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Phys. Rev. E 73, 066703 (2006) [5 pages]

Mesoscopic interparticle potentials in the lattice Boltzmann equation for multiphase fluids

R. S. Qin
CCLRC Daresbury Laboratory, Warrington WA4 4AD, United Kingdom
Received 6 December 2005; published 7 June 2006

I introduce a method to derive mesoscopic particle interactions by macroscopic thermodynamics, which is suitable for simulation of multiphase fluids by means of the lattice Boltzmann equation. For van der Waals fluids, the interaction possesses a high-density strong repulsive core and a low-density weak attractive tail, which looks like the Lennard-Jones potential with replacement of the distance between particles with mass density. Numerical results on phase separation show a droplet growth scheme rather than spinodal decomposition, and exhibit accurately the equilibrium phase diagram, a convincing interfacial energy property, and irreversible thermodynamics.

©2006 The American Physical Society

URL: http://link.aps.org/doi/10.1103/PhysRevE.73.066703
DOI: 10.1103/PhysRevE.73.066703
PACS: 47.11.-j; 02.70.Ns; 05.70.Ce
  • 47.11.-j
    Computational methods in fluid dynamics
  • 02.70.Ns
    Molecular dynamics and particle methods
  • 05.70.Ce
    Thermodynamic functions and equations of state
  • YEAR: 2006
KEYWORDS: Lennard-Jones potential, phase separation, spinodal decomposition, phase diagrams, surface energy, irreversible thermodynamics, Boltzmann equation, drops, flow simulation

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