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金属研究所 [3]
宁波材料技术与工程研... [2]
合肥物质科学研究院 [2]
上海应用物理研究所 [1]
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期刊论文 [9]
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2020 [9]
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Chemistry [1]
Materials ... [1]
Physics [1]
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Interaction of irradiation-induced point defects with transmutants (H, He, Li, Be, B, Mg, Al and P) in 3C-SiC ceramics
期刊论文
JOURNAL OF THE EUROPEAN CERAMIC SOCIETY, 2020, 卷号: 40
作者:
Sun, Jingjing
;
You, Yu-Wei
;
Xu, Yichun
;
Wu, Xuebang
;
Li, B. S.
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2020/10/26
Cubic silicon carbide
Point defect
Structural materials
Transmutants
Ab initio calculations
AN AB INITIO INVESTIGATION OF THE EFFECT OF Co, Ru, W, Ta ON THE STABILITY AND ELECTRONIC PROPERTIES OF Ni-BASE SINGLE CRYSTAL SUPERALLOYS
期刊论文
DIGEST JOURNAL OF NANOMATERIALS AND BIOSTRUCTURES, 2020, 卷号: 15, 期号: 4, 页码: 1215-1226
作者:
Liu, J.
;
Du, X.
;
Li, J.
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2021/03/15
Site occupancy
Ab initio calculations
Ni-based single crystal superalloys
Electronic structure
A combined experiment and first-principles study on lattice dynamics of thermoelectric CuInTe2
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2020, 卷号: 822
作者:
Yu, Hao
;
Huang, Ge
;
Peng, Qing
;
Chen, Liu-Cheng
;
Pang, Hong-Jie
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  |  
浏览/下载:22/0
  |  
提交时间:2020/11/26
Chalcopyrite compounds
X-ray diffraction
Raman spectra
Ab initio calculations
Large influence of vacancies on the elastic constants of cubic epitaxial tantalum nitride layers grown by reactive magnetron sputtering
期刊论文
ACTA MATERIALIA, 2020, 卷号: 184, 页码: 254-266
作者:
Abadias, Gregory
;
Li, Chen-Hui
;
Belliard, Laurent
;
Hu, Qing Miao
;
Greneche, Nicolas
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  |  
浏览/下载:77/0
  |  
提交时间:2021/02/02
Nitrides
Thin films
Elastic constants
Point defects
Ab initio calculations
Large influence of vacancies on the elastic constants of cubic epitaxial tantalum nitride layers grown by reactive magnetron sputtering
期刊论文
ACTA MATERIALIA, 2020, 卷号: 184, 页码: 254-266
作者:
Abadias, Gregory
;
Li, Chen-Hui
;
Belliard, Laurent
;
Hu, Qing Miao
;
Greneche, Nicolas
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2021/02/02
Nitrides
Thin films
Elastic constants
Point defects
Ab initio calculations
Polarity-induced electronic and atomic reconstruction at NdNiO2/SrTiO3 interfaces
期刊论文
PHYSICAL REVIEW B, 2020, 卷号: 102, 期号: 3
作者:
He, Ri
;
Jiang, Peiheng
;
Lu, Yi
;
Song, Yidao
;
Chen, Mingxing
收藏
  |  
浏览/下载:33/0
  |  
提交时间:2020/12/16
TOTAL-ENERGY CALCULATIONS
AB-INITIO CALCULATIONS
Unprecedented differences in the diamond nucleation density between carbon- and silicon-faces of 4H-silicon carbides
期刊论文
CHINESE CHEMICAL LETTERS, 2020, 卷号: 31, 期号: 7, 页码: 2013-2018
作者:
Wang, Bo
;
Sukkaew, Pitsiri
;
Song, Guichen
;
Rosenkranz, Andreas
;
Lu, Yunxiang
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  |  
浏览/下载:115/0
  |  
提交时间:2020/12/16
MOLECULAR CALCULATIONS
GROWTH-MECHANISM
AB-INITIO
NANOCRYSTALLINE
THERMOCHEMISTRY
ADSORPTION
HYDROGEN
ATOMS
How to produce isotope anomalies in mantle by using extremely small isotope fractionations: A process-driven amplification effect?
期刊论文
Geochimica et Cosmochimica Acta, 2020, 卷号: 291, 页码: 19-49
作者:
Yining Zhang;Yun Liu
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  |  
浏览/下载:20/0
  |  
提交时间:2021/03/01
Isotope Anomalies
Amplification Effect
Multi-stage Melting And Crystallization
Monte Carlo Simulation
Ab-initio Calculations
Nfse
Mass-independent Isotope Fractionations
Combined experimental and first-principles studies of structural and physical properties of beta-Ti3SiC2
期刊论文
JOURNAL OF APPLIED PHYSICS, 2020, 卷号: 128, 期号: 22, 页码: -
作者:
Zhang, LQ
;
Sun, JR
;
Gao, X
;
Deng, TY
;
Cheng, ZY
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  |  
浏览/下载:19/0
  |  
提交时间:2021/09/06
TOTAL-ENERGY CALCULATIONS
AB-INITIO
MAX-PHASES
ELASTIC PROPERTIES
IRRADIATION RESISTANCE
MECHANICAL-PROPERTIES
M(N+1)AX(N) PHASES
TERNARY CARBIDES
TI3SIC2
STABILITY
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