Generalized form for finite-size corrections in mutual diffusion coefficients of multicomponent mixtures obtained from equilibrium molecular dynamics simulation
The system-size dependence of computed mutual diffusion coefficients of multicomponent
mixtures is investigated, and a generalized correction term is derived. The generalized finite …
mixtures is investigated, and a generalized correction term is derived. The generalized finite …
Diffusivities in 1-Alcohols Containing Dissolved H2, He, N2, CO, or CO2 Close to Infinite Dilution
The influence of the strength of intermolecular interactions on mass diffusive processes
remains poorly understood for mixtures of associative liquids with dissolved gases. For …
remains poorly understood for mixtures of associative liquids with dissolved gases. For …
Thermal, Mutual, and Self-Diffusivities of Binary Liquid Mixtures Consisting of Gases Dissolved in n-Alkanes at Infinite Dilution
C Giraudet, T Klein, G Zhao, MH Rausch… - The Journal of …, 2018 - ACS Publications
In the present study, dynamic light scattering (DLS) experiments and molecular dynamics
(MD) simulations were used for the investigation of the molecular diffusion in binary mixtures …
(MD) simulations were used for the investigation of the molecular diffusion in binary mixtures …
Mutual and thermal diffusivities as well as fluid-phase equilibria of mixtures of 1-hexanol and carbon dioxide
This work contributes to an improved understanding of the fluid-phase behavior and
diffusion processes in mixtures of 1-hexanol and carbon dioxide (CO2) at temperatures …
diffusion processes in mixtures of 1-hexanol and carbon dioxide (CO2) at temperatures …
Influence of Liquid Structure on Fickian Diffusion in Binary Mixtures of n-Hexane and Carbon Dioxide Probed by Dynamic Light Scattering, Raman Spectroscopy, and …
This study contributes to a fundamental understanding of how the liquid structure in a model
system consisting of weakly associative n-hexane (n-C6H14) and carbon dioxide (CO2) …
system consisting of weakly associative n-hexane (n-C6H14) and carbon dioxide (CO2) …
Translational and rotational diffusion coefficients of gold nanorods dispersed in mixtures of water and glycerol by polarized dynamic light scattering
FE Berger Bioucas, C Damm, W Peukert… - The Journal of …, 2019 - ACS Publications
Polarized dynamic light scattering (DLS) gives access to orientation-averaged translational
and rotational diffusion coefficients of anisotropic particles dispersed in fluids in a single …
and rotational diffusion coefficients of anisotropic particles dispersed in fluids in a single …
Thermal conductivity of hydrocarbon liquid organic hydrogen carrier systems: measurement and prediction
FE Berger Bioucas, M Piszko, M Kerscher… - Journal of Chemical & …, 2020 - ACS Publications
In this study, the thermal conductivity of diphenylmethane, benzyltoluene, and
dibenzyltoluene and their fully hydrogenated counterparts relevant in the context of the …
dibenzyltoluene and their fully hydrogenated counterparts relevant in the context of the …
Thermal and mutual diffusivities of fuel-related binary liquid mixtures under pre-combustion conditions
In modelling heating and evaporation of fuel droplets, intra-droplet heat and mass transfer
has to be considered. This is only possible with the help of reliable data for thermal and …
has to be considered. This is only possible with the help of reliable data for thermal and …
Fick Diffusion Coefficient in Binary Mixtures of [HMIM][NTf2] and Carbon Dioxide by Dynamic Light Scattering and Molecular Dynamics Simulations
Dynamic light scattering (DLS) experiments and equilibrium molecular dynamics (EMD)
simulations were performed in the saturated liquid phase of the binary mixture of 1-hexyl-3 …
simulations were performed in the saturated liquid phase of the binary mixture of 1-hexyl-3 …
Liquid viscosity, interfacial tension, thermal diffusivity and mutual diffusivity of n-Tetradecane with dissolved carbon dioxide
J Cui, J Wu, S Bi - Fluid Phase Equilibria, 2021 - Elsevier
Abstract Systems in connection with hydrocarbons with dissolved carbon dioxide (CO 2) are
widespread in various chemical and engineering applications such as Fischer–Tropsch (FT) …
widespread in various chemical and engineering applications such as Fischer–Tropsch (FT) …