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CAS IR Grid
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力学研究所 [8]
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期刊论文 [37]
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Chemistry [1]
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Deformation Mechanisms Dominated by Decomposition of an Interfacial Misfit Dislocation Network in Ni/Ni
3
Al Multilayer Structures
期刊论文
OAI收割
MATERIALS, 2024, 卷号: 17, 期号: 16, 页码: 15
作者:
Zhang, Zhiwei
;
Zhang, Xingyi
;
Yang, Rong
;
Wang, Jun
;
Lu, Chunsheng
  |  
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2024/10/08
Ni/Ni3Al multilayer structures
interfacial misfit dislocation network
dislocation evolution
crystalline orientation effect
molecular dynamics
Characterization of the effects of wettability and pore pressure on the interfacial behavior of CO2 interacting with oil-water two-phase on pore walls
期刊论文
OAI收割
GEOENERGY SCIENCE AND ENGINEERING, 2023, 卷号: 231, 页码: 13
作者:
Yu, Tao
;
Li, Qi
;
Tan, Yongsheng
;
Hu, Haixiang
;
Xu, Liang
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2025/06/27
Molecular dynamics simulation
CO2 gas flooding
Wettability
Interfacial tension
Interaction energy
Residual oil
CO2 utilization
Size- and temperature-dependent thermal transport across a Cu-diamond interface: Non-equilibrium molecular dynamics simulations
期刊论文
OAI收割
SURFACES AND INTERFACES, 2023, 卷号: 37, 页码: 102736
作者:
Huang, Hai
;
Zhong, Yinghui
;
Cai, Bin
;
Wang, Jiefang
;
Liu, Zhongxia
  |  
收藏
  |  
浏览/下载:82/0
  |  
提交时间:2023/06/15
Interfacial thermal transport
Cu -diamond composites
Size effects
Temperature effects
Non -equilibrium molecular dynamics
Interfacial Characteristics of Graphene-Reinforced Iron Composites: A Molecular Dynamics Study
期刊论文
OAI收割
CRYSTALS, 2023, 卷号: 13, 期号: 1, 页码: 12
作者:
Song, Miaomiao
;
Jin, Jianfeng
;
Wang, Lu
;
Li, Shaojie
;
Wang, Huiming
  |  
收藏
  |  
浏览/下载:31/0
  |  
提交时间:2023/02/27
graphene-reinforced iron matrix composite
interfacial characteristic
molecular dynamics simulation
moire pattern
crystallographic orientation
Partition model for trace elements between liquid metal and silicate melts involving the interfacial transition structure: An exploratory two-phase first-principles molecular dynamics study
期刊论文
OAI收割
JOURNAL OF MOLECULAR LIQUIDS, 2022, 卷号: 364, 页码: 14
作者:
Sun, Yiwei
;
Qian, Guoyu
;
Pang, Sheng
;
Lu, Jijun
;
Guo, Jianwei
  |  
收藏
  |  
浏览/下载:37/0
  |  
提交时间:2023/02/24
Partition model of trace elements
Two-phase first-principles molecular 
dynamics
Local coordination structure
Interfacial transition structure
Silicon slag refining
Room temperature bilayer water structures on a rutile TiO2(110) surface: hydrophobic or hydrophilic?
期刊论文
OAI收割
CHEMICAL SCIENCE, 2022, 卷号: 13, 期号: 35, 页码: 10546-10554
作者:
Qu, Mengyang
;
Huang, Gang
;
Liu, Xinyi
;
Nie, Xuechuan
;
Qi, Chonghai
  |  
收藏
  |  
浏览/下载:39/0
  |  
提交时间:2023/01/16
SUM-FREQUENCY GENERATION
MOLECULAR-DYNAMICS
INTERFACIAL WATER
TITANIUM-DIOXIDE
ELECTRON-TRANSFER
TIO2
SPECTROSCOPY
ADSORPTION
LAYER
PHOTOOXIDATION
Interaction between the edge dislocation dipole pair and interfacial misfit dislocation network in Ni-based single crystal superalloys
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF SOLIDS AND STRUCTURES, 2021, 卷号: 228, 页码: 8
作者:
Zhang ZW(张志伟)
;
Fu, Qiang
;
Wang J(王军)
;
Yang R(杨荣)
  |  
收藏
  |  
浏览/下载:84/0
  |  
提交时间:2021/09/08
Ni-based single crystal superalloys
Edge dislocation dipole pair
Interfacial misfit dislocation network
Interacting mechanism
Molecular dynamics
Photodriven water oxidation initiated by a surface bound chromophore-donor-catalyst assembly
期刊论文
OAI收割
CHEMICAL SCIENCE, 2021, 卷号: 12, 期号: 43, 页码: 14441-14450
作者:
Wang, Degao
;
Xu, Zihao
;
Sheridan, Matthew V.
;
Concepcion, Javier J.
;
Li, Fei
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2021/12/01
INTERFACIAL ELECTRON-TRANSFER
OXYGEN-EVOLVING COMPLEX
METAL-OXIDE SURFACES
ARTIFICIAL PHOTOSYNTHESIS
RECOMBINATION DYNAMICS
HIGHLY EFFICIENT
POLYPYRIDYL DYES
PHOTOSYSTEM-II
BOND FORMATION
SOLAR FUELS
Recent Progress toward Ab Initio Modeling of Electrocatalysis
期刊论文
OAI收割
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2021, 卷号: 12, 期号: 37, 页码: 8924-8931
作者:
Le, Jia-Bo
;
Yang, Xiao-Hui
;
Zhuang, Yong-Bin
;
Jia, Mei
;
Cheng, Jun
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2021/12/01
MOLECULAR-DYNAMICS SIMULATIONS
FREE-ENERGY
INTERFACIAL WATER
PROTON-TRANSFER
DENSITY
MECHANISMS
REDUCTION
CONSTANT
SURFACE
ORIGIN
Application of Atomic Layer Deposition in Dye-Sensitized Photoelectrosynthesis Cells
期刊论文
OAI收割
TRENDS IN CHEMISTRY, 2021, 卷号: 3, 期号: 1
作者:
Wang, Degao
;
Huang, Qing
;
Shi, Weiqun
;
You, Wei
;
Meyer, Thomas J.
  |  
收藏
  |  
浏览/下载:152/0
  |  
提交时间:2021/12/01
MOLECULAR WATER-OXIDATION
INTERFACIAL ELECTRON-TRANSFER
METAL-OXIDE SURFACES
SOLAR-CELLS
RECOMBINATION DYNAMICS
ARTIFICIAL PHOTOSYNTHESIS
CHARGE-SEPARATION
HIGHLY EFFICIENT
SINGLE-SITE
TANDEM CELL