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Microstructure evolution in 439 stainless steels under tensile: phase field simulation and experiment
期刊论文
OAI收割
MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2024, 卷号: 32, 期号: 3, 页码: 23
作者:
Liu, Yongbo
;
Wang, Mingtao
;
Liu, Qingcheng
;
Jin, Jianfeng
;
Peng, Qing
  |  
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2024/03/11
439 stainless steel
phase field simulation
tensile stress
texture
microstructure
Molecular insights into the dispersibility of asphaltene and crude oil rheological properties under the effect of multi-alkylated aromatic amides
期刊论文
OAI收割
CHEMICAL ENGINEERING SCIENCE, 2024, 卷号: 285, 页码: 12
作者:
Zhu, Bojin
;
Li, Zhen
;
Han, Tiankun
;
Yan, Youguo
;
Li, Jiawei
  |  
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2024/04/07
Asphaltene dispersibility
Crude oil viscosity
Molecular dynamics simulation
Density function theory calculation
Exponential relaxation of the energy and desorption dynamics of atoms colliding with a surface
期刊论文
OAI收割
PHYSICA SCRIPTA, 2024, 卷号: 99, 期号: 3, 页码: 10
作者:
Zeng, Dandan
;
Jiang, Jianzheng
;
Liu, Chong
;
Fan, Jing
;
Fan J(樊菁)
  |  
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2024/03/11
atom-surface interaction
energy relaxation
residence time
molecular dynamics
Insights into scratching force in axial ultrasonic vibration-assisted single grain scratching
期刊论文
OAI收割
JOURNAL OF MANUFACTURING PROCESSES, 2024, 卷号: 112, 页码: 150-160
作者:
Zhang, Yuqiang
;
Hu, Zhongwei
;
Chen, Yue
;
Yu, Yiqing
;
Jin, Jianfeng
  |  
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2024/04/02
Axial ultrasonic vibration
Scratching
Scratching force
Molecular dynamics
Periodic fluctuation
Insights into the effect of water content on asphaltene aggregation behavior and crude oil rheology: A molecular dynamics simulation study
期刊论文
OAI收割
JOURNAL OF MOLECULAR LIQUIDS, 2024, 卷号: 396, 页码: 9
作者:
Zhu, Bojin
;
Yang, Menglong
;
Yan, Youguo
;
Zhong, Jie
;
Li, Jiawei
  |  
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2024/04/07
W/O emulsions
Water content
Asphaltene polar adsorption
Viscosity mechanism
MD simulations
The Effect of Impact Load on the Atomistic Scale Fracture Behavior of Nanocrystalline bcc Iron
期刊论文
OAI收割
NANOMATERIALS, 2024, 卷号: 14, 期号: 4, 页码: 11
作者:
Zhao, Zhifu
;
Wang, Zhen
;
Bie, Yehui
;
Liu, Xiaoming
;
Wei, Yueguang
  |  
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2024/04/02
molecular dynamics simulation
nanocrystalline iron
impact load
fracture resistance
fracture ductility
Effects of Chemical Short-Range Order and Lattice Distortion on Crack-Tip Behavior of Medium-Entropy Alloy by Atomistic Simulations
期刊论文
OAI收割
METALS, 2024, 卷号: 14, 期号: 2, 页码: 14
作者:
Zhu, Xiuju
;
Cao, Fuhua
;
Dai, Lanhong
;
Chen, Yan
;
Dai LH(戴兰宏)
  |  
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2024/04/02
chemical short-range order
lattice distortion
J-integral
localized deformation zone
crack
molecular dynamics
Temperature gradient enhances the solidification process and properties of a CoCrFeNi high-entropy alloy: Atomic insights from molecular dynamics simulations
期刊论文
OAI收割
COMPUTATIONAL MATERIALS SCIENCE, 2024, 卷号: 231, 页码: 12
作者:
Xie, Lu
;
Wu, Guangda
;
Liaw, Peter K.
;
Wang, Wenrui
;
Li, Dongyue
  |  
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2023/12/11
High-entropy alloy
Temperature gradient
Stress distribution
Cooling rate
Enhancing geometric representations for molecules with equivariant vector-scalar interactive message passing
期刊论文
OAI收割
NATURE COMMUNICATIONS, 2024, 卷号: 15, 期号: 1, 页码: 13
作者:
Wang, Yusong
;
Wang, Tong
;
Li, Shaoning
;
He, Xinheng
;
Li, Mingyu
  |  
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2024/02/27
The emergence of machine learning force fields in drug design
期刊论文
OAI收割
MEDICINAL RESEARCH REVIEWS, 2024, 页码: 36
作者:
Chen, Mingan
;
Jiang, Xinyu
;
Zhang, Lehan
;
Chen, Xiaoxu
;
Wen, Yiming
  |  
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2024/02/19
computational chemistry
drug design
force field
machine learning
molecular modeling