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In this paper a generalization of the Cahn-Hilliard theory of binary liquids is presented for multi-component incompressible liquid mixtures. First, a thermodynamically consistent convection-diffusion type dynamics is derived on the basis…

Materials Science · Physics 2016-02-03 Gyula I. Toth , Mojdeh Zarifi , Bjorn Kvamme

We present a loosely coupled approach for the solution of fluid-structure interaction problems between a compressible flow and a deformable structure. The method is based on staggered Dirichlet-Neumann partitioning. The interface motion in…

We investigate the structural properties of liquid water at near ambient conditions using first-principles molecular dynamics simulations based on a semilocal density functional augmented with nonlocal van der Waals interactions. The…

Soft Condensed Matter · Physics 2016-08-01 Giacomo Miceli , Stefano de Gironcoli , Alfredo Pasquarello

Understanding what happens inside the rippling and dancing surface of a liquid remains one of the great challenges of fluid dynamics. Using molecular dynamics (MD) we can pick apart the interface structure and understand surface tension. In…

Computational Physics · Physics 2020-10-28 Edward R. Smith , Carlos Braga

Boundary conditions at the interface between the free-flow region and the adjacent porous medium is a key issue for physically consistent modeling and accurate numerical simulation of flow and transport processes in coupled systems due to…

Numerical Analysis · Mathematics 2020-06-23 Elissa Eggenweiler , Iryna Rybak

In the present work, a general formulation is proposed to implement the contact angle boundary conditions for the second-order Phase-Field models, which is applicable to $N$-phase $(N \geqslant 2)$ moving contact line problems. To remedy…

Fluid Dynamics · Physics 2022-09-27 Ziyang Huang , Guang Lin , Arezoo M. Ardekani

A van der Waals (vdW) density functional was implemented in the mixed basis approach previously developed for studying two dimensional systems, in which the vdW interaction plays an important role. The basis functions here are taken to be…

Computational Physics · Physics 2017-12-27 Chung-Yuan Ren , Yia-Chung Chang , Chen-Shiung Hsue

Numerical simulations of systems at coexistence are known to yield unstable fields in some regions of the density parameters, as well as inequivalence of ensembles. The Van der Waals-like loops are attributed to effects of the interface…

Statistical Mechanics · Physics 2021-04-30 Jozismar Rodrigues Alves , Vera Bohomoletz Henriques

Interface equations are derived for both binary diffusive and binary fluid systems subjected to non-equilibrium conditions, starting from the coarse-grained (mesoscopic) models. The equations are used to describe thermo-capillary motion of…

Soft Condensed Matter · Physics 2015-06-25 Ravi Bhagavatula , David Jasnow , Takao Ohta

A diffuse interface (phase field) model for an electrochemical system is developed. We describe the minimal set of components needed to model an electrochemical interface and present a variational derivation of the governing equations. With…

Materials Science · Physics 2007-05-23 J. E. Guyer , W. J. Boettinger , J. A. Warren , G. B. McFadden

This paper investigates a variational approach to viscous flows with contact line dynamics based on energy-dissipation modeling. The corresponding model is reduced to a thin-film equation and its variational structure is also constructed…

Fluid Dynamics · Physics 2018-11-21 Dirk Peschka

We introduce a diffuse-interface Landau-de Gennes free energy for nematic liquid crystals (NLC) systems, with free boundaries, in three dimensions submerged in isotropic liquid, and a phase field is introduced to model the deformable…

Analysis of PDEs · Mathematics 2025-09-23 Dawei Wu , Baoming Shi , Yucen Han , Pingwen Zhang , Apala Majumdar , Lei Zhang

We present an hybrid VOF/embedded boundary method allowing to model two-phase flows in presence of solids with arbitrary shapes. The method relies on the coupling of existing methods: a geometric Volume of fluid (VOF) method to tackle the…

In this paper, we present a novel approach to model the fluid/solid interaction forces in a direct solver of the Navier-Stokes equations based on the volume of fluid interface tracking method. The key ingredient of the model is the explicit…

Fluid Dynamics · Physics 2015-06-16 Kyle Mahady , Shahriar Afkhami , Lou Kondic

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

The ``no-slip'' boundary condition, i.e., zero fluid velocity relative to the solid at the fluid-solid interface, has been very successful in describing many macroscopic flows. A problem of principle arises when the no-slip boundary…

Soft Condensed Matter · Physics 2007-05-23 Tiezheng Qian , Xiao-Ping Wang , Ping Sheng

Using a fixed Eulerian mesh, the phase-field method has been successfully utilized for a broad range of moving boundary problems involving multiphase fluids and single-phase fluid-structure interaction. Nevertheless, multiphase fluids…

Fluid Dynamics · Physics 2024-02-19 Xiaoyu Mao , Rajeev Jaiman

In this paper, we propose an improved phase field model for interface capturing in simulating two-phase incompressible flows. The model incorporates a second-order diffusion term, which utilizes a nonlinear coefficient to assess the degree…

Fluid Dynamics · Physics 2025-01-20 Jing-Wei Chen , Chun-Yu Zhang , Hao-Ran Liu , Hang Ding

A multispecies diffuse interface model is formulated in a fluctuating hydrodynamics framework for the purpose of simulating surfactant interfaces at the nanoscale. The model generalizes previous work to ternary mixtures, employing a…

Fluid Dynamics · Physics 2025-08-26 John B. Bell , Andrew Nonaka , Alejandro L. Garcia

Filaments are ubiquitous within the microscopic world. They occur frequently in both biological and industrial environments and display varied and rich dynamics. Their wide range of applications has spurred the development of a special…

Fluid Dynamics · Physics 2023-03-31 Lyndon Koens , Benjamin J. Walker