Phase-field modeling droplet dynamics with soluble surfactants

Using lattice Boltzmann approach, a phase-field model is proposed for simulating droplet motion with soluble surfactants. The model can recover the Langmuir and Frumkin adsorption isotherms in equilibrium. From the equilibrium equation of state, we can determine the interfacial tension lowering scale according to the interface surfactant concentration. The model is able to capture short-time and long-time adsorption dynamics of surfactants. We apply the model to examine the effect of soluble surfactants on droplet deformation, breakup and coalescence. The increase of surfactant concentration and attractive lateral interaction can enhance droplet deformation, promote droplet breakup, and inhibit droplet coalescence. We also demonstrate that the Marangoni stresses can reduce the interface mobility and slow down the film drainage process, thus acting as an additional repulsive force to prevent the droplet coalescence

Interfacial dynamics with soluble surfactants: A phase-field two-phase flow model with variable densities

 In this work, we present a hydrodynamics coupled phase-field surfactant model with variable densities. Two scalar auxiliary variables are introduced to transform the original free energy functional into an equivalent form, and then a new thermodynamically consistent model can be obtained. In this model, evolutions of two phase-field variables are described by two Cahn-Hilliard-type equations, and the fluid flow is dominated by incompressible Navier-Stokes equation. The finite difference method on staggered grid is used to solve the above model. Then a classical droplet rising case and a droplet merging case are used to validate our model. Finally, we study the effect of surfactants on droplet deformation and merging. A more prolate profile of droplet is observed under a higher surfactant bulk concentration, which verifies the effect of surfactant in reducing the interfacial tension. Increases in surface Peclet number and initial surfactant bulk concentration can enhance the non-uniformity of surfactant distribution around the interface, which will arise the Marangoni force. The Marangoni force acts as an additional repulsive force to delay the droplet merging.Cited as: Zhu, G., Li, A. Interfacial dynamics with soluble surfactants: A phase-field two-phase flow model with variable densities. Advances in Geo-Energy Research, 2020, 4(1): 86-98, doi: 10.26804/ager.2020.01.0

Numerical approximation of a phase-field surfactant model with fluid flow

Modelling interfacial dynamics with soluble surfactants in a multiphase system is a challenging task. Here, we consider the numerical approximation of a phase-field surfactant model with fluid flow. The nonlinearly coupled model consists of two Cahn-Hilliard-type equations and incompressible Navier-Stokes equation. With the introduction of two auxiliary variables, the governing system is transformed into an equivalent form, which allows the nonlinear potentials to be treated efficiently and semi-explicitly. By certain subtle explicit-implicit treatments to stress and convective terms, we construct first and second-order time marching schemes, which are extremely efficient and easy-to-implement, for the transformed governing system. At each time step, the schemes involve solving only a sequence of linear elliptic equations, and computations of phase-field variables, velocity and pressure are fully decoupled. We further establish a rigorous proof of unconditional energy stability for the first-order scheme. Numerical results in both two and three dimensions are obtained, which demonstrate that the proposed schemes are accurate, efficient and unconditionally energy stable. Using our schemes, we investigate the effect of surfactants on droplet deformation and collision under a shear flow, where the increase of surfactant concentration can enhance droplet deformation and inhibit droplet coalescence

Phase field modelling of surfactants in multi-phase flow

A diffuse interface model for surfactants in multi-phase flow with three or more fluids is derived. A system of Cahn-Hilliard equations is coupled with a Navier-Stokes system and an advection-diffusion equation for the surfactant ensuring thermodynamic consistency. By an asymptotic analysis the model can be related to a moving boundary problem in the sharp interface limit, which is derived from first principles. Results from numerical simulations support the theoretical findings. The main novelties are centred around the conditions in the triple junctions where three fluids meet. Specifically the case of local chemical equilibrium with respect to the surfactant is considered, which allows for interfacial surfactant flow through the triple junctions