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Room temperature bilayer water structures on a rutile TiO2(110) surface: hydrophobic or hydrophilic?
期刊论文
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:18/0
  |  
提交时间:2023/01/16
SUM-FREQUENCY GENERATION
MOLECULAR-DYNAMICS
INTERFACIAL WATER
TITANIUM-DIOXIDE
ELECTRON-TRANSFER
TIO2
SPECTROSCOPY
ADSORPTION
LAYER
PHOTOOXIDATION
Tailored electrochemical behavior of ta-C film by glancing angle deposition
期刊论文
APPLIED SURFACE SCIENCE, 2020, 卷号: 516
作者:
Wei, Jing
;
Guo, Peng
;
Liu, Linlin
;
Li, Hanchao
;
Li, Hao
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  |  
浏览/下载:129/0
  |  
提交时间:2020/12/16
DIAMOND-LIKE CARBON
MOLECULAR-DYNAMICS SIMULATION
THIN-FILMS
CORROSION BEHAVIOR
GROWTH
MICROSTRUCTURE
NANOMATERIALS
EVOLUTION
SURFACES
Synthesis of Macromolecular Aromatic Epoxy Resins as Anticorrosive Materials: Computational Modeling Reinforced Experimental Studies
期刊论文
ACS OMEGA, 2020, 卷号: 5, 期号: 7, 页码: 3151-3164
作者:
Dagdag, Omar
;
Safi, Zaki
;
Qiang, Yujie
;
Erramli, Hamid
;
Guo, Lei
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  |  
浏览/下载:64/0
  |  
提交时间:2020/12/16
CORROSION INHIBITION PERFORMANCE
MOLECULAR-DYNAMICS SIMULATION
DENSITY-FUNCTIONAL THEORY
CARBON-STEEL CORROSION
MILD-STEEL
SCHIFF-BASE
HCL MEDIUM
STEREOCHEMICAL CONFORMATION
QUINOLINE DERIVATIVES
ABSOLUTE HARDNESS
Macroscale Superlubricity Enabled by Graphene-Coated Surfaces
期刊论文
ADVANCED SCIENCE, 2020, 卷号: 7, 期号: 4
作者:
Zhang, Zhenyu
;
Du, Yuefeng
;
Huang, Siling
;
Meng, Fanning
;
Chen, Leilei
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  |  
浏览/下载:28/0
  |  
提交时间:2020/12/16
ULTRA-LOW FRICTION
RAMAN-SPECTROSCOPY
NITROGEN ATMOSPHERE
MOLECULAR-DYNAMICS
FILMS
OXIDE
LUBRICANT
SUBSTRATE
ADHESION
WEAR
Experimental and theoretical studies on the inhibition properties of three diphenyl disulfide derivatives on copper corrosion in acid medium
期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2020, 卷号: 298
作者:
Tan, Bochuan
;
Zhang, Shengtao
;
Qiang, Yujie
;
Li, Wenpo
;
Li, Hao
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  |  
浏览/下载:18/0
  |  
提交时间:2020/12/16
MILD-STEEL CORROSION
CARBON-STEEL
SULFURIC-ACID
MOLECULAR-DYNAMICS
IONIC LIQUIDS
SURFACE CHARACTERIZATION
ANTICORROSIVE MECHANISM
INDAZOLE DERIVATIVES
ORGANIC-COMPOUNDS
GREEN INHIBITOR
First-principles investigations on the anisotropic elasticity and thermodynamic properties of U3Si2-Al
期刊论文
RSC ADVANCES, 2020, 卷号: 10, 期号: 58, 页码: 35049-35056
作者:
Chen, Xinyu
;
Qin, Yanqing
;
Shi, Diwei
;
Guo, Yaolin
;
Bu, Moran
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  |  
浏览/下载:124/0
  |  
提交时间:2020/12/16
INITIO MOLECULAR-DYNAMICS
THERMOPHYSICAL PROPERTIES
FUEL
TRANSITION
STABILITY
BEHAVIOR
U3SI2/AL
Investigation of Losartan Potassium as an eco-friendly corrosion inhibitor for copper in 0.5 M H2SO4
期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2020, 卷号: 305
作者:
Li, Hao
;
Zhang, Shengtao
;
Tan, Bochuan
;
Qiang, Yujie
;
Li, Wenpo
收藏
  |  
浏览/下载:22/0
  |  
提交时间:2020/12/16
MILD-STEEL CORROSION
SULFURIC-ACID
MOLECULAR-DYNAMICS
CARBON-STEEL
IONIC LIQUIDS
ANTICORROSIVE MECHANISM
STAINLESS-STEEL
CU CORROSION
HCL SOLUTION
EXTRACT
Influence of the ion size on the stability of the smectic phase of ionic liquid crystals
期刊论文
SOFT MATTER, 2020, 卷号: 16, 期号: 2, 页码: 411-420
作者:
Cao, Wudi
;
Senthilkumar, Beeran
;
Causin, Valerio
;
Swamy, Vincent P.
;
Wang, Yanting
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  |  
浏览/下载:26/0
  |  
提交时间:2020/06/16
MOLECULAR-DYNAMICS SIMULATIONS
SPATIAL HETEROGENEITY
THERMAL-BEHAVIOR
CHAIN-LENGTH
GUANIDINIUM
TRANSITION
AGGREGATION
TRANSPORT
INSIGHTS
STATE
Dynamic heterogeneity in aqueous ionic solutions
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 33, 页码: 21313-21324
作者:
Ren, G
;
Chen, L
;
Wang, YT
收藏
  |  
浏览/下载:32/0
  |  
提交时间:2018/12/27
ALKALI-HALIDE SOLUTIONS
STOKES-EINSTEIN RELATION
MOLECULAR-DYNAMICS
CONDUCTIVITY RELAXATION
DIELECTRIC-SPECTROSCOPY
HOMOGENEOUS NUCLEATION
ELECTROLYTE-SOLUTIONS
SUPERCOOLED WATER
LIGHT-SCATTERING
LENNARD-JONES
Dynamic heterogeneity in aqueous ionic solutions
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 33, 页码: 21313-21324
作者:
Chen, L
;
Ren, G
;
Wang, YT
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2018/12/26
ALKALI-HALIDE SOLUTIONS
STOKES-EINSTEIN RELATION
MOLECULAR-DYNAMICS
CONDUCTIVITY RELAXATION
DIELECTRIC-SPECTROSCOPY
HOMOGENEOUS NUCLEATION
ELECTROLYTE-SOLUTIONS
SUPERCOOLED WATER
LIGHT-SCATTERING
LENNARD-JONES
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