In this paper, we review the recent development of phase-field models and their numerical methods for multi-component fluid flows with interfacial phenomena. The models consist of a Navier-Stokes system coupled with a multi-component Cahn-Hilliard system through a phase-field dependent surface tension force, variable density and viscosity, and the advection term. The classical infinitely thin boundary of separation between two immiscible fluids is replaced by a transition region of a small but finite width, across which the composition of the mixture changes continuously. A constant level set of the phase-field is used to capture the interface between two immiscible fluids. Phase-field methods are capable of computing topological changes such as splitting and merging, and thus have been applied successfully to multi-component fluid flows involving large interface deformations. Practical applications are provided to illustrate the usefulness of using a phase-field method. Computational results of various experiments show the accuracy and effectiveness of phase-field models.

With discretized particle velocity space, a multi-scale unified gas-kinetic scheme for entire Knudsen number flows has been constructed based on the kinetic model in one-dimensional case [J. Comput. Phys., vol. 229 (2010), pp. 7747-7764]. For the kinetic equation, to extend a one-dimensional scheme to multidimensional flow is not so straightforward. The major factor is that addition of one dimension in physical space causes the distribution function to become two-dimensional, rather than axially symmetric, in velocity space. In this paper, a unified gas-kinetic scheme based on the Shakhov model in two-dimensional space will be presented. Instead of particle-based modeling for the rarefied flow, such as the direct simulation Monte Carlo (DSMC) method, the philosophical principal underlying the current study is a partial-differential-equation (PDE)-based modeling. Since the valid scale of the kinetic equation and the scale of mesh size and time step may be significantly different, the gas evolution in a discretized space is modeled with the help of kinetic equation, instead of directly solving the partial differential equation. Due to the use of both hydrodynamic and kinetic scales flow physics in a gas evolution model at the cell interface, the unified scheme can basically present accurate solution in all flow regimes from the free molecule to the Navier-Stokes solutions. In comparison with the DSMC and Navier-Stokes flow solvers, the current method is much more efficient than DSMC in low speed transition and continuum flow regimes, and it has better capability than NS solver in capturing of non-equilibrium flow physics in the transition and rarefied flow regimes. As a result, the current method can be useful in the flow simulation where both continuum and rarefied flow physics needs to be resolved in a single computation. This paper will extensively evaluate the performance of the unified scheme from free molecule to continuum NS solutions, and from low speed micro-flow to high speed non-equilibrium aerodynamics. The test cases clearly demonstrate that the unified scheme is a reliable method for the rarefied flow computations, and the scheme provides an important tool in the study of non-equilibrium flow.

We introduce a lattice-free hard sphere exclusion stochastic process. The resulting stochastic rates are distance based instead of cell based. The corresponding Markov chain build for this many particle system is updated using an adaptation of the kinetic Monte Carlo method. It becomes quickly apparent that due to the lattice-free environment, and because of that alone, the dynamics behave differently than those in the lattice-based environment. This difference becomes increasingly larger with respect to particle densities/temperatures. The well-known packing problem and its solution (Palasti conjecture) seem to validate the resulting lattice-free dynamics.

Simulation of elastic wave propagation has important applications in many areas such as inverse problem and geophysical exploration. In this paper, stability conditions for wave simulation in 3-D anisotropic media with the pseudospectral method are investigated. They can be expressed explicitly by elasticity constants which are easy to be applied in computations. The 3-D wave simulation for two typical anisotropic media, transversely isotropic media and orthorhombic media, are carried out. The results demonstrate some satisfactory behaviors of the pseudospectral method.

Power-law distributions and other skew distributions, observed in various models and real systems, are considered. A model, describing evolving systems with increasing number of elements, is considered to study the distribution over element sizes. Stationary power-law distributions are found. Certain non-stationary skew distributions are obtained and analyzed, based on exact solutions and numerical simulations.

We present a systematic derivation of a model based on the central moment lattice Boltzmann equation that rigorously maintains Galilean invariance of forces to simulate inertial frame independent flow fields. In this regard, the central moments, i.e. moments shifted by the local fluid velocity, of the discrete source terms of the lattice Boltzmann equation are obtained by matching those of the continuous full Boltzmann equation of various orders. This results in an exact hierarchical identity between the central moments of the source terms of a given order and the components of the central moments of the distribution functions and sources of lower orders. The corresponding source terms in velocity space are then obtained from an exact inverse transformation due to a suitable choice of orthogonal basis for moments. Furthermore, such a central moment based kinetic model is further extended by incorporating reduced compressibility effects to represent incompressible flow. Moreover, the description and simulation of fluid turbulence for full or any subset of scales or their averaged behavior should remain independent of any inertial frame of reference. Thus, based on the above formulation, a new approach in lattice Boltzmann framework to incorporate turbulence models for simulation of Galilean invariant statistical averaged or filtered turbulent fluid motion is discussed.

In this paper, the second in a series, we improve the discretization of the higher spatial derivative terms in a spectral volume (SV) context. The motivation for the above comes from [J. Sci. Comput., 46(2), 314-328], wherein the authors developed a variant of the LDG (Local Discontinuous Galerkin) flux discretization method. This variant (aptly named LDG2), not only displayed higher accuracy than the LDG approach, but also vastly reduced its unsymmetrical nature. In this paper, we adapt the LDG2 formulation for discretizing third derivative terms. A linear Fourier analysis was performed to compare the dispersion and the dissipation properties of the LDG2 and the LDG formulations. The results of the analysis showed that the LDG2 scheme (i) is stable for 2nd and 3rd orders and (ii) generates smaller dissipation and dispersion errors than the LDG formulation for all the orders. The 4th order LDG2 scheme is however mildly unstable: as the real component of the principal eigen value briefly becomes positive. In order to circumvent the above, a weighted average of the LDG and the LDG2 fluxes was used as the final numerical flux. Even a weight of 1.5% for the LDG (i.e., 98.5% for the LDG2) was sufficient to make the scheme stable. This weighted scheme is still predominantly LDG2 and hence generated smaller dissipation and dispersion errors than the LDG formulation. Numerical experiments are performed to validate the analysis. In general, the numerical results are very promising and indicate that the approach has a great potential for higher dimension Kortewegde Vries (KdV) type problems.

In this paper the numerical method for solution of an aeroelastic model describing the interactions of air flow with vocal folds is described. The flow is modelled by the incompressible Navier-Stokes equations spatially discretized with the aid of the stabilized finite element method. The motion of the computational domain is treated with the aid of the Arbitrary Lagrangian Eulerian method. The structure dynamics is replaced by a mechanically equivalent system with the two degrees of freedom governed by a system of ordinary differential equations and discretized in time with the aid of an implicit multistep method and strongly coupled with the flow model. The influence of inlet/outlet boundary conditions is studied and the numerical analysis is performed and compared to the related results from literature.

There is a growing trend within energy and environmental simulation to consider tightly coupled solutions to multiphysics problems. This can be seen in nuclear reactor analysis where analysts are interested in coupled flow, heat transfer and neutronics, and in nuclear fuel performance simulation where analysts are interested in thermomechanics with contact coupled to species transport and chemistry. In energy and environmental applications, energy extraction involves geomechanics, flow through porous media and fractured formations, adding heat transport for enhanced oil recovery and geothermal applications, and adding reactive transport in the case of applications modeling the underground flow of contaminants. These more ambitious simulations usually motivate some level of parallel computing. Many of the physics coupling efforts to date utilize simple code coupling or first-order operator splitting, often referred to as loose coupling. While these approaches can produce answers, they usually leave questions of accuracy and stability unanswered. Additionally the different physics often reside on distinct meshes and data are coupled via simple interpolation, again leaving open questions of stability and accuracy.

This paper is the second part of a two part sequence on multiphysics algorithms and software. The first [1] focused on the algorithms; this part treats the multiphysics software framework and applications based on it. Tight coupling is typically designed into the analysis application at inception, as such an application is strongly tied to a composite nonlinear solver that arrives at the final solution by treating all equations simultaneously. The application must also take care to minimize both time and space error between the physics, particularly if more than one mesh representation is needed in the solution process. This paper presents an application framework that was specifically designed to support tightly coupled multiphysics analysis. The Multiphysics Object Oriented Simulation Environment (MOOSE) is based on the Jacobian-free Newton-Krylov (JFNK) method combined with physics-based preconditioning to provide the underlying mathematical structure for applications. The report concludes with the presentation of a host of nuclear, energy and environmental applications that demonstrate the efficacy of the approach and the utility of a well-designed multiphysics framework.

A two-dimensional numerical scheme for the compressible Euler equations is presented and applied here to the simulation of exemplary compressible vortical flows. The proposed approach allows to perform computations on unstructured moving grids with adaptation, which is required to capture complex features of the flow-field. Grid adaptation is driven by suitable error indicators based on the Mach number and by element-quality constraints as well. At the new time level, the computational grid is obtained by a suitable combination of grid smoothing, edge-swapping, grid refinement and de-refinement. The grid modifications—including topology modification due to edge-swapping or the insertion/deletion of a new grid node—are interpreted at the flow solver level as continuous (in time) deformations of suitably-defined node-centered finite volumes. The solution over the new grid is obtained without explicitly resorting to interpolation techniques, since the definition of suitable interface velocities allows one to determine the new solution by simple integration of the Arbitrary Lagrangian-Eulerian formulation of the flow equations. Numerical simulations of the steady oblique-shock problem, of the steady transonic flow and of the start-up unsteady flow around the NACA 0012 airfoil are presented to assess the scheme capabilities to describe these flows accurately.

This paper summarizes suitable material models for creep and damage of concrete which are coupled with heat and moisture transfer. The fully coupled approach or the staggered coupling is assumed. Governing equations are spatially dis-cretized by the finite element method and the temporal discretization is done by the generalized trapezoidal method. Systems of non-linear algebraic equations are solved by the Newton method. Development of an efficient and extensible computer code based on the C++ programming language is described. Finally, successful analyses of two real engineering problems are described.