The pseudopotential method is one of the most popular extensions of the lattice Boltzmann method (LBM) for phase change and multiphase flow simulation. One attractive feature of the original proposed method consists on its simplicity of adding a force dependent on a nearest-neighbor potential function, which became known as the Shan-Chen interaction force. Some of the well known drawbacks implied by this method involves lack of thermodynamic consistency and impossibility to control the surface tension independently. In order to correct these deficiencies, different approaches were developed in the literature, such as multirange interactions potential, which involves larger stencils than nearest-neighbor approach, and modified forcing schemes. In this work, a strategy is developed to control the liquid-gas density ratio and the surface tension by means of an appropriate interaction force field using only nearest-neighbor interactions. The proposed procedure is devised starting from the desired pressure tensor, which allow for the control of the equilibrium multiphase properties such as liquid-gas coexistence curve and surface tension. Then, it is shown how to derive an external force field able to replicate the effects of this pressure tensor in the macroscopic conservation equations. The final step of our procedure is implementing this external force in the LBE by using the classical Guo forcing scheme. Numerical tests regarding static and dynamic flow conditions were performed. Results obtained from simulations showed good agreement with expected analytical values. Most divergent solution observed was the droplet oscillation period under certain flow conditions, which deviated 9% from expected analytical result. The observed results corroborate that the proposed method is able to replicate the desired macroscopic multiphase behaviour.
In this work, a third-order Chapman-Enskog analysis of the multiple-relaxation-time (MRT) pseudopotential lattice Boltzmann (LB) model for multiphase flow is performed for the first time. The leading terms on the interaction force, consisting of an anisotropic and an isotropic term, are successfully identified in the third-order macroscopic equation recovered by the lattice Boltzmann equation (LBE), and then new mathematical insights into the pseudopotential LB model are provided. For the third-order anisotropic term, numerical tests show that it can cause the stationary droplet to become out-…
The hyperbolic tangent function is usually used as a reliable approximation of the equilibrium density distributions of a system with phase transitions. However, analyzing the accuracies of the numerical derivatives, we find that its numerical derivatives computed by central difference method (CDM) may deviate significantly from its analytical solutions, while those computed by high-order difference method (HDM) can agree very well. Therefore, we introduce HDM to evaluate the interparticle interactions instead of popular CDM, and propose a pseudopotential multiphase lattice Boltzmann model bas…
The pseudopotential lattice Boltzmann (LB) model is a popular model in the LB community for simulating multiphase flows. Recently, several thermal LB models, which are based on the pseudopotential LB model and constructed within the framework of the double-distribution-function LB method, were proposed to simulate thermal multiphase flows [G. Házi and A. Márkus, Phys. Rev. E 77, 026305 (2008); L. Biferale et al., Phys. Rev. Lett. 108, 104502 (2012); S. Gong and P. Cheng, Int. J. Heat Mass Transfer 55, 4923 (2012)]. The objective of the present paper is to show that the effect of the forcing te…
We generalize to three dimensions (3D) a recently developed improved multi-component pseudopotential lattice Boltzmann method and analyze its applicability to simulate flows through realistic porous media. The model is validated and characterized via benchmarks, and we investigate its performance by simulating the displacement of immiscible fluids in 3D geometries. Two samples are considered, namely, a pack of spheres obtained numerically, and a Bentheimer sandstone rock sample obtained experimentally. We show that, with this model it is possible to simulate realistic viscosity ratios, to tune…
The pseudopotential multiphase lattice Boltzmann (LB) model is a very popular model in the LB community for simulating multiphase flows. When the multiphase modeling involves a solid boundary, a numerical scheme is required to simulate the contact angle at the solid boundary. In this work, we aim at investigating the implementation of contact angles in the pseudopotential LB simulations with curved boundaries. In the pseudopotential LB model, the contact angle is usually realized by employing a solid-fluid interaction or specifying a constant virtual wall density. However, it is shown that the…
Owing to its conceptual simplicity and computational efficiency, the pseudopotential multiphase lattice Boltzmann (LB) model has attracted significant attention since its emergence. In this work, we aim to extend the pseudopotential LB model to simulate multiphase flows at large density ratio and relatively high Reynolds number. First, based on our recent work [Li et al., Phys. Rev. E. 86, 016709 (2012)], an improved forcing scheme is proposed for the multiple-relaxation-time pseudopotential LB model in order to achieve thermodynamic consistency and large density ratio in the model. Next, thro…
The implementation of boundary conditions is among the most challenging parts of modeling fluid flow through channels and complex media. Here, we show that the existing methods to deal with liquid-wall interactions using multicomponent Lattice Boltzmann are accurate when the wall is aligned with the main axes of the lattice but fail otherwise. To solve this problem, we extend a strategy previously developed for multiphase models. As an example, we study the coalescence of two droplets on a curved surface in two dimensions. The strategy proposed here is of special relevance for binary flows in …
In this paper, we aim to address an important issue about the pseudopotential lattice Boltzmann (LB) model, which has attracted much attention as a mesoscopic model for simulating interfacial dynamics of complex fluids, but suffers from the problem that the surface tension cannot be tuned independently of the density ratio. In the literature, a multi-range potential was devised to adjust the surface tension [Sbragaglia et al., Phys. Rev. E 75, 026702 (2007)]. However, it was recently found that the density ratio of the system will be changed when the multi-range potential is employed to adjust…
Numerical Simulation of Oscillating Multiphase Heat Transfer in Parallel plates using Pseudopotential Multiple-Relaxation-Time Lattice Boltzmann Method
Immiscible fluid displacement in porous media occurs in several natural and industrial processes. For example, during petroleum extraction from porous rock reservoirs, water is used to displace oil. In this paper, we investigate primary drainage and imbibition in a heterogeneous porous medium using an improved numerical model based on the multicomponent pseudopotential lattice Boltzmann method. We apply recent developments from the literature and develop new pressure boundary conditions. We show that the proposed model is able to simulate realistic viscosity ratios, and it allows independent t…
Boiling is a complex phenomenon where different non-linear physical interactions take place and for which the quantitative modeling of the mechanism involved is not fully developed yet. In the last years, many works have been published focusing on the numerical analysis of this problem. However, a lack of numerical works assessing quantitatively the sensitivity of these numerical simulations to grid parameters can be identified, especially for the Lattice Boltzmann method (LBM). The main goal of this work is to propose a mesh refinement methodology for simulating phase-change heat transfer pro…
The performances of the Color-Gradient (CG) and of the Shan-Chen (SC) multicomponent Lattice Boltzmann models are quantitatively compared side-by-side on multiple physical flow problems where breakup, coalescence and contraction of fluid ligaments are important. The flow problems are relevant to microfluidic applications, jetting of microdroplets as seen in inkjet printing, as well as emulsion dynamics. A significantly wider range of parameters is shown to be accessible for CG in terms of density-ratio, viscosity-ratio and surface tension values. Numerical stability for a high density ratio $\…
We present a diffusion dominated evaporation model using the popular pseudopotential multicomponent lattice Boltzmann method introduced by Shan and Chen. With an analytical computation of the diffusion coefficients, we demonstrate that Fick's law is obeyed. We then validate the applicability of our model by demonstrating the agreement of the time evolution of the interface position of an evaporating planar film to the analytical prediction. Furthermore, we study the evaporation of a freely floating droplet and confirm that the effect of Laplace pressure is significant for predicting the time e…
The existing lattice Boltzmann models for incompressible multiphase flows are mostly constructed with two distribution functions, one is the order parameter distribution function, which is used to track the interface between different phases, and the other is the pressure distribution function for solving the velocity field. In this brief report, it is shown that in these models the recovered momentum equation is inconsistent with the target one: an additional interfacial force is included in the recovered momentum equation. The effects of the additional force are investigated by numerical sim…
In the classical multiple-relaxation-time (MRT) lattice Boltzmann (LB) method, the transformation matrix is formed by constructing a set of orthogonal basis vectors. In this paper, a theoretical and numerical study is performed to investigate the capability and efficiency of a non-orthogonal MRT-LB model for simulating multiphase flows. First, a three-dimensional non-orthogonal MRT-LB is proposed. A non-orthogonal MRT collision operator is devised based on a set of non-orthogonal basis vectors, through which the transformation matrix and its inverse matrix are considerably simplified as compar…
Implicit-solvent models are widely used to study the electrostatics in dissolved biomolecules, which are parameterized using force fields. Standard force fields treat the charge distribution with point charges, however, other force fields have emerged which offer a more realistic description by considering polarizability. In this work, we present the implementation of the polarizable and multipolar force field AMOEBA, in the boundary integral Poisson-Boltzmann solver \texttt{PyGBe}. Previous work from other researchers coupled AMOEBA with the finite-difference solver APBS, and found difficulti…
In the gas kinetic theory, it showed that the zeroth order of the density distribution function $f^{(0)}$ and local equilibrium density distribution function were the Maxwellian distribution $f^{(eq)}(ρ,\emph{\textbf{u}}, T)$ with an external force term, where $ρ$ the fluid density, $\emph{\textbf{u}}$ the physical velocity and $T$ the temperature, while in the lattice Boltzmann equation (LBE) method numerous force treatments were proposed with a discrete density distribution function $f_i$ apparently relaxed to a given state $f^{(eq)}_i(ρ,\emph{\textbf{u}}^*)$, where the given velocity $\emph…
We develop a multicomponent lattice Boltzmann (LB) model for the 2D Rayleigh--Taylor turbulence with a Shan-Chen pseudopotential implemented on GPUs. In the immiscible case this method is able to accurately overcome the inherent numerical complexity caused by the complicated structure of the interface that appears in the fully developed turbulent regime. Accuracy of the LB model is tested both for early and late stages of instability. For the developed turbulent motion we analyze the balance between different terms describing variations of the kinetic and potential energies. Then, we analyze t…
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.
Several applications exist in which lattice Boltzmann methods (LBM) are used to compute stationary states of fluid motions, particularly those driven or modulated by external forces. Standard LBM, being explicit time-marching in nature, requires a long time to attain steady state convergence, particularly at low Mach numbers due to the disparity in characteristic speeds of propagation of different quantities. In this paper, we present a preconditioned generalized lattice Boltzmann equation (GLBE) with forcing term to accelerate steady state convergence to flows driven by external forces. The u…
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 …
In this paper, two different approaches fluid forces computation approaches are compared in the frame of Volume Penalization - Lattice Boltzmann Method (VP-LBM). The first method, the momentum exchange method, uses the variation of the distribution functions near the fluid solid interface, while the second one, the stress integration method, allows direct integration of fluid forces onto this interface. Applied to the VP-LBM, which consists in penalizing the solid in the LBM, these two methods lead to significantly different results. The tests are performed to study on one hand the lift and dr…
Pool boiling characteristics in two computational domains with and without considering conjugate heat transfer (CHT) were numerically simulated by an improved hybrid pseudopotential phase-change lattice Boltzmann method (LBM). The effects of constant temperature boundary condition (BC) with nucleate spots and fluctuant temperature on the boiling process were investigated in detail. It was found that for the computational domain without CHT, the treatment of constant temperature BC with nucleate spots is quite easier to produce film boiling than the temperature BC with small fluctuation. Howeve…
In the work of N. Martys et al. [Nicos S. Martys, Xiaowen Shan, Hudong Chen, Phys. Rev. E, Vol. 58, Num.5, 1998 ], a self-consistent force term to any order in the Boltzmann-BKG equation is derived by the Hermite basis with raw velocity. As an extension, in the present work, the force term is expanded by the Hermite basis with the relative velocity in the comoving coordinate and the Hermite basis with the relative velocity scaled by the local temperature. It is found that the force scheme proposed by He et al. [Xiaoyi He, Xiaowen Shan, Gary D. Doolen, Phys. Rev. E, Vol. 57, Num.1,1998] can be …
A unified framework to derive discrete time-marching schemes for coupling of immersed solid and elastic objects to the lattice Boltzmann method is presented. Based on operator splitting for the discrete Boltzmann equation, second-order time-accurate schemes for the immersed boundary method, viscous force coupling and external boundary force are derived. Furthermore, a modified formulation of the external boundary force is introduced that leads to a more accurate no-slip boundary condition. The derivation also reveals that the coupling methods can be cast into a unified form, and that the immer…
We studied turbulence induced by the Rayleigh-Taylor (RT) instability for 2D immiscible two-component flows by using a multicomponent lattice Boltzmann method with a Shan-Chen pseudopotential implemented on GPUs. We compare our results with the extension to the 2D case of the phenomenological theory for immiscible 3D RT studied by Chertkov and collaborators ({\it Physical Review E 71, 055301, 2005}). Furthermore, we compared the growth of the mixing layer, typical velocity, average density profiles and enstrophy with the equivalent case but for miscible two-component fluid. Both in the miscibl…
Current multi-component, multiphase pseudo-potential lattice Boltzmann models have thermodynamic inconsistencies that prevent them to correctly predict the thermodynamic phase behavior of partially miscible multi-component mixtures, such as hydrocarbon mixtures. This paper identifies these inconsistencies and attempts to design a thermodynamically consistent multi-component, multiphase pseudo-potential lattice Boltzmann model that allows mass transfer across the phase interfaces and is capable to predict the phase behavior of typically partially miscible hydrocarbon mixtures. The designed mode…
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…
A hybrid thermal lattice Boltzmann (LB) model is presented to simulate thermal multiphase flows with phase change based on an improved pseudopotential LB approach [Q. Li, K. H. Luo, and X. J. Li, Phys. Rev. E 87, 053301 (2013)]. The present model does not suffer from the spurious term caused by the forcing-term effect, which was encountered in some previous thermal LB models for liquid-vapor phase change. Using the model, the liquid-vapor boiling process is simulated. The boiling curve together with the three boiling stages (nucleate boiling, transition boiling, and film boiling) is numericall…
Single component pseudo-potential lattice Boltzmann models have been widely studied due to their simplicity and stability in multiphase simulations. While numerous model have been proposed, comparative analysis and advantages and disadvantages of different force schemes is often lacking. A pseudo-potential model to simulate large density ratios proposed by Kupershtokh et al. is analyzed in detail in this work. Several common used force schemes are utilized and results compared. Based on the numerical results, the relatively most accurate force scheme proposed by Guo et al. is selected and appl…
Wereportonanewmultiscalemethodapproachforthestudyofsystemswith wide separation of short-range forces acting on short time scales and long-range forces acting on much slower scales. We consider the case of the Poisson-Boltzmann equation that describes the long-range forces using the Boltzmann formula (i.e. we assume the medium to be in quasi local thermal equilibrium). We developed a new approach where fields and particle information (mediated by the equations for their moments) are solved self-consistently. The new approach is implicit and numerically stable, providing exact energy conservatio…
When boiling occurs in a liquid flow field, the phenomenon is known as forced-convection boiling. We numerically investigate such a boiling system on a cylinder in a flow at a saturated condition. To deal with the complicated liquid-vapor phase-change phenomenon, we develop a numerical scheme based on the pseudopotential lattice Boltzmann method (LBM). The collision stage is performed in the space of central moments (CMs) to enhance numerical stability for high Reynolds numbers. The adopted forcing scheme, consistent with the CMs-based LBM, leads to a concise yet robust algorithm. Furthermore,…
The spurious currents observed in multiphase flow simulations with pseudo-potential lattice Boltzmann (LB) models are usually understood to be the result of the lack of isotropy of the model-generated interaction force between phases. Remedies have been proposed to utilize larger stencils to compute the interaction force with higher orders of isotropy. In this short communication, we point out the incompleteness in the current understanding and propose a new consistent implementation to more effectively suppress the spurious currents. We also demonstrate theoretically that certain low-level sp…
Operator split forcing schemes exploiting a symmetrization principle, i.e. Strang splitting, for cascaded lattice Boltzmann (LB) methods in two- and three-dimensions for fluid flows with impressed local forces are presented. Analogous scheme for the passive scalar transport represented by a convection-diffusion equation with a source term in a novel cascaded LB formulation is also derived. They are based on symmetric applications of the split solutions of the changes on the scalar field/fluid momentum due to the sources/forces over half time steps before and after the collision step. The latte…
A lattice Boltzmann method (LBM) approach to the Charney-Hasegawa-Mima (CHM) model for adiabatic drift wave turbulence in magnetised plasmas, is implemented. The CHM-LBM model contains a barotropic equation of state for the potential, a force term including a cross-product analogous to the Coriolis force in quasigeostrophic models, and a density gradient source term. Expansion of the resulting lattice Boltzmann model equations leads to cold-ion fluid continuity and momentum equations, which resemble CHM dynamics under drift ordering. The resulting numerical solutions of standard test cases (mo…
A upscaled lattice Boltzmann method (LBM) for flow simulations in heterogeneous porous media, at both pore and Darcy scales, is proposed in this paper. In the micro-scale simulations, we model flows using LBM with the modified Guo et al. algorithm where we replace the force model with a simple Shan-Chen force model. The proposed upscaled LBM uses coarser grids to represent the effects of the fine-grid (pore-scale) simulations. For the upscaled LBM, effective properties and reduced-order models are proposed as we coarsen the grid. The effective properties are computed using solutions of local p…
We propose a multi-component discrete Boltzmann model (DBM) for premixed, nonpremixed, or partially premixed nonequilibrium reactive flows. This model is suitable for both subsonic and supersonic flows with or without chemical reaction and/or external force. A two-dimensional sixteen-velocity model is constructed for the DBM. In the hydrodynamic limit, the DBM recovers the modified Navier-Stokes equations for reacting species in a force field. Compared to standard lattice Boltzmann models, the DBM presents not only more accurate hydrodynamic quantities, but also detailed nonequilibrium effects…
A lattice Boltzmann model was proposed to simulate electrowetting-on-dielectric (EWOD). The insulative vapor and the electrolyte liquid droplet were simulated by the lattice Boltzmann method respectively, and the linear property between cosine of contact angle and the electric field force confirms the reliability of this model. In the simulation of electrolyte flowing in a rough-wall channel under an external electric field, we found that a narrow channel is more sensitive than a broad channel and the flux decreases monotonously as the electric field increase, but may suddenly increase if the …
We develop a mesoscopic lattice Boltzmann model for liquid-vapor phase transition by handling the microscopic molecular interaction. The short-range molecular interaction is incorporated by recovering an equation of state for dense gases, and the long-range molecular interaction is mimicked by introducing a pairwise interaction force. Double distribution functions are employed, with the density distribution function for the mass and momentum conservation laws and an innovative total kinetic energy distribution function for the energy conservation law. The recovered mesomacroscopic governing eq…
In this paper, we propose a lattice Boltzmann (LB) model to solve the coupled Cahn-Hilliard-Navier-Stokes equations. Differently from previous efforts, the LB equation for the fluid velocity is decomposed in a space of non-orthogonal central moments where the surface tension force is inserted directly in the equilibrium state. The present scheme is validated against well-consolidated benchmark tests, showing very good accuracy. Moreover, it outperforms the BGK approach in terms of stability, as our algorithm allows us to simulate a very large range of viscosity contrast.
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…
The interpolated bounce-back scheme and the immersed boundary method are the two most popular algorithms in treating a no-slip boundary on curved surfaces in the lattice Boltzmann method. While those algorithms are frequently implemented in the numerical simulations involving complex geometries, such as particle-laden flows, their performances are seldom compared systematically over the same local quantities within the same context. In this paper, we present a systematic comparative investigation on some frequently used and most state-of-the-art interpolated bounce-back schemes and immersed bo…
In this paper, a thermal cascaded lattice Boltzmann method (TCLBM) is developed in combination with the double-distribution-function (DDF) approach. A density distribution function relaxed by the cascaded scheme is employed to solve the flow field, and a total energy distribution function relaxed by the BGK scheme is used to solve temperature field, where two distribution functions are coupled naturally. The forcing terms are incorporated by means of central moments, which is consistent with the previous force scheme [Premnath \emph{et al.}, Phys. Rev. E \textbf{80}, 036702 (2009)] but the der…
We employ a recently formulated axisymmetric version of the multiphase Shan-Chen (SC) lattice Boltzmann method (LBM) [Srivastava et al, in preparation (2013)] to simulate the contraction of a liquid ligament. We compare the axisymmetric LBM simulation against the slender jet (SJ) approximation model [T. Driessen and R. Jeurissen, IJCFD {\bf 25}, 333 (2011)]. We compare the retraction dynamics of the tail-end of the liquid ligament from the LBM simulation, the SJ model, Flow3D simulations and a simple model based on the force balance (FB). We find good agreement between the theoretical predicti…
In this paper, we propose a hybrid lattice Boltzmann method (HLBM) for solving fluid-structure interaction problems. The proposed numerical approach is applied to model the flow induced by a vibrating thin lamina submerged in a viscous quiescent fluid. The hydrodynamic force exerted by the fluid on the solid body is described by means of a complex hydrodynamic function, whose real and imaginary parts are determined via parametric analysis. Numerical results are validated by comparison with those from other numerical as well as experimental works available in the literature. The proposed hybrid…
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 origin of the spurious interface velocity in finite difference lattice Boltzmann models for liquid - vapor systems is related to the first order upwind scheme used to compute the space derivatives in the evolution equations. A correction force term is introduced to eliminate the spurious velocity. The correction term helps to recover sharp interfaces and sets the phase diagram close to the one derived using the Maxwell construction.
