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The effect of carbon vacancy on the properties of ZrC by MEAM potentials
期刊论文
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, 2024, 卷号: 85, 页码: 7
作者:
Ouyang, Yifang
;
Xiong, Meiling
;
Lin, Kuixin
;
Zhou, Yulu
;
Chen, Hongmei
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浏览/下载:0/0
  |  
提交时间:2024/05/27
Zr-C system
MEAM potential
Physical properties
Synthesis of a novel fused heterocyclic quaternary ammonium salt and its performance in ultra-low dosage as acidizing corrosion inhibitor
期刊论文
JOURNAL OF MOLECULAR STRUCTURE, 2024, 卷号: 1303, 页码: 13
作者:
Wang, Jing
;
Wang, Yefei
;
Yang, Zhen
;
Guo, Lei
;
Yang, Jiang
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  |  
浏览/下载:0/0
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提交时间:2024/06/04
Fused heterocyclic
One-pot synthesis method
Ultra-low dosage
Synergistic inhibition
Inhibition mechanism
Molecular dynamics simulation
Microstructure evolution in 439 stainless steels under tensile: phase field simulation and experiment
期刊论文
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
;
彭庆3,4,5)
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  |  
浏览/下载:2/0
  |  
提交时间:2024/03/11
439 stainless steel
phase field simulation
tensile stress
texture
microstructure
Real-time structural signatures of protein allostery by electrically- and mechanically-coupled sensing
期刊论文
NANO TODAY, 2024, 卷号: 55, 页码: 10
作者:
Zhang, Mingkun
;
Zheng, Zhi
;
Zhou, Jin
;
Ding, Qihan
;
Long, Mian
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  |  
浏览/下载:2/0
  |  
提交时间:2024/03/25
Nanopore sensing
Atomic force microscopy (AFM)
Protein allostery
Steered molecular dynamics (SMD)
Spheroid approximation
Machine Learning-Accelerated First-Principles Study of Atomic Configuration and Ionic Diffusion in Li
10
GeP
2
S
12
Solid Electrolyte
期刊论文
MATERIALS, 2024, 卷号: 17, 期号: 8, 页码: 14
作者:
Qi, Changlin
;
Zhou, Yuwei
;
Yuan XZ(袁晓泽)
;
Peng Q(彭庆)
;
Yang, Yong
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浏览/下载:0/0
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提交时间:2024/05/27
Li10GeP2S12 solid electrolyte
first-principles calculation
Ewald-summation-based electrostatic energy
machine learning- and active-learning-based LAsou method
ab initio molecular dynamics
Understanding the Corrosion Behaviour of Steel Under Alternate Oil/Water Wetting with Different Oil Viscosities
期刊论文
JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 2024, 卷号: 171, 期号: 3, 页码: 9
作者:
Ma, W. L.
;
Wang, H. X.
;
Neville, A.
;
Hua, Y.
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提交时间:2024/06/04
corrosion
molecular dynamics simulation
alternate oil/water wetting
oil viscosity
oil film stability
Dynamical Performance of Graphene Aerogel with Ductile and Brittle Characteristics
期刊论文
ADVANCED FUNCTIONAL MATERIALS, 2024, 页码: 11
作者:
Xiao, Kailu
;
Zhang, Wei
;
Zhu, Mingquan
;
Yin, Qiuyun
;
Fortunelli, Alessandro
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  |  
浏览/下载:1/0
  |  
提交时间:2024/05/14
asymmetry expanded failure mode
dynamical performance
energy dissipation behavior
graphene aerogel
Collaborative Optimization Design of Self-Powered Sterilizer with Highly Efficient Synergistic Antibacterial Effect
期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2024, 卷号: 16, 期号: 13, 页码: 16232-16242
作者:
Li, Jiawei
;
Zhou, Zhou
;
Wang, Peng
;
Wang, Congyu
;
Xiang, Tengfei
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  |  
浏览/下载:0/0
  |  
提交时间:2024/06/04
triboelectric nanogenerator
self-powered system
multimodal sterilization
breakdown discharge
electroporation
reactive oxygen species
reactivenitrogen species
Pathway of Oil-Soluble Additives to Reduce Heavy Crude Oil Viscosity Depends on the Molecular Characteristics of Asphaltene
期刊论文
ENERGY & FUELS, 2024, 卷号: 38, 期号: 6, 页码: 4990-4997
作者:
Li, Zhen
;
Han, Tiankun
;
Li, Jiawei
;
Zhu, Bojin
;
Yan, Youguo
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  |  
浏览/下载:0/0
  |  
提交时间:2024/06/04
Molecular insights into the dispersibility of asphaltene and crude oil rheological properties under the effect of multi-alkylated aromatic amides
期刊论文
CHEMICAL ENGINEERING SCIENCE, 2024, 卷号: 285, 页码: 12
作者:
Zhu, Bojin
;
Li, Zhen
;
Han, Tiankun
;
Yan, Youguo
;
Li, Jiawei
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  |  
浏览/下载:5/0
  |  
提交时间:2024/04/07
Asphaltene dispersibility
Crude oil viscosity
Molecular dynamics simulation
Density function theory calculation
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