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Modelling hydrodynamic lubrication is crucial in the design of engineering components as well as for a fundamental understanding of friction mechanisms. The cornerstone of thin-film flow modelling is the Reynolds equation -- a…

Fluid Dynamics · Physics 2022-03-08 Hannes Holey , Andrea Codrignani , Peter Gumbsch , Lars Pastewka

Using a coarse-grained bead-spring model of flexible polymer chains, the structure of a polymeric nanodroplet adsorbed on a chemically decorated flat wall is investigated by means of Molecular Dynamics simulation. We consider sessile drops…

Soft Condensed Matter · Physics 2009-11-10 J. Yaneva , A. Milchev , K. Binder

We study water between parallel metal walls under applied electric field accounting for the image effect at $T=298$ K. The electric field due to the surface charges serves to attract and orient nearby water molecules, while it tends to a…

Soft Condensed Matter · Physics 2015-07-24 Kyohei Takae , Akira Onuki

The fluid-mechanics community is currently divided in assessing the boundaries of applicability of the macroscopic approach to fluid mechanical problems. Can the dynamics of nano-droplets be described by the same macroscopic equations as…

Fluid Dynamics · Physics 2017-07-13 Alex V. Lukyanov , Tristan Pryer

Liquid has a significant effect on the flow of wet granular assemblies. We explore the effects of liquid induced cohesion on the flow characteristics of wet granular materials. We propose a cohesion-scaling approach that enables invariant…

Fluid Dynamics · Physics 2019-02-04 Ahmed Jarray , Vanessa Magnanimo , Stefan Luding

We consider the viscous incompressible fluids in a three-dimensional horizontally periodic domain bounded below by a fixed smooth boundary and above by a free moving surface. The fluid dynamics are governed by the Navier-Stokes equations…

Analysis of PDEs · Mathematics 2024-04-30 Xing Cheng , Yunrui Zheng

Cavitation, the formation of vapor bubbles in metastable liquids, is highly sensitive to nanoscale surface defects. Using molecular dynamics simulations and classical nucleation theory, we show that pure water confined within defect-free…

Soft Condensed Matter · Physics 2025-01-22 Marin Šako , Fabio Staniscia , Roland R. Netz , Emanuel Schneck , Matej Kanduč

The complicated dynamics of the contact line of a moving droplet on a solid substrate often hamper the efficient modeling of microfluidic systems. In particular, the selection of the effective boundary conditions, specifying the contact…

A molecular theory of the glass transition of network forming liquids is developed using a combination of self-consistent phonon and liquid state approaches. Both the dynamical transition and the entropy crisis characteristic of random…

Condensed Matter · Physics 2009-11-07 Randall W. Hall , Peter G. Wolynes

This article attempts to use the ideas from the field of complexity sciences to revisit the classical field of fluid mechanics. For almost a century, the mathematical self-consistency of Navier-Stokes equations has remained elusive to the…

Fluid Dynamics · Physics 2022-12-06 Saksham Sharma , Giulia Marcucci , Adnan Mahmud

Using molecular dynamics simulations, we reveal emergent properties of hydrated electrode interfaces that while molecular in origin are integral to the behavior of the system across long times scales and large length scales. Specifically,…

Materials Science · Physics 2015-05-20 David T. Limmer , Adam P. Willard

Numerical Simulations are employed to create amorphous nano-films of a chosen thickness on a crystalline substrate which induces strain on the film. The films are grown by a vapor deposition technique which was recently developed to create…

The interaction mechanisms of water with nanoscale geometries remain poorly understood. This study focuses on behaviour of water clusters under varying external electric fields with a particular focus on molecular ferroelectric devices. We…

We report a molecular dynamics simulation investigating the dynamics of a simple liquid in the proximity to a non-interacting smooth confining wall. A strong enhancement of the liquid diffusion is observed within the layers adjacent to the…

Materials Science · Physics 2024-12-06 Lorenzo Agosta , Mikhail Dzugutov , Wim Briels , Kersti Hermansson

Using molecular dynamics simulations, we study the motion of a closely fitting nanometer-size solid sphere in a fluid-filled cylindrical nanochannel at low Reynolds numbers and for a wide range of fluid-solid interactions corresponding to…

Soft Condensed Matter · Physics 2007-05-23 German Drazer , Boris Khusid , Joel Koplik , Andreas Acrivos

The low-energy theory for multi-wall carbon nanotubes including the long-ranged Coulomb interactions, internal screening effects, and single-electron hopping between graphite shells is derived and analyzed by bosonization methods.…

Strongly Correlated Electrons · Physics 2009-10-31 R. Egger

We study a moving boundary value problem consisting of a viscous incompressible fluid moving and interacting with a nonlinear elastic fluid shell. The fluid motion is governed by the Navier-Stokes equations, while the fluid shell is modeled…

Analysis of PDEs · Mathematics 2007-05-23 C. H. Arthur Cheng , Daniel Coutand , Steve Shkoller

We examine the dynamics of two coalescing liquid drops in the `inertial regime', where the effects of viscosity are negligible and the propagation of the bridge front connecting the drops can be considered as `local'. The solution fully…

Fluid Dynamics · Physics 2015-06-19 James E. Sprittles , Yulii D. Shikhmurzaev

We consider the incompressible flow of two immiscible fluids in the presence of a solid phase that undergoes changes in time due to precipitation and dissolution effects. Based on a seminal sharp interface model a phase field approach is…

Analysis of PDEs · Mathematics 2019-12-20 Christian Rohde , Lars von Wolff

We propose a multi-layer approach to simulate hyperpycnal and hypopycnal plumes in flows with free surface. The model allows to compute the vertical profile of the horizontal and the vertical components of the velocity of the fluid flow.…

Fluid Dynamics · Physics 2017-05-16 T. Morales de Luna , E. D. Fernández-Nieto , M. J. Castro Díaz