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西北高原生物研究所 [27]
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期刊论文 [170]
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Hydrogen trapping in vanadium carbide alloyed with transition metals
期刊论文
NUCLEAR MATERIALS AND ENERGY, 2023, 卷号: 36, 页码: 11
作者:
Tang, Shuai
;
Li, Linxian
;
Yan, Haile
;
Jin, Jianfeng
;
Peng, Qing
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2023/11/28
Hydrogen barrier coating
Vanadium carbide
First-principles calculations
Transition-metal alloying
Anisotropic mechanical response of a 2D covalently bound fullerene lattice
期刊论文
CARBON, 2023, 卷号: 202, 页码: 118-124
作者:
Zhao, Shuai
;
Zhang, Xibei
;
Ni, Yong
;
Peng, Qing
;
Wei, Yujie
收藏
  |  
浏览/下载:90/0
  |  
提交时间:2023/01/25
MonolayerC(60) fullerene(mC(60))
Mechanical properties
Anisotropic strength
Strain engineering
Band gap
Effect of alloying elements on the interface of fcc-Fe/Ni3Al by first principle calculations
期刊论文
Computational Materials Science, 2022, 卷号: 214
作者:
Guo, Xin
;
Zhou, Jitian
;
Zhang, Xingxing
;
Yang, Ping
;
Ren, Junqiang
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  |  
浏览/下载:29/0
  |  
提交时间:2022/09/22
Alloying
Atoms
Austenite
Calculations
Chemical bonds
Density functional theory
Electrons
Density diagram
Differential charge
First principle calculations
First principles
Heat-resistant steel
Interface energy
Interface property
Orbital electrons
Orbitals
Segregation
First-principles insights into hydrogen trapping in interstitial-vacancy complexes in vanadium carbide
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 34, 页码: 20400-20408
作者:
Tang, Shuai
;
Li, Lin-xian
;
Peng, Qing
;
Yan, Hai-le
;
Cai, Ming-hui
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  |  
浏览/下载:41/0
  |  
提交时间:2022/09/16
First-principles Study of Doped (Silicon, Germanium, Tin) Single-wall Carbon Nanotubes
期刊论文
Cailiao Daobao/Materials Reports, 2022, 卷号: 36, 期号: 9
作者:
Lu, Xuefeng
;
Wang, Kuan
;
Cui, Zhihong
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2022/06/20
Absorption spectroscopy
Atoms
Calculations
Semiconductor doping
Single-walled carbon nanotubes (SWCN)
Solar cells
Doped silicon
Doped systems
Electronic.structure
First principles
First-principle study
Germanium tins
Silicon germaniums (SiGe)
Single Wall
Single-wall carbon nanotube
Sn-doped
First-Principles Study on the Effect of Cu on Nb Segregation in Inconel 718 Alloy
期刊论文
ACTA METALLURGICA SINICA, 2022, 卷号: 58, 期号: 2, 页码: 241-249
作者:
Li Yamin
;
Zhang Yaoyao
;
Zhao Wang
;
Zhou Shengrui
;
Liu Hongjun
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  |  
浏览/下载:34/0
  |  
提交时间:2022/03/01
Inconel 718 alloy
alloying element interaction
Nb segregation mechanism
first principle
Structural stability and mechanical properties of B2 ordered refractory AlNbTiVZr high entropy alloys
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2021, 卷号: 886, 页码: 8
作者:
Qiu, Shi
;
Chen, Shu-Ming
;
Naihua, Naihua
;
Zhou, Jian
;
Hu, Qing-Miao
收藏
  |  
浏览/下载:54/0
  |  
提交时间:2021/11/22
Local chemical ordering
High entropy alloy
First-principles calculations
Mechanical properties
Structural stability and mechanical properties of B2 ordered refractory AlNbTiVZr high entropy alloys
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2021, 卷号: 886, 页码: 8
作者:
Qiu, Shi
;
Chen, Shu-Ming
;
Naihua, Naihua
;
Zhou, Jian
;
Hu, Qing-Miao
收藏
  |  
浏览/下载:54/0
  |  
提交时间:2021/11/22
Local chemical ordering
High entropy alloy
First-principles calculations
Mechanical properties
Interaction and Mechanism between Imidazolium Ionic Liquids and the Zwitterionic Amino Acid Tyr: a DFT Study
期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2021, 卷号: 37, 期号: 10, 页码: 10
作者:
Wu, Zhiwei
;
Ding, Weilu
;
Zhang, Yaqin
;
Wang, Yanlei
;
He, Hongyan
收藏
  |  
浏览/下载:23/0
  |  
提交时间:2021/08/31
Ionic liquids
Zwitterionic amino acid
Interaction and mechanism
Hydrogen bond effect
Van der Weals effect
Dynamic Process and Mechanism of the Catastrophic Taihongcun Landslide Triggered by the 2008 Wenchuan Earthquake Based on Field Investigations and Discrete Element Method Simulations
期刊论文
FRONTIERS IN EARTH SCIENCE, 2021, 卷号: 9, 页码: 19
作者:
Zhou, Xingtao
;
Wei, Pengfei
;
Fu, Xiaodong
;
Li, Lihua
;
Xue, Xiaohui
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2021/09/14
Taihongcun landslide
field investigation
discrete element method
dynamic process
formation mechanism
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