Chemical-potential-based lattice Boltzmann method for nonideal fluids

Phys Rev E. 2017 Jun;95(6-1):063305. doi: 10.1103/PhysRevE.95.063305. Epub 2017 Jun 13.

Abstract

Chemical potential, as an important thermodynamic quantity, has been popularly used in thermodynamic modeling for complex systems, especially for those involving the phase transitions and chemical reactions. Here we present a chemical-potential-based multiphase lattice Boltzmann model, in which the nonideal force is directly evaluated by a chemical potential. The numerical computation is more efficient than the pressure-tensor-based model [Wen et al. Europhys. Lett. 112, 44002 (2015)10.1209/0295-5075/112/44002] because the calculations of the pressure tensor and its divergence are avoided. We have derived several chemical potentials of the popular equations of state from the free-energy density function. The theoretical analyses and numerical results support that the present model satisfies thermodynamics and Galilean invariance. An effective chemical-potential boundary condition is also implemented to investigate the wettability of a solid surface, and the contact angle can be linearly tuned by the surface chemical potential.