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An emb e dde d-atom method potential for studying the properties of Fe-Pb solid-liquid interface
期刊论文
JOURNAL OF NUCLEAR MATERIALS, 2022, 卷号: 572
作者:
Lei, Yawei
;
Zhang, Jingdan
;
Zhang, Yange
;
Li, Xiangyan
;
Xu, Yichun
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2022/12/23
Fe-Pb system
Force -matching method
EAM potential
Corrosion
Liquid properties
Synergistic defect engineering for improving n-type NbFeSb thermoelectric performance through high-throughput computations
期刊论文
JOURNAL OF MATERIALS CHEMISTRY A, 2022, 卷号: 10
作者:
Li, Jingyu
;
Zhu, Jianbo
;
Ti, Zhuoyang
;
Zhai, Wenya
;
Wei, Liuming
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  |  
浏览/下载:14/0
  |  
提交时间:2022/12/23
Strain effects on the behavior of intrinsic point defects within the GaN/AlN interface
期刊论文
INTERNATIONAL JOURNAL OF MODERN PHYSICS C, 2022
作者:
Yang, Yuming
;
Zhang, Xuemei
;
Liu, Jun
;
Zhang, Chuanguo
;
Li, Yonggang
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  |  
浏览/下载:11/0
  |  
提交时间:2022/12/23
GaN
AlN interface
strain effects
intrinsic point defects
first-principles calculations
diffusion barrier
Distinct point defect behaviours in body-centered cubic medium-entropy alloy NbZrTi induced by severe lattice distortion
期刊论文
ACTA MATERIALIA, 2022, 卷号: 229, 页码: 14
作者:
Shi, Tan
;
Su, Zhengxiong
;
Li, Jing
;
Liu, Chenguang
;
Yang, Jinxue
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  |  
浏览/下载:24/0
  |  
提交时间:2022/07/18
Medium-entropy alloys
Point defect properties
First-principles calculations
Ion irradiation
Radiation resistance
Prediction of vacancy formation energies at tungsten grain boundaries from local structure via machine learning method
期刊论文
JOURNAL OF NUCLEAR MATERIALS, 2022, 卷号: 559
作者:
Wang, Yuxuan
;
Li, Xiaolin
;
Li, Xiangyan
;
Zhang, Yuxiang
;
Zhang, Yange
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  |  
浏览/下载:12/0
  |  
提交时间:2022/12/23
Vacancy formation energy
Machine learning
Tungsten
Symmetry tilt grain boundary
Support vector machine
Cross validation
Forster and nanometal surface-energy transfer in CsPbCl3/Yb3+ quantum-cutting multilayer structures
期刊论文
Physical Chemistry Chemical Physics, 2022, 卷号: 24, 期号: 48, 页码: 29902-29908
作者:
C. X. Liu
;
J. S. Zhang
;
Y. Y. Chen
;
L. J. Wang
;
Y. Song and L. J. Wang
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  |  
浏览/下载:3/0
  |  
提交时间:2023/06/14
In situ transmission electron microscopy study and molecular dynamics simulation of dislocation loop evolution in FeCrAl alloys under Fe+ irradiation
期刊论文
MATERIALS TODAY ENERGY, 2021, 卷号: 21, 页码: 12
作者:
Li, Y. P.
;
Yu, M. S.
;
Ran, G.
;
Gao, N.
;
Chen, Y.
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  |  
浏览/下载:14/0
  |  
提交时间:2021/12/08
In situ TEM observation
Loop reaction
Molecular dynamics simulation
Fuel cladding
Irradiation damage
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
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  |  
浏览/下载:22/0
  |  
提交时间:2021/10/14
beta-Si3N4
electrical property
vacancy
interstitial defect
First principles investigation of intrinsic and Na defects in XTe (X=Ca, Sr, Ba) nanostructured PbTe
期刊论文
MATERIALS TODAY PHYSICS, 2021, 卷号: 19
作者:
Zhang, Xuemei
;
Toriyama, Michael Y.
;
Male, James P.
;
Feng, Zhenzhen
;
Guo, Shuping
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  |  
浏览/下载:26/0
  |  
提交时间:2021/08/30
Thermoelectric
Point defect
Solid solution
Pseudo-interface
PbTe compounds
Melt-spun Sn(1-x-y)SbxMnyTe with unique multiscale microstructures approaching exceptional average thermoelectric zT
期刊论文
NANO ENERGY, 2021, 卷号: 84, 页码: 13
作者:
Yan, Xiangmei
;
Zheng, Sikang
;
Zhou, Zizhen
;
Wu, Hong
;
Zhang, Bin
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  |  
浏览/下载:45/0
  |  
提交时间:2021/06/01
Thermoelectric
SnTe
Melt spinning
Band engineering
Defect engineering
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