Classical dynamical density functional theory: from fundamentals to applications
Classical dynamical density functional theory (DDFT) is one of the cornerstones of modern
statistical mechanics. It is an extension of the highly successful method of classical density …
statistical mechanics. It is an extension of the highly successful method of classical density …
Effect of ionomer swelling and capillary condensation of water on porous characteristics in cathode catalyst layers of polymer electrolyte membrane fuel cells under …
T Kaneko, J Ooyama, M Ohki, H Kanesaka… - International Journal of …, 2023 - Elsevier
Reducing oxygen diffusion resistance in the cathode catalyst layer of polymer electrolyte fuel
cells under humidified conditions is essential for reducing the cost of expensive platinum …
cells under humidified conditions is essential for reducing the cost of expensive platinum …
Liquid drops on a surface: Using density functional theory to calculate the binding potential and drop profiles and comparing with results from mesoscopic modelling
The contribution to the free energy for a film of liquid of thickness h on a solid surface due to
the interactions between the solid-liquid and liquid-gas interfaces is given by the binding …
the interactions between the solid-liquid and liquid-gas interfaces is given by the binding …
Relation between oxygen gas diffusivity and porous characteristics under capillary condensation of water in cathode catalyst layers of polymer electrolyte membrane …
We present a coupled simulation method for evaluating oxygen diffusivity in cathode catalyst
layers of polymer electrolyte membrane fuel cells under capillary condensation of water …
layers of polymer electrolyte membrane fuel cells under capillary condensation of water …
Water Condensation in the Nanoscale Pores of Pt/C Catalyst Particles and Its Impact on Catalyst Utilization: A Simulation Based on a Reconstructed Structure from …
CJC Otic, S Katayama, M Arao… - … Applied Materials & …, 2024 - ACS Publications
In polymer electrolyte membrane fuel cells, carbon-supported platinum (Pt/C) catalyst
particles require sufficient water condensation within the nanoscale pores to effectively …
particles require sufficient water condensation within the nanoscale pores to effectively …
Dynamic magnetic properties the spin-1 Ising model with bilinear and biquadratic interactions within the path probability method
M Ertaş, M Keskin - Physica A: Statistical Mechanics and its Applications, 2019 - Elsevier
Dynamic magnetic properties the spin-1 Ising model with bilinear and biquadratic
interactions under the oscillating magnetic field are studied by using the path probability …
interactions under the oscillating magnetic field are studied by using the path probability …
Effect of capillary condensation on gas transport properties in porous media
We investigate the effect of capillary condensation on gas diffusivity in porous media
composed of randomly packed spheres with moderate wettability. To simulate capillary …
composed of randomly packed spheres with moderate wettability. To simulate capillary …
[HTML][HTML] Dynamic density functional theory with hydrodynamic interactions: Theoretical development and application in the study of phase separation in gas-liquid …
ES Kikkinides, PA Monson - The Journal of Chemical Physics, 2015 - pubs.aip.org
Building on recent developments in dynamic density functional theory, we have developed a
version of the theory that includes hydrodynamic interactions. This is achieved by combining …
version of the theory that includes hydrodynamic interactions. This is achieved by combining …
Direct Observation of the Xenon Physisorption Process in Mesopores by Combining In Situ Anomalous Small-Angle X-ray Scattering and X-ray Absorption …
E Gericke, D Wallacher, R Wendt, G Greco… - The Journal of …, 2021 - ACS Publications
The morphology and structural changes of confined matter are still far from being
understood. This report deals with the development of a novel in situ method based on the …
understood. This report deals with the development of a novel in situ method based on the …