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Self-Diffusion and Molecular Association in a Cyclohexane–Methanol Binary System at Temperatures of 298 and 323 K
AbstractSelf-diffusion in a cyclohexane–methanol binary system was studied by the pulsed gradient spin-echo 1 H NMR method at temperatures of 298 (in...
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Study of anode self-humidifying gas diffusion layer
Hydrogen is oxidized into H + and e − on the anode side of fuel cell. H + is transported from anode to cathode of fuel cell in the form of H 3 + O. When...
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Self-Diffusion of Ferulic and Sinapic Acids in the Binary Carbon Tetrachloride–Acetone-d6 System
Abstract1 H NMR with a pulsed magnetic field gradient method are used to measure the coefficients of self-diffusion of ferulic and sinapic acids in...
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Shear Viscosity and Self-Diffusion in Water
AbstractAn analysis is performed of two important transport processes in a liquid water: kinematic shear viscosity and self-diffusion. The approach...
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Probing the self-diffusion process in Aluminium
An in-depth understanding of the diffusion process in liquid metals is a key to design and engineering new high-performance materials. In this study,...
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Self-supported copper-based gas diffusion electrodes improve the local CO2 concentration for efficient electrochemical CO2 reduction
Electrochemical CO 2 reduction is a sustainable approach in green chemistry that enables the production of valuable chemicals and fuels while...
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MD Simulation and Analysis of the Pair Correlation Functions, Self-Diffusion Coefficients and Orientational Correlation Times in Aqueous KCl Solutions at Different Temperatures and Concentrations
In this study, we investigate some structural and dynamical properties of aqueous KCl solutions at different temperatures and concentrations. We...
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Solute–Solvent Interactions of 2,2,6,6-Tetramethylpiperidinyloxyl and 5-Tert-Butylisophthalic Acid in Polyethylene Glycol as Observed by Measurements of Density, Viscosity, and Self-Diffusion Coefficient
This study is seeking a better understanding of polyethylene glycol (PEG) as a solvent to promote its use in chemical synthesis. The effect of adding...
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Model of confined water self-diffusion and its application to proton-exchange membranes
A model of self-diffusion in confined water is proposed. It is based on the idea that confined water forms structures similar to hexagonal ice and...
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Dynamics in nanoporous materials probed by 2H solid state NMR: estimation of self-diffusion coefficients
2 H solid-state NMR represents a reliable method for probing the dynamics of the molecules in confined geometries, including microporous and...
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Self-diffusion of nanoscale particles with hard and soft sphere models
The diffusion of particles in suspension is investigated by a thermostat based on fluctuating hydrodynamics for dynamic simulations of...
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Terminology and Mechanisms of Self-Emulsifying Systems for Biomedical Applications: A Comprehensive Review
AbstractSelf-emulsifying systems, such as self-emulsifying drug delivery systems (SEDDS) and self-nanoemulsifying drug delivery systems (SNEDDS),...
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Self-Diffusion of Fullerene С60 Derivatives in Aqueous Solutions and Suspensions of Erythrocytes According to Pulsed Field Gradient NMR Data
AbstractDetermination of the mechanism of substance penetration in biological cells is one of the fundamental problems of metabolism. Interest in the...
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Molecular dynamics simulation of the effects of intermolecular interactions on the diffusion mechanism of 1,2,3-benzotriazole in low density polyethylene
It is of great significance to understand the diffusion rate of the volatile corrosion inhibitor (VCI) in the VCI films for corrosion inhibition. The...
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Design and structural parameter optimization of Venturi-type microbubble reactor for wastewater treatment by CFD simulation
Microbubble reactors play an important role in the development of gas-liquid reaction process enhancement. However, the urgent demand for high...
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A predictive procedure to model gas transport and intrinsic properties of rubbery polymeric membranes using equilibrium thermodynamics and free volume theory
In this study, the lattice fluid (LF) and Vrentas’s self-diffusion (VSD) model were employed to predict the gas sorption, diffusion, and permeability...
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A deep potential molecular dynamics study on the ionic structure and transport properties of NaCl-CaCl2 molten salt
Chloride salts that have abundant reserves own good thermal stability in high-temperature components of solar systems and thermal storage devices....
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Molecular Mobility in Aqueous Systems of Primary Aliphatic Amino Alcohols
AbstractSelf-diffusion coefficients (SDCs) of 3-amino-1-propanol (3AP), monoethanolamine (MEA), and water molecules are measured via 1 H NMR using a...
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A New Possibility to Recognize the Concentration Dependence of Sedimentation Coefficients
The binding constants of self-associating proteins can be determined from sedimentation velocity runs using the numerical solution of the Lamm...
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Identification of Distinct Soluble States During Fibril Formation Using Multilinear Analysis of NMR Diffusion Data
Protein misfolding and self-assembling into amyloid structures are associated with a number of diseases. Characterization of protein amyloid...