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浏览/检索结果:
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First-principles modeling of passivation behaviors of stainless steels in corrosive environments
期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2025, 卷号: 229, 页码: 58-66
作者:
Xu, Wenjing
;
Bao, Ergen
;
Si, Yueqi
;
Ma, Hui
;
Liu, Peitao
;
Sun, Yan
;
Shi, Yongpeng
;
Chen, Xing-Qiu
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2025/04/27
Passivation
Modeling
First-principles calculation
Stainless steel
Spinel inversion-induced magnetic coupling transitions at antiphase boundaries
期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2025, 卷号: 223, 页码: 47-55
作者:
Chen, Shanshan
;
Sun, Ziyi
;
Jin, Qianqian
;
Yan, Xuexi
;
Gao, Chunyang
;
Tao, Ang
;
Jiang, Yixiao
;
Yao, Tingting
;
Chen, Chunlin
;
Ma, Xiuliang
;
Ye, Hengqiang
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2025/04/27
Antiphase boundary
Cation distribution
Magnetic coupling
Transmission electron microscopy
First-principles calculations
First-principles insights into the stability and mechanical properties of four typical tantalum carbides
期刊论文
VACUUM, 2025, 卷号: 234, 页码: 8
作者:
Yang, Guang
;
Zhang, Wenyu
;
Ma, Shangyi
;
Li, Yunfei
;
Jiang, Tao
;
Qi, Yang
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2025/04/27
Tantalum carbides
Mechanical properties
Formation free energy
Thermal stability
The atomic formation mechanism of GP zones in Al-Cu alloys: Insights from cluster expansion coupled with Monte Carlo simulation
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2025, 卷号: 252, 页码: 11
作者:
Fan, Weiqi
;
Gong, Tongzhao
;
Hao, Weiye
;
Chen, Yun
;
Chen, Xing-Qiu
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2025/04/27
GP zones
Al-cu alloys
Cluster expansion
Monte Carlo simulation
Vacancy
Magnesium
Deep-Learning Potential Molecular Dynamics Study on Nanopolycrystalline Al-Er Alloys: Effects of Er Concentration, Grain Boundary Segregation, and Grain Size on Plastic Deformation
期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2025, 页码: 12
作者:
Chang, Zhen
;
Feng, Li
;
Xue, Hong-Tao
;
Yang, Yan-Hong
;
Ren, Jun-Qiang
;
Tang, Fu-Ling
;
Lu, Xue-Feng
;
Li, Jun-Chen
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2025/04/27
The Fe-N system: crystal structure prediction, phase stability, and mechanical properties
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2025, 卷号: 251, 页码: 12
作者:
Bao, Ergen
;
Zhao, Jinbin
;
Gao, Qiang
;
Shahid, Ijaz
;
Ma, Hui
;
Luo, Yixiu
;
Liu, Peitao
;
Sun, Yan
;
Chen, Xing-Qiu
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2025/04/27
First-principles
Fe-N compounds
Mechanical properties
Hardness
Growth mechanism and product formation of Micro-arc oxide film layers on aluminum matrix composites: An analytical experimental and computational simulation study
期刊论文
APPLIED SURFACE SCIENCE, 2025, 卷号: 684, 页码: 12
作者:
Ma, Guofeng
;
Li, Zhanpeng
;
Zhao, Xiaorong
;
Wang, Ziyao
;
Sun, Shineng
;
Yang, Yanhong
;
Sun, Yuan
;
Wang, Shiyang
;
Ren, Shengtao
;
Kou, Ronghui
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2025/04/27
Micro-arc oxidation
Density functional theory
Growth mechanism
17% SiCp/ 2009 AMC
Atomic-scale understanding of the effects of Cr and Ti on γ′ growth kinetics in the Ni-Al-X ternary system: Diffusion couple technique and DFT study
期刊论文
JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMR&T, 2025, 卷号: 35, 页码: 1311-1322
作者:
Gao, Xinyu
;
Tian, Yuan
;
Wen, Xin
;
Qiao, Shichang
;
Wang, Fengzhen
;
Li, Na
;
Xia, Zhikang
;
Wang, Yongqianag
;
Liu, Shuai
;
Yuan, Chao
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2025/04/27
Ni-based alloy
Diffusion couple
Precipitation kinetic
Solid state phase transformation
First-principles
Novel transformation mechanism among precipitates in Mg-Gd alloys
期刊论文
ACTA MATERIALIA, 2025, 卷号: 286, 页码: 10
作者:
Niu, Xue-Shan
;
Lv, Ming
;
Feng, Yan-Peng
;
Wang, Yu-Jia
;
Shao, Xiao-Hong
;
Ma, Xiu-Liang
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2025/04/27
Mg alloy
First principles
Phase transformation
HAADF-STEM
A new generation of two-dimensional reverse osmosis membranes with satisfactory desalination and photodegradation properties: Ag-GDY
期刊论文
DIAMOND AND RELATED MATERIALS, 2025, 卷号: 152, 页码: 10
作者:
Xu, Ting
;
Wang, Jilun
;
Yu, Xiaohua
;
Niu, Yutao
;
Li, Hanqing
;
Lu, Yi
;
Hou, Hongying
;
Xiong, Shizhao
;
Liu, Zhaohua
;
Rong, Ju
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2025/04/27
Silver-doped graphdiyne
Desalination
Photodegradation
Disinfection and sterilization
Sustainable development