and optical properties
Electronic characteristics
First-principles calculation
MAPbI3
Optical absorption properties
PCBM
Tailoring the local lattice distortion of Nd3+ by codoping of Y3+ through first principles calculation for tuning the spectroscopic properties
期刊论文
OPTICAL MATERIALS EXPRESS, 2019, 卷号: 9, 期号: 11, 页码: 4256
作者:
Ma, Fengkai
;
Jiang, Dapeng
;
Zhang, Zhen
;
Tian, Xueqi
;
Wu, Qinghui
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  |  
浏览/下载:94/0
  |  
提交时间:2019/12/26
The Nucleation and the Intrinsic Microstructure Evolution of Martensite from {332}< 113 >(beta) Twin Boundary in beta Titanium: First-Principles Calculations
期刊论文
METALS, 2019, 卷号: 9, 期号: 11, 页码: 12
作者:
Chen, Qiu-Jie
;
Ma, Shang-Yi
;
Wang, Shao-Qing
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  |  
浏览/下载:15/0
  |  
提交时间:2021/02/02
martensite phase transformation
phase transformation kinetics
titanium
first-principle calculation
twin boundary
Density functional theory capture of electronic structures and optical properties of vacancy doped 3C-SiC systems
期刊论文
MATERIALS RESEARCH EXPRESS, 2019, 卷号: 6, 期号: 11
作者:
Lu, Xuefeng
;
Yang, Panfeng
;
Luo, Jianhua
;
Guo, Xin
;
Ren, Junqiang
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2020/06/02
3C-SiC
electronic structures
optical properties
vacancy doping
first-principles simulations
First-principles calculation of stability, electronic and optical properties of PCBM-adsorbed MAPbI(3) surface
期刊论文
MATERIALS RESEARCH EXPRESS, 2019, 卷号: 6, 期号: 11
作者:
Tian, Ying
;
Xue, Hongtao
;
Tang, Fuling
;
Wang, Lifu
;
Jiang, Haiyan
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2020/06/02
first-principles calculation
MAPbI(3)
PCBM
electronic properties
optical absorption
The structure properties, defect stability and excess properties in Am-doped LnPO(4) (Ln = La, Ce, Nd, Sm, Eu, Gd) monazites
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 806, 页码: 113-119
作者:
Teng, Yuancheng
;
Yang, Xiaoyong
;
Wu, Lang
;
Wang, Lili
;
Zhang, Tongmin
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  |  
浏览/下载:75/0
  |  
提交时间:2019/11/10
Monazite
Am
First principles calculations
Defect stability
Excess property
Synthesis, crystal structures and optical properties of noncentrosymmetric oxysulfides AeGeS(2)O (Ae = Sr, Ba)
期刊论文
DALTON TRANSACTIONS, 2019, 卷号: 48, 期号: 39, 页码: 14662
作者:
Zhang, Xian
;
Xiao, Yi
;
Wang, Ruico
;
Fu, Pengxiang
;
Zheng, Chong
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  |  
浏览/下载:67/0
  |  
提交时间:2019/12/26
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