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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
Authors:
Liu, J.
;
Du, X.
;
Li, J.
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Submit date:2021/03/15
Site occupancy
Ab initio calculations
Ni-based single crystal superalloys
Electronic structure
Enhanced magnetic properties and thermal stability of highly ordered epsilon-Fe3N1+x (-0.12 <= x <=-0.01) nanoparticles
期刊论文
NANOSCALE, 2020, 卷号: 12, 期号: 19, 页码: 10834-10841
Authors:
Li, Yong
;
Pan, Desheng
;
Zhou, Yangtao
;
Kuang, Qifeng
;
Wang, Chinwei
;
Li, Bing
;
Zhang, Bingsen
;
Park, Jihoon
;
Li, Da
;
Choi, Chuljin
;
Zhang, Zhidong
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Submit date:2021/02/03
Potassium-Induced Phase Stability Enables Stable and Efficient Wide-Bandgap Perovskite Solar Cells
期刊论文
SOLAR RRL, 2020, 卷号: 4, 期号: 7, 页码: 10
Authors:
Wang, Lipeng
;
Wang, Gaoxiang
;
Yan, Zheng
;
Qiu, Jianhang
;
Jia, Chunxu
;
Zhang, Weimin
;
Zhen, Chao
;
Xu, Chuan
;
Tai, Kaiping
;
Jiang, Xin
;
Yang, Shihe
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View/Download:110/0
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Submit date:2021/02/02
defect passivation
phase segregation
potassium incorporation
wide-bandgap perovskite solar cells
Potassium-Induced Phase Stability Enables Stable and Efficient Wide-Bandgap Perovskite Solar Cells
期刊论文
SOLAR RRL, 2020, 页码: 10
Authors:
Wang, Lipeng
;
Wang, Gaoxiang
;
Yan, Zheng
;
Qiu, Jianhang
;
Jia, Chunxu
;
Zhang, Weimin
;
Zhen, Chao
;
Xu, Chuan
;
Tai, Kaiping
;
Jiang, Xin
;
Yang, Shihe
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View/Download:64/0
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Submit date:2021/02/02
defect passivation
phase segregation
potassium incorporation
wide-bandgap perovskite solar cells
On the abnormal fast diffusion of solute atoms in alpha-Ti: A first-principles investigation
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2018, 卷号: 740, 页码: 156-166
Authors:
Zhang, LJ
;
Chen, ZY
;
Hu, QM
;
Yang, R
;
Hu, QM (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, 72 Wenhua Rd, Shenyang 110016, Liaoning, Peoples R China.
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View/Download:107/0
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Submit date:2018/06/05
Grain-boundary Segregation
Austenitic Stainless-steel
Total-energy Calculations
Augmented-wave Method
Elastic Band Method
Alloying Elements
Self-diffusion
Impurity Diffusion
1st Principles
Saddle-points
Structure of Bergman-type W-TiZrNi approximants to quasicrystal, analyzed by lattice inversion method
期刊论文
Journal of Physics-Condensed Matter, 2014, 卷号: 26, 期号: 31
Authors:
H. Huang
;
D. Q. Meng
;
X. C. Lai
;
T. W. Liu
;
Y. Long
;
Q. M. Hu
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View/Download:116/0
  |  
Submit date:2015/01/14
W-tizrni Approximant
Lattice Inversion
Site Preference
Phase
Stability
Ti-zr-ni
Molecular-dynamics Simulation
Interatomic Potentials
Atomistic Simulation
Site Preference
Transition
Stability
Hydrogen
Program
Storage
Synthesis and Crystal Structure of (R)-1-acetyl-6-(2-chloro-4-fluorophenyl)-4-methyl-N-((R)-1-phenylethyl)-2-(2,4,6-trifluorophenyl)-1,6-dihydropyrimidine-5-carboxamide
期刊论文
CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2013, 卷号: 32, 期号: 7, 页码: 989-992
Authors:
Yang XiuYan
;
Zhao GuoMing
;
Yang ShiYing
;
Li Song
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View/Download:38/0
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Submit date:2021/02/02
INHIBITION
HAPs
crystal structure
synthesis
Strengthening of gamma-TiAl-Nb by short-range ordering of point defects
期刊论文
Intermetallics, 2011, 卷号: 19, 期号: 6, 页码: 793-796
Authors:
Y. J. Li
;
Q. M. Hu
;
D. S. Xu
;
R. Yang
Adobe PDF(297Kb)
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View/Download:66/0
  |  
Submit date:2012/04/13
Titanium Aluminide
Point Defect Complex
First-principles Calculation
Solid-solution Strengthening
Titanium Aluminides
Solid-solutions
Alloys
Al
The formation of stacking fault tetrahedra in Al and Cu II. SFT growth by successive absorption of vacancies generated by dipole annihilation (vol 59, pg 10, 2011)
期刊论文
Acta Materialia, 2011, 卷号: 59, 期号: 6, 页码: 2563-2563
Authors:
H. Wang
;
D. S. Xu
;
R. Yang
;
P. Veyssiere
Adobe PDF(1938Kb)
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View/Download:53/0
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Submit date:2012/04/13
Understanding corrosion inhibition mechanisms-experimental and theoretical approach
期刊论文
Rsc Advances, 2011, 卷号: 1, 期号: 5, 页码: 866-873
Authors:
E. E. Oguzie
;
Y. Li
;
S. G. Wang
;
F. H. Wang
Adobe PDF(859Kb)
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View/Download:55/0
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Submit date:2012/04/13
Universal Force-field
Mild-steel Corrosion
Molecular-structure
Organic-compounds
Sulfuric-acid
Carbon-steel
Simulation
Copper
Iron
Dft