Related Experiment Video
Updated: Aug 2, 2025

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
Published on: April 12, 2019
Improved partially saturated method for the lattice Boltzmann pseudopotential multicomponent flows
Gang Wang1, Umberto D'Ortona1, Pierrette Guichardon1
1Aix-Marseille Univ., CNRS, Centrale Marseille, M2P2 Marseille, France.
Abstract:
This paper extends the partially saturated method (PSM), used for curved or complex walls, to the lattice Boltzmann (LB) pseudopotential multicomponent model and adapts the wetting boundary condition to model the contact angle. The pseudopotential model is widely used for various complex flow simulations due to its simplicity. To simulate the wetting phenomenon within this model, the mesoscopic interaction force between the boundary fluid and solid nodes is used to mimic the microscopic adhesive force between the fluid and the solid wall, and the bounce-back (BB) method is normally adopted to achieve the no-slip boundary condition. In this paper, the pseudopotential interaction forces are computed with eighth-order isotropy since fourth-order isotropy leads to the condensation of the dissolved component on curved walls. Due to the staircase approximation of curved walls in the BB method, the contact angle is sensitive to the shape of corners on curved walls. Furthermore, the staircase approximation makes the movement of the wetting droplet on curved walls not smooth. To solve this problem, the curved boundary method may be used, but due to the interpolation or extrapolation process, most curved boundary conditions suffer from massive mass leakage when applied to the LB pseudopotential model. Through three test cases, it is found that the improved PSM scheme is mass conservative, that nearly identical static contact angles are observed on flat and curved walls under the same wetting condition, and that the movement of a wetting droplet on curved and inclined walls is smoother compared to the usual BB method. The present method is expected to be a promising tool for modeling flows in porous media and in microfluidic channels.
More Related Videos
12:11Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
Published on: April 8, 2020
10:36Author Spotlight: Optimization of Airflow Velocities in Battery Cooling Systems for Enhanced Thermal Performance and Reduced Energy Consumption
Published on: November 3, 2023
Related Concept Videos
Laminar and Turbulent Flow
Thermodynamic Potentials
Plane Potential Flows
Uniform...
Van der Waals Equation
First, the attractive forces between molecules, which are stronger at higher densities and reduce the pressure, are considered by adding to the pressure a term equal to the square of the molar density multiplied by a positive coefficient a. Second, the volume...
Magnetostatic Boundary Conditions
The Power Flow Problem and Solution