Different formulations of interfacial force have been adopted in phase-field-based lattice Boltzmann method for two-phase flows. Although they are identical mathematically, their numerical performances may be different due to truncation errors in the discretization. In this paper, four-type formulations of interfacial force available in the literature, namely stress tensor form (STF), chemical potential form (CPF), pressure form (PF) and continuum surface force (CSF) form, are compared and discussed. A series of benchmark problems, including stationary droplet, two merging droplets, Capillary wave, rising bubble and drop deformation in shear flow, are simulated. Numerical results show that CPF is a good choice for small surface deformation problems while STF is preferred for dynamical problems, both STF and CSF demonstrate good numerical stability.
Galilean invariance is a fundamental property; however, although the lattice Boltzmann equation itself is Galilean invariant, this property is usually not taken into account in the treatment of the fluid-solid interface. Here, we show that consideration of Galilean invariance in fluid-solid interfacial dynamics can greatly enhance the computational accuracy and robustness in a numerical simulation. Surprisingly, simulations are so vastly improved that the force fluctuation is very small and a time average becomes unnecessary.
Three-phase flows through a pore network of Berea sandstone are studied numerically under critical interfacial tension condition. Results show that the relative permeability of each fluid increases as its own saturation increases. The specific interfacial length between wetting and non-wetting fluids monotonously decreases with increasing the saturation of intermediate-wetting fluid, while the other two specific interfacial lengths exhibit a non-monotonous variation. As the wetting (non-wetting) fluid becomes less wetting (non-wetting), the relative permeability of wetting fluid monotonously i…
The lattice Boltzmann method (LBM) is routinely employed in the simulation of complex multiphase flows comprising bulk phases separated by non-ideal interfaces. LBM is intrinsically mesoscale with an hydro-dynamic equivalence popularly set by the Chapman-Enskog analysis, requiring that fields slowly vary in space and time. The latter assumptions become questionable close to interfaces, where the method is also known to be affected by spurious non hydrodynamical contributions. This calls for quantitative hydrodynamical checks. In this paper we analyze the hydrodynamic behaviour of LBM pseudo-po…
Three-dimensional melting problems are investigated numerically with Lattice Boltzmann method (LBM). Regarding algorithm's accuracy and stability, Multiple-Relaxation-Time (MRT) models are employed to simplify the collision term in LBM. Temperature and velocity fields are solved with double distribution functions, respectively. 3-D melting problems are solved with double MRT models for the first time in this article. The key point for the numerical simulation of a melting problem is the methods to obtain the location of the melting front and this article uses interfacial tracking method. The i…
The Lattice Boltzmann method has been gaining acceptance for hydrodynamic problems involving complex boundaries, non-equilibrium dynamics and interfacial phenomena in multiphase or multicomponent systems. lb2d.pm is a Perl module offering a clear framework for simple Lattice Boltzmann simulations in 2D. The syntax and some basic applications are presented. Mainly, the new version 0.1 enables solute transport and accounts for reactive boundaries leading to surface growth.
The Rayleigh-Taylor Instability (RTI) in compressible flow with inter-molecular interactions is probed via the Discrete Boltzmann Method (DBM). The effects of interfacial tension, viscosity and heat conduction are investigated. It is found that the influences of interfacial tension on the perturbation amplitude, bubble velocity, and two kinds of entropy production rates all show differences at different stages of RTI evolution. It inhibits the RTI evolution at the bubble acceleration stage, while at the asymptotic velocity stage, it first promotes and then inhibits the RTI evolution. Viscosity…
A novel lattice Boltzmann (LB) model for multiphase flows is developed that complies with the thermodynamic foundations of kinetic theory. By directly devising the collision term for LB equation at the discrete level, a self-tuning equation of state is achieved, which can be interpreted as the incorporation of short-range molecular interaction. A pairwise interaction force is introduced to mimic the long-range molecular interaction, which is responsible for interfacial dynamics. The derived pressure tensor is naturally consistent with thermodynamic theory, and surface tension and interface thi…
Simulation of multiphase flows require coupled capturing or tracking of the interfaces in conjunction with the solution of fluid motion often occurring at multiple scales. We will present unified cascaded LB methods based on central moments for the solution of the incompressible two-phase flows at high density ratios and for capturing of the interfacial dynamics. Based on a modified continuous Boltzmann equation (MCBE) for two-phase flows, where a kinetic transformation to the distribution function involving the pressure field is introduced to reduce the associated numerical stiffness at high …
In this paper, we theoretically prove a set of fundamental conditions pertaining discrete velocity sets and corresponding weights. These conditions provide sufficient conditions for a priori formulation of lattice Boltzmann models that automatically admit correct hydrodynamic moments up to any given N-th order.
The cascaded or central-moments-based lattice Boltzmann method (CM-LBM) is a robust alternative to the more conventional BGK-LBM for the simulation of high-Reynolds number flows. Unfortunately, its original formulation makes its extension to a broader range of physics quite difficult. To tackle this issue, a recent work [A. De Rosis, Phys. Rev. E 95, 013310 (2017)] proposed a more generic way to derive concise and efficient three-dimensional CM-LBMs. Knowing the original model also relies on central moments that are derived in an adhoc manner, i.e., by mimicking those of the Maxwell-Boltzmann …
In this paper, we extend a lattice Boltzmann equation (LBE) with continuous surface fore (CSF) to simulate thermocapillary flows. The model is designed on our previous CSF LBE for athermal two phase flow, in which the interfacial tension forces and the Marangoni stresses as the results of the interface interactions between different phases are described by a conception of CSF. In this model, the sharp interfaces between different phases are separated by a narrow transition layers, and the kinetics and morphology evolution of phase separation would be characterized by an order parameter visa Ca…
It is shown that the Shan-Chen (SC) model for non-ideal lattice fluids can be made compliant with a pseudo free-energy principle by simple addition of a gradient force, whose expression is uniquely specified in terms of the fluid density. This additional term is numerically shown to provide fairly negligible effects on the system evolution during phase-separation. To the best of our knowledge, these important properties of the SC model were not noted before. The approach developed in the present work is based on a continuum analysis: further extensions, more in line with a discrete lattice the…
We present an a priori derivation of the force scheme for lattice Boltzmann method based on kinetic theoretical formulation. We show that the discrete lattice effect, previously eliminated a posteriori in BGK collision model, is due to first-order space-time discretization and can be eliminated generically for a wide range of collision models with second-order space-time discretization. Particularly, the force scheme for the recently developed spectral multiple-relaxation-time (SMRT) collision model is obtained and numerically verified.
We present a further theoretical extension to the kinetic theory based formulation of the lattice Boltzmann method of Shan et al (2006). In addition to the higher order projection of the equilibrium distribution function and a sufficiently accurate Gauss-Hermite quadrature in the original formulation, a new regularization procedure is introduced in this paper. This procedure ensures a consistent order of accuracy control over the non-equilibrium contributions in the Galerkin sense. Using this formulation, we construct a specific lattice Boltzmann model that accurately incorporates up to the th…
The central framework of a filtered lattice Boltzmann collision operator formulation is to remove hydrodynamic moments that are not supported by the order of isotropy of a given lattice velocity set. Due to the natural moment orthogonality of the Hermite polynomials, the form of a filtered collision operator is obtained directly via truncation of the Hermite expansion. In this paper, we present an extension of the filtered collision operator formulation to enforce Galilean invariance. This is accomplished by representing hydrodynamic moments in the relative reference frame with respect to loca…
We propose a novel method for the direct numerical simulation of interfacial flows involving large density contrasts, using a Volume-of-Fluid method. We employ the conservative formulation of the incompressible Navier-Stokes equations for immiscible fluids in order to ensure consistency between the discrete transport of mass and momentum in both fluids. This strategy is implemented on a uniform 3D Cartesian grid with a staggered configuration of primitive variables, wherein a geometrical reconstruction based mass advection is carried out on a grid twice as fine as that for the momentum. The im…
We use a hybrid method of lattice Boltzmann and finite differences to simulate flat and curved interfaces between the nematic and isotropic phases of a liquid crystal described by the Landau-de Gennes theory. For the flat interface, we measure the interfacial velocity at different temperatures around the coexistence. We show that the interface is completely static at the coexistence temperature and that the profile width is in line with the theoretical predictions. The interface is stable in a range of temperatures around coexistence and disappears when one of the two phases becomes mechanical…
We present a two-way coupled fluid-structure interaction scheme for rigid bodies using a two-population lattice Boltzmann formulation for compressible flows. Arbitrary Lagrangian-Eulerian formulation of the discrete Boltzmann equation on body-fitted meshes is used in a combination with polynomial blending functions. The blending function approach localizes mesh deformation and allows treating multiple moving bodies with a minimal computational overhead. We validate the model with several test cases of vortex induced vibrations of single and tandem cylinders and show that it can accurately desc…
Particle stabilized emulsions are ubiquitous in the food and cosmetics industry, but our understanding of the influence of microscopic fluid-particle and particle-particle interactions on the macroscopic rheology is still limited. In this paper we present a simulation algorithm based on a multicomponent lattice Boltzmann model to describe the solvents combined with a molecular dynamics solver for the description of the solved particles. It is shown that the model allows a wide variation of fluid properties and arbitrary contact angles on the particle surfaces. We demonstrate its applicability …
We explore the Carlemann linearization of the collision term of the lattice Boltzmann formulation, as a first step towards formulating a quantum lattice Boltzmann algorithm. Specifically, we deal with the case of a single, incompressible fluid with the Bhatnagar Gross and Krook equilibrium function. Under this assumption, the error in the velocities is proportional to the square of the Mach number. Then, we showcase the Carlemann linearization technique for the system under study. We compute an upper bound to the number of variables as a function of the order of the Carlemann linearization. We…
In this paper, we demonstrate a set of fundamental conditions required for the formulation of a thermohydrodynamic lattice Boltzmann model at an arbitrary Prandtl number. A specific collision operator form is then proposed that is in compliance with these conditions. It admits two independent relaxation times, one for viscosity and another for thermal conductivity. But more importantly, the resulting thermohydrodynamic equations based on such a collision operator form is theoretically shown to remove the well known non-Galilean invariant artifact at non-unity Prandtl numbers in previous therma…
In the Bona-Masso formulation, Einstein equations are written as a set of flux conservative first order hyperbolic equations that resemble fluid dynamics equations. Based on this formulation, we construct a lattice Boltzmann model for Numerical Relativity. Our model is validated with well-established tests, showing good agreement with analytical solutions. Furthermore, we show that by increasing the relaxation time, we gain stability at the cost of losing accuracy, and by decreasing the lattice spacings while keeping a constant numerical diffusivity, the accuracy and stability of our simulatio…
Collisional effects are included in the path-integral formulation that was proposed in one of our previous paper for the collisionless Boltzmann gas. In calculating the number of molecules entering a six-dimensional phase volume element due to collisions, both the colliding molecules and the scattered molecules are allowed to have distributions; thus the calculation is done smoothly and no singularities arise.
A numerical method for simulating three-phase flows with moving contact lines on arbitrarily complex surfaces is developed in the framework of lattice Boltzmann method. In this method, the immiscible three-phase flow is modeled through a multiple-relaxation-time color-gradient model, which not only allows for a full range of interfacial tensions but also produces stable outcomes for a wide range of viscosity ratios. A characteristic line model is introduced to implement the wetting boundary condition, which is not only easy to implement but also able to handle arbitrarily complex boundaries wi…
The implementation of the kinetic diffuse boundary condition with the characteristic streaming-collision mechanism is studied for the high-order lattice Boltzmann (LB) models. The obtained formulation is also tested and validated numerically for three high-order LB models for both isothermal and thermal Couette flows. The streaming-collision mechanism ensures that high-order LB models can retain particle feature while go beyond the Navier-Stokes hydrodynamics.
In this article, we propose a generalized non-equilibrium chemical kinetics model from \textit{ab initio} simulation data obtained using accurate potential energy surfaces developed recently for the purpose of studying high-temperature air chemistry. First, we present a simple cross-section model for dissociation that captures recent \textit{ab initio} data accurately. The cross-section model is analytically integrated over Boltzmann distributions and general non-Boltzmann distributions to derive general non-equilibrium dissociation model. The general non-Boltzmann model systematically incorpo…
In this paper, a fractional step lattice Boltzmann method is proposed to model two-phase flows with large density differences by solving Cahn-Hilliard phase-field equation and the incompressible Navier-Stokes equations.In order to maintain a hyperbolic tangent property of the interface profile and conserve the volume, an interfacial profile correction term and a flux correction term are added into the original Cahn-Hilliard equation respectively. By using a fractional step scheme, the modified Cahn-Hilliard equation is split into two sub-equations. One is solved in the framework of lattice Bol…
An immersed interface-lattice Boltzmann method (II-LBM) is developed for modelling fluid-structure systems. The key element of this approach is the determination of the jump conditions that are satisfied by the distribution functions within the framework of the lattice Boltzmann method when forces are imposed along a surface immersed in an incompressible fluid. In this initial II-LBM, the discontinuity related to the normal portion of the interfacial force is sharply resolved by imposing the relevant jump conditions using an approach that is analogous to imposing the corresponding pressure jum…
The lattice Boltzmann method has become a standard technique for simulating a wide range of fluid flows. However, the intrinsic coupling of momentum and space discretization restricts the traditional lattice Boltzmann method to regular lattices. Alternative off-lattice Boltzmann schemes exist for both single- and multiphase flows that decouple the velocity discretization from the underlying spatial grid. The current study extends the applicability of these off-lattice methods by introducing a finite element formulation that enables simulating contact line dynamics for partially wetting fluids.…
In this paper, we aim to investigate the implementation of contact angles in the pseudopotential lattice Boltzmann modeling of wetting at a large density ratio. The pseudopotential lattice Boltzmann model [X. Shan and H. Chen, Phys. Rev. E 49, 2941 (1994)] is a popular mesoscopic model for simulating multiphase flows and interfacial dynamics. In this model, the contact angle is usually realized by a fluid-solid interaction. Two widely used fluid-solid interactions: the density-based interaction and the pseudopotential-based interaction, as well as a modified pseudopotential-based interaction f…
In this paper, the performance of two lattice Boltzmann method formulations for yield-stress (i.e. viscoplastic) fluids has been investigated. The first approach is based on the popular Papanastasiou regularisation of the fluid rheology in conjunction with explicit modification of the lattice Boltzmann relaxation rate. The second approach uses a locally-implicit formulation to simultaneously solve for the fluid stress and the underlying particle distribution functions. After investigating issues related to the lattice symmetry and non-hydrodynamic Burnett stresses, the two models were compared…
