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科研机构
金属研究所 [35]
内容类型
期刊论文 [35]
发表日期
2021 [35]
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发表日期:2021
专题:金属研究所
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Two-dimensional layered MSi2N4 (M = Mo, W) as promising thermal management materials: a comparative study
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2021, 页码: 8
作者:
Shen, Chen
;
Wang, Lei
;
Wei, Donghai
;
Zhang, Yixuan
;
Qin, Guangzhao
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2022/07/01
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:55/0
  |  
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
Surface passivation induced a significant enhancement of superconductivity in layered two-dimensional MSi2N4 (M = Ta and Nb) materials
期刊论文
NANOSCALE, 2021, 卷号: 13, 期号: 45, 页码: 18947-18954
作者:
Yan, Luo
;
Wang, Bao-Tian
;
Huang, Xingyong
;
Li, Qiaoqiao
;
Xue, Kui
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2021/12/09
Probing the reaction mechanism of acetylene hydrochlorination on metal-free doped boron nitride: Decisive role of carbon dopant
期刊论文
APPLIED SURFACE SCIENCE, 2021, 卷号: 566, 页码: 7
作者:
Si, Chaowei
;
Lian, Zan
;
Yang, Min
;
Li, Bo
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2021/11/22
Metal-free catalysis
Boron Nitride
DFT
Acetylene hydroclorination
Carbon doping
Topological nodal line and superconductivity of highly thermally stable two-dimensional TiB4
期刊论文
PHYSICAL REVIEW B, 2021, 卷号: 104, 期号: 19, 页码: 9
作者:
Wang, Lei
;
Liu, Mingfeng
;
Li, Jiangxu
;
Li, Ronghan
;
Ma, Hui
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2022/01/27
Unraveling surface functionalization of Cr2B2T2 (T = OH, O, Cl, H) MBene by first-principles calculations
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 199, 页码: 7
作者:
Hu, Tao
;
Wang, Mengting
;
Wang, Xiaohui
;
Zhou, Yanchun
;
Li, Changming
收藏
  |  
浏览/下载:38/0
  |  
提交时间:2021/11/22
Two-dimensional materials
Surface functionalization
Stability
MBene
First-principles calculations
Interaction between Al and other alloying atoms in alpha-Ti for designing high temperature titanium alloy
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 197, 页码: 11
作者:
Cao, Shuo
;
Zhang, Shang-Zhou
;
Liu, Jian-Rong
;
Li, Shu-Jun
;
Sun, Tao
收藏
  |  
浏览/下载:119/0
  |  
提交时间:2021/10/15
Titanium alloys
Thermal strength
Thermal stability
Interaction energy
First principles calculations
Origin of the omega-Strengthening and Embrittlement in beta-Titanium Alloys: Insight from First Principles
期刊论文
PHYSICAL MESOMECHANICS, 2021, 卷号: 24, 期号: 5, 页码: 513-522
作者:
Cao, Sh
;
Chen, W.
;
Yang, R.
;
Hu, Q-M
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2021/12/09
titanium alloys
phase
embrittlement
generalized stacking fault energy
first-principles calculations
Twinning pathways in Fe and Fe-Cr alloys from first-principles theory
期刊论文
ACTA MATERIALIA, 2021, 卷号: 215, 页码: 14
作者:
Wang, Ci
;
Schonecker, Stephan
;
Li, Wei
;
Yang, Yaochun
;
Hu, Qing-Miao
收藏
  |  
浏览/下载:69/0
  |  
提交时间:2021/10/15
Deformation twinning
Generalized stacking fault energy
Ferrite
Fe-Cr alloys
First-principles calculations
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