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In Molecular Dynamics (MD) simulations, interactions between water molecules and graphitic surfaces are often modeled as a simple Lennard-Jones potential between oxygen and carbon atoms. A possible method for tuning this parameter consists…

介观与纳米尺度物理 · 物理学 2015-06-03 Giulio Scocchi , Danilo Sergi , Claudio D'Angelo , Alberto Ortona

Accessing fluid infiltration in nanogranular coatings is an outstanding challenge, of relevance for applications ranging from nanomedicine to catalysis. A sensing platform, allowing to quantify the amount of fluid infiltrated in a…

In part 1, we proposed a model of dynamics of wetting for slow movements near a contact line formed at the interface of two immiscible fluids and a solid when viscous dissipation remains bounded. The contact line is not a material line and…

经典物理 · 物理学 2008-01-15 Henri Gouin

A simple model is proposed for the direct correlation function (DCF) for simple fluids consisting of a hard-core contribution, a simple parametrized core correction, and a mean-field tail. The model requires as input only the free energy of…

统计力学 · 物理学 2007-10-08 James F. Lutsko

By taking into account precursor films accompanying nanodroplets on trapezoidal substrates we show that on a mesoscopic level of description one does not observe the phenomenon of liquid-gas-substrate contact line pinning at substrate…

软凝聚态物质 · 物理学 2016-11-29 Filip Dutka , Marek Napiorkowski , Siegfried Dietrich

By means of contact-density chain-growth simulations, we investigate a simple lattice model of a flexible polymer interacting with an attractive substrate. The contact density is a function of the numbers of monomer-substrate and…

统计力学 · 物理学 2011-07-04 Michael Bachmann

A moving contact line occurs at the intersection of an interface formed between two immiscible liquids and a solid. According to viscous theory, the flow is entirely governed by just two parameters, the viscosity ratio, $\lambda$, and the…

流体动力学 · 物理学 2024-01-18 Charul Gupta , Lakshmana D Chandrala , Harish N Dixit

We study surface nanobubbles using molecular dynamics simulation of ternary (gas, liquid, solid) systems of Lennard-Jones fluids. They form for sufficiently low gas solubility in the liquid, i.e., for large relative gas concentration. For…

流体动力学 · 物理学 2012-11-19 J. H. Weijs , J. H. Snoeijer , D. Lohse

The thermodynamics of solid/liquid interfaces under nanoconfinement has tremendous implications for liquid transport properties. Here using molecular dynamics, we investigate graphite nanoslits and study how the water/graphite interfacial…

流体动力学 · 物理学 2022-05-17 Zixuan Wei , Mara Chiricotto , Joshua D. Elliott , Fausto Martelli , Paola Carbone

We consider the spreading of a thin two-dimensional droplet on a solid substrate. We use a model for viscous fluids where the evolution is governed by Darcy's Law. At the triple point where air and liquid meet the solid substrate, the…

偏微分方程分析 · 数学 2012-04-12 Hans Knüpfer , Nader Masmoudi

Droplet deposition onto a hydrophobic surface is studied experimentally and numerically. A wide range of droplet sizes can result from the same syringe, depending strongly on the needle retraction speed. Three regimes are identified…

流体动力学 · 物理学 2015-05-13 Bian Qian , Melissa Loureiro , David Gagnon , Anubhav Tripathi , Kenneth S. Breuer

Results from Monte Carlo simulations of wall-attached droplets in the three-dimensional Ising lattice gas model and in a symmetric binary Lennard-Jones fluid, confined by antisymmetric walls, are analyzed, with the aim to estimate the…

软凝聚态物质 · 物理学 2018-07-04 Subir K. Das , Sergei A. Egorov , Peter Virnau , David Winter , Kurt Binder

Spatial profiles of the pressure have been measured in atomic Fermi gases with primarily 2D kinematics. The in-plane motion of the particles is confined by a gaussian-shape potential. The two-component deeply-degenerate Fermi gases are…

量子气体 · 物理学 2016-09-05 Kirill Martiyanov , Tatiana Barmashova , Vasiliy Makhalov , Andrey Turlapov

In this paper we try to work out in detail the implications of a microscopic theory for capillary waves under the assumption that the density is given along lines normal to the interface. Our study provides interface Hamiltonians for…

软凝聚态物质 · 物理学 2017-11-07 Luis G. MacDowell

In this study, micro-droplets are placed on thin, glassy, free-standing films where the Laplace pressure of the droplet deforms the free-standing film, creating a bulge. The film's tension is modulated by changing temperature continuously…

软凝聚态物质 · 物理学 2017-06-26 Adam Fortais , Rafael D. Schulman , Kari Dalnoki-Veress

We present results of Molecular Dynamics (MD) calculations on the behavior of liquid nanodroplets on rough hydrophobic and hydrophilic solid surfaces. On hydrophobic surfaces, the contact angle for nanodroplets depends strongly on the root…

软凝聚态物质 · 物理学 2008-05-07 C. Yang , U. Tartaglino , B. N. J. Persson

The prevailing models for advancing dynamic contact angle are under intensive debates, and the fitting performances are far from satisfying in practice. The present study proposes a model based on the recent understanding of the multi-scale…

软凝聚态物质 · 物理学 2019-02-05 Hao Wang , Lei Chen

We analyze a one-component simple fluid in a liquid-vapor coexistence state, which forms an arbitrarily curved interface. By using an approach based on density functional theory, we obtain an exact and simple expression for the grand…

统计力学 · 物理学 2015-05-30 Jose G. Segovia-Lopez , Adolfo Zamora , J. A. Santiago

We examine the profile of a liquid front of a film that is dewetting a solid substrate. Since volume is conserved, the material that once covered the substrate is accumulated in a rim close to the three phase contact line. Theoretically,…

软凝聚态物质 · 物理学 2009-11-07 Ralf Seemann , Stephan Herminghaus , Karin Jacobs

We predict a strongest size for the contact strength when asperity radii of curvature decrease below ten nanometers. The reason for such strongest size is found to be correlated with the competition between the dislocation plasticity and…

材料科学 · 物理学 2016-11-04 Wei Guo , Zhao Wang , Ju Li