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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…

Fluid Dynamics · Physics 2022-05-17 Zixuan Wei , Mara Chiricotto , Joshua D. Elliott , Fausto Martelli , Paola Carbone

We perform systematic molecular dynamics simulations of water confined between two nanoscale plates at T=300 K. We investigate the effect of pressure (-0.15 GPa <= P <= 0.2 GPa) and plate separation (0.4 nm <= d <= 1.6 nm) on the phase…

Chemical Physics · Physics 2016-09-08 Nicolas Giovambattista , Peter J. Rossky , Pablo G. Debenedetti

A model for the formation of cavitation nuclei in liquids has recently been presented with basis in interfacial liquid tension at non-planar solid surfaces of concave form. In the present paper investigations of water-solid interfaces by…

Fluid Dynamics · Physics 2007-05-23 Niels Asger Mortensen , Anders Kuhle , Knud A. Morch

Soft nanoparticles hold promise as smart emulsifiers due to their high degree of deformability, permeability and stimuli responsive properties. By means of large-scale simulations we investigate the structural properties of nanogels at…

Soft Condensed Matter · Physics 2019-11-18 Daniel J. Arismendi-Arrieta , Angel J. Moreno

Direct Numerical Simulations of two superposed fluids in a channel with a textured surface on the lower wall have been carried out. A parametric study varying the viscosity ratio between the two fluids has been performed to mimic both {\bf…

Fluid Dynamics · Physics 2019-05-22 I. Arenas , E. Garcia , M. K. Fu , P. Orlandi , M. Hultmark , S. Leonardi

We investigate through non-equilibrium Molecular Dynamics simulations the structure and flow of fluids in functionalized nanopores. The nanopores are modeled as cylindrical structures with solvophilic and solvophobic sites. Two fluids are…

Soft Condensed Matter · Physics 2016-05-17 José Rafael Bordin , Marcia C. Barbosa

The formation and entrapment of gas bubbles during solidification significantly influence the microstructure and mechanical properties of materials, from metallic alloys to ice. While gas segregation at the solidification front is…

Soft Condensed Matter · Physics 2026-04-14 Bastien Isabella , Cécile Monteux , Sylvain Deville

We study the role of surface topology, surface chemistry, and wall superheat temperature on the onset of boiling, bubble nucleation and growth, and the possible formation of an insulating vapour film by means of large-scale MD simulations.…

Soft Condensed Matter · Physics 2020-07-10 Armin Shahmardi , Outi Tammisola , Mauro Chinappi , Luca Brandt

Superhydrophobic surfaces play an important role in the development of new product coatings such as cars, but also in mechanical engineering, especially design of turbines and compressors. Thus a vital part of the design of these surfaces…

The motion of three-phase contact lines is one of the most relevant research topics of micro- and nano-fluidics. According to many hydrodynamic and molecular models, the dynamics of contact lines is assumed overdamped and dominated by…

Fluid Dynamics · Physics 2022-09-29 Michele Pellegrino , Berk Hess

We show that phase separation can occur in a one-component liquid outside its coexistence curve (CX) with addition of a small amount of a solute. The solute concentration at the transition decreases with increasing the difference of the…

Soft Condensed Matter · Physics 2015-06-01 Ryuichi Okamoto , Akira Onuki

We apply specular and off-specular neutron reflection at the hydrophobic silicon/water interface to check for evidence of nanoscopic air bubbles whose presence is claimed after an ad hoc procedure of solvent exchange. Nanobubbles and/or a…

Soft Condensed Matter · Physics 2017-10-13 Philipp Gutfreund , Marco Maccarini , Andrew Dennison , Max Wolff

We investigate the interfacial dynamics involved in the impact of a droplet on a liquid-liquid system, which involves the impingement of an immiscible core liquid drop from a vertical separation onto an interfacial shell liquid layer…

Fluid Dynamics · Physics 2024-08-20 Akash Chowdhury , Sirshendu Misra , Sushanta K. Mitra

The physics of dynamic friction on water molecule contaminated surfaces is still poorly understood. In line with the growing interest in hydrophobic contact for industrial applications, this paper focuses on friction mechanisms in such…

Soft Condensed Matter · Physics 2022-06-24 Olivier Noël , Pierre-Emmanuel Mazeran , Igor Stanković

We investigate bubble dynamics in a holographic superfluid undergoing a first-order phase transition with spontaneous $U(1)$ symmetry breaking. Near the nucleation threshold, the system exhibits universal critical behavior governed by a…

High Energy Physics - Theory · Physics 2026-04-21 Zhen-han Jin , Yu-ping An , Li Li

We explore the structural properties of anomalous fluids confined in a nanopore using Molecular Dynamics simulations. The fluid is modeled by core-softened (CS) potentials that have a repulsive shoulder and an attractive well at a further…

Soft Condensed Matter · Physics 2014-10-22 Leandro B. Krott , José Rafael Bordin , Marcia Barbosa

Confined glasses and their anomalous interfacial rheology raise important questions in fundamental research and numerous practical applications. In this Letter, we study the influence of interfacial air nanobubbles on the free surface of…

Soft Condensed Matter · Physics 2020-11-04 Shuai Ren , Christian Pedersen , Andreas Carlson , Thomas Salez , Yuliang Wang

Capillary forces guide the motion of biomolecular condensates, water-borne insects, and breakfast cereal. These surface-mediated interactions can be harnessed to build units into materials with exotic properties deriving from mesoscale…

Soft Condensed Matter · Physics 2025-07-22 Anshu Thapa , Robert Malinowski , Matthew O. Blunt , Giorgio Volpe , Joe Forth

In the field of nanoconfined fluids, there are striking examples of deformation/transport coupling in which mechanical solicitation of the confining host and dynamics of the confined fluid impact each other. While this intriguing behavior…

Computational Physics · Physics 2024-04-01 Alexander Schlaich , Matthieu Vandamme , Marie Plazanet , Benoit Coasne

The influence of the external pressure and surface energy on the wetting transition at nanotextured interfaces is studied using molecular dynamics and continuum simulations. The surface roughness of the composite interface is introduced via…

Soft Condensed Matter · Physics 2018-07-12 Bishal Bhattarai , Nikolai V. Priezjev
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