Related Experiment Video
Updated: Aug 28, 2025

An Analog Macroscopic Technique for Studying Molecular Hydrodynamic Processes in Dense Gases and Liquids
Published on: December 4, 2017
Free-Energy-Based Discrete Unified Gas Kinetic Scheme for van der Waals Fluid.
Zeren Yang1, Sha Liu1,2, Congshan Zhuo1,2
1School of Aeronautics, Northwestern Polytechnical University, Xi'an 710072, China.
A new well-balanced free-energy model resolves force imbalance issues in discrete unified gas-kinetic schemes (DUGKS) for multiphase flow simulations. While effective for steady states, further improvements are needed for transient flow stability.
Area of Science:
- Computational Fluid Dynamics
- Multiphase Flow Modeling
- Free-Energy Theory
Background:
- The free-energy model is a robust approach for multiphase flow simulations.
- Discrete Unified Gas-Kinetic Scheme (DUGKS) offers efficient implementation.
- Integrating free-energy models into DUGKS presents challenges.
Purpose of the Study:
- Identify limitations of applying classical lattice Boltzmann free-energy models to DUGKS.
- Develop a well-balanced free-energy model for DUGKS to overcome identified hindrances.
- Validate the performance and stability of the improved DUGKS for multiphase flows.
Main Methods:
- Introduced classical lattice Boltzmann free-energy model into DUGKS with various flux reconstruction schemes.
- Developed and coupled a well-balanced free-energy model with DUGKS.
- Validated the model using coexisting density curves, Laplace's law, quiescent droplet tests, spinodal decomposition, and droplet coalescence.
Main Results:
- Force imbalance amplified by reconstruction errors hinders direct free-energy model application in DUGKS.
- The well-balanced free-energy model effectively removes amplified force imbalance influences.
- Consistent performance across different reconstruction schemes was observed for steady-state multiphase flows.
- Spurious currents were reduced to machine accuracy (10-15) in quiescent droplet tests.
- Stability issues were identified in transient flow simulations like spinodal decomposition and droplet coalescence.
Conclusions:
- The well-balanced free-energy model significantly enhances DUGKS for steady-state multiphase flow simulations.
- The improved DUGKS demonstrates high accuracy and minimal spurious currents.
- Further research is necessary to address the stability limitations of the current model in transient flow scenarios.
More Related Videos
10:52Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
Published on: April 12, 2019
06:37Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
Published on: September 17, 2021
Related Concept Videos
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...
Real Gases: Effects of Intermolecular Forces and Molecular Volume Deriving Van der Waals Equation
Kinetic Theory of an Ideal Gas
The number of molecules in one mole is called...
Kinetic Molecular Theory: Molecular Velocities, Temperature, and Kinetic Energy
Molecular Kinetic Energy
Basic Postulates of Kinetic Molecular Theory: Particle Size, Energy, and Collision