Large Eddy Simulation composition equations for single-phase and two-phase fully multicomponent flows

The Large Eddy Simulation (LES) equations for multicomponent (MC) fuel single-phase (SP) flow and two-phase (TP) flow with phase change are derived from the Direct Numerical Simulation (DNS) equations by filtering the DNS equations using a top-hat filter. Additional to the equations solved for single-component (SC) fuels, composition equations enter the formulation. The species composition is represented through a Probability Distribution Function (PDF), and DNS equations for the PDF moments are solved to find the composition. The TP filtered equations contain three categories of subgrid-scale (SGS) terms: (1) SGS–flux terms, (2) filtered source terms (FSTs) and (3) terms representing the ‘LES assumptions’. For SP flows no FSTs exist. The SGS terms in the LES equations must be either shown negligible or modeled. It is shown that for the composition equations, two equivalent forms of the DNS equations lead to two non-equivalent forms of the LES equations. Criteria are proposed to select the form best suited for LES. These criteria are used in conjunction with evaluations based on a DNS database portraying mixing and phase change, and lead to choosing one of the LES forms which satisfies all criteria. It is shown that the LES assumptions lead to additional SGS terms which require modeling. Further considerations are made for reactive flows.     

Influences of subgrid scale dynamics on resolvable scale statistics in large-eddy simulations

Recently, the -expansion and recursive renormalization group (RNG) theories as well as approximate inertial manifolds (AIM) have been exploited as means of systematically modeling subgrid scales in large-eddy simulations (LES). Although these theoretical approaches are rather complicated mathematically, their key approximations can be investigated using direct numerical simulations (DNS). In fact, the differences among these theories can be traced to whether they retain or neglect interactions between the subgrid-subgrid and subgrid-resolvable scales. In this paper, we focus on the influence of these two interactions on the evolution of the resolvable scales in LES: the effect^A which keeps only the interactions between the small and large scales; and, the effect^B which, on the other hand, keeps only the interactions among the subgrid-subgrid scales. The performance of these models is analyzed using the velocity fields of the direct numerical simulations. Specifically, our comparison is based on the analysis of the energy and enstrophy spectra, as well as higher-order statistics of the velocity and velocity derivatives. We found that the energy spectrum and higher-order statistics for the simulations with the effect^A (referred to, hereafter, as model^A) are in very good agreement with the filtered DNS. The comparison between the computations with effect^B (referred to, hereafter, as model^B) and the filtered DNS, however, is not satisfactory. Moreover, the decorrelation between the filtered DNS and model^A is much slower than that of the filtered DNS and model^B. Therefore, we conclude that the model^A, taking into acciunt the interactions between the subgrid and resolvable scales, is a faithful subgrid model for LES for the range of Reynolds numbers considered.     

An improved dynamic subgrid-scale model and its application to large eddy simulation of rotating channel flows

Rotating turbulence occurs extensively in nature and engineering circumstances. Meanwhile, understanding physical mechanisms of the rotating turbulence is important to the fundamental research of turbulence. The turbulent flow in rotating frames undergoes two kinds of Coriolis force effects. First, a secondary flow is induced in the case that there is a mean vorticity component perpendicular to the rotating axis. Second, there are augmenting or suppressing effects on the turbulence if there i…     

Particle subgrid scale modelling in large-eddy simulations of particle-laden turbulence

This study is concerned with particle subgrid scale (SGS) modelling in large-eddy simulations (LESs) of particle-laden turbulence. Although many particle-laden LES studies have neglected the effect of the SGS on the particles, several particle SGS models have been proposed in the literature. In this research, the approximate deconvolution method (ADM) and the stochastic models of Fukagata et al. (Dynamics of Brownian particles in a turbulent channel flow, Heat Mass Transf. 40 (2004), 715–726) Shotorban and Mashayek (A stochastic model for particle motion in large-eddy simulation, J. Turbul. 7 (2006), 1–13) and Berrouk et al. (Stochastic modelling of inertial particle dispersion by subgrid motion for LES of high Reynolds number pipe flow, J. Turbul. 8 (2007), pp. 1–20) are analysed. The particle SGS models are assessed using both a priori and a posteriori simulations of inertial particles in a periodic box of decaying, homogeneous and isotropic turbulence with an initial Reynolds number of Re_λ = 74. The model results are compared with particle statistics from a direct numerical simulation (DNS). Particles with a large range of Stokes numbers are tested using various filter sizes and stochastic model constant values. Simulations with and without gravity are performed to evaluate the ability of the models to account for the crossing trajectory and continuity effects. The results show that ADM improves results but is only capable of recovering a portion of the SGS turbulent kinetic energy. Conversely, the stochastic models are able to recover sufficient SGS energy, but show a large range of results dependent on the Stokes number and filter size. The stochastic models generally perform best at small Stokes numbers, but are unable to predict preferential concentration.     

A priori analysis of sub-grid variance of a reactive scalar using DNS data of high Ka flames

Direct numerical simulations (DNS) of low and high Karlovitz number (Ka) flames are analysed to investigate the behaviour of the reactive scalar sub-grid scale (SGS) variance in premixed combustion under a wide range of combustion conditions (regimes). An order of magnitude analysis is performed to assess the importance of various terms in the variance evolution equation and the analysis is validated using the DNS results. This analysis sheds light on the relative behaviour among turbulent transport and production, scalar dissipation and chemical processes involved in the evolution of the SGS variance at different Ka. The common expectation is that the variance equation shifts from a reaction-dissipation balance at low Ka to a production–dissipation balance at high Ka with diminishing reaction contribution. However, in large eddy simulation (LES), a high Ka alone does not make the reaction term negligible, as the relative importance of the reaction term has a concurrent increase with filter size. The filter size can be relatively large compared with the Kolmogorov length scale in practical LES of high Ka flames, and as a consequence a reaction–production–dissipation balance may prevail in the variance equation even in a high Ka configuration, and this possibility is quantified using the DNS analysis in this work. This has implications from modelling perspectives, and therefore two commonly used closures in LES for the SGS scalar dissipation rate are investigated a priori to estimate the importance of the above balance in LES modelling. The results are explained to highlight the interplay among turbulence, chemistry and dissipation processes as a function of Ka.     

Large eddy simulation of orientation and rotation of ellipsoidal particles in isotropic turbulent flows

The rotational motion and orientational distribution of ellipsoidal particles in turbulent flows are of significance in environmental and engineering applications. Whereas the translational motion of an ellipsoidal particle is controlled by the turbulent motions at large scales, its rotational motion is determined by the fluid velocity gradient tensor at small scales, which raises a challenge when predicting the rotational dispersion of ellipsoidal particles using large eddy simulation (LES) method due to the lack of subgrid scale (SGS) fluid motions. We report the effects of the SGS fluid motions on the orientational and rotational statistics, such as the alignment between the long axis of ellipsoidal particles and the vorticity, the mean rotational energy at various aspect ratios against those obtained with direct numerical simulation (DNS) and filtered DNS. The performances of a stochastic differential equation (SDE) model for the SGS velocity gradient seen by the particles and the approximate deconvolution method (ADM) for LES are investigated. It is found that the missing SGS fluid motions in LES flow fields have significant effects on the rotational statistics of ellipsoidal particles. Alignment between the particles and the vorticity is weakened; and the rotational energy of the particles is reduced in LES. The SGS-SDE model leads to a large error in predicting the alignment between the particles and the vorticity and over-predicts the rotational energy of rod-like particles. The ADM significantly improves the rotational energy prediction of particles in LES.     

Generalised scale-by-scale energy-budget equations and large-eddy simulations of anisotropic scalar turbulence at various Schmidt numbers

A necessary condition for the accurate prediction of turbulent flows using large-eddy simulation (LES) is the correct representation of energy transfer between the different scales of turbulence in the LES. For scalar turbulence, transfer of energy between turbulent length scales is described by a transport equation for the second moment of the scalar increment. For homogeneous isotropic turbulence, the underlying equation is the well-known Yaglom equation. In the present work, we study the turbulent mixing of a passive scalar with an imposed mean gradient by homogeneous isotropic turbulence. Both direct numerical simulations (DNS) and LES are performed for this configuration at various Schmidt numbers, ranging from 0.11 to 5.56. As the assumptions made in the derivation of the Yaglom equation are violated for the case considered here, a generalised Yaglom equation accounting for anisotropic effects, induced by the mean gradient, is derived in this work. This equation can be interpreted as a scale-by-scale energy-budget equation, as it relates at a certain scale r terms representing the production, turbulent transport, diffusive transport and dissipation of scalar energy. The equation is evaluated for the conducted DNS, followed by a discussion of physical effects present at different scales for various Schmidt numbers. For an analysis of the energy transfer in LES, a generalised Yaglom equation for the second moment of the filtered scalar increment is derived. In this equation, new terms appear due to the interaction between resolved and unresolved scales. In an a-priori test, this filtered energy-budget equation is evaluated by means of explicitly filtered DNS data. In addition, LES calculations of the same configuration are performed, and the energy budget as well as the different terms are thereby analysed in an a-posteriori test. It is shown that LES using an eddy viscosity model is able to fulfil the generalised filtered Yaglom equation for the present configuration. Further, the dependence of the terms appearing in the filtered energy-budget equation on varying Schmidt numbers is discussed.     

High-order incompressible large-eddy simulation of fully inhomogeneous turbulent flows

The subgrid-scale (SGS) eddy-viscosity model developed by Vreman [Phys. Fluids 16 (2004) 3670] and its dynamic version [Phys. Fluids 19 (2007) 065110] are tested in large-eddy simulations (LES) of the turbulent flow in an Re = 12,000 lid-driven cubical cavity by comparison to the direct numerical simulation (DNS) data of Leriche and Gavrilakis [Phys. Fluids 12 (2000) 1363]. This appears to be the first test of this class of model to flows without any homogeneous flow directions, which is typical of flows in complex geometries. Additional LES predictions at Re = 18,000 and Re = 22,000 are compared to the DNS data of Leriche [J. Sci. Comp. 27 (2006)]. The new LES framework yielded excellent agreement for both the mean velocity and Reynolds stress profiles and matches DNS data better than the more traditional Smagorinsky-based SGS models.     

一种改进后的亚格子特征尺度表达式

针对大涡模拟涡粘性亚格子模式中使用网格尺度为特征尺度存在的不足,提出一种改进的亚格子特征尺度表达式,利用结合Sagaut混合尺度模式获得的改进模式与Smagorinsky模式、Germano模式和Sagaut模式等进行对比研究.时间发展混合层和中性大气边界层的大涡模拟结果表明,改进的有效亚格子特征尺度能合理反映亚格子脉动的时空分布特性,同时扩展了适用范围.在对耗散程度、流动演化过程、可解湍流强度和可解雷诺应力等方面的模拟,改进模式优于基准模式,表明亚格子脉动有效特征尺度在大涡模拟中具有一定的理论基础和广泛的应用价值.     

Large eddy simulation of channel flow with and without periodic constrictions using the explicit algebraic subgrid-scale model

We analyse the performance of the explicit algebraic subgrid-scale (SGS) stress model (EASSM) in large eddy simulation (LES) of plane channel flow and the flow in a channel with streamwise periodic hill-shaped constrictions (periodic hill flow) which induce separation. The LESs are performed with the Code_Saturne which is an unstructured collocated finite volume solver with a second-order spatial discretisation suitable for LES of incompressible flow in complex geometries. At first, performance of the EASSM in LES of plane channel flow at two different resolutions using the Code_Saturne and a pseudo-spectral method is analysed. It is observed that the EASSM predictions of the mean velocity and Reynolds stresses are more accurate than the conventional dynamic Smagorinsky model (DSM). The results with the pseudo-spectral method were, in general, more accurate. In the second step, LES with the EASSM of flow separation in the periodic hill flow is compared to LES with the DSM, no SGS model and a highly resolved LES data using the DSM. Results show that the mean velocity profiles, the friction and pressure coefficients, the length and shape of the recirculation bubble, as well as the Reynolds stresses are considerably better predicted by the EASSM than the DSM and the no SGS model simulations. It was also observed that in some parts of the domain, the resolved strain-rate and SGS shear stress have the same sign. The DSM cannot produce a correct SGS stress in this case, in contrast to the EASSM.     

A priori evaluation of large eddy simulation subgrid-scale scalar flux models in isotropic passive-scalar and anisotropic buoyancy-driven homogeneous turbulence

Direct numerical simulation (DNS) of passive (non-buoyant) and active (buoyant) scalar homogeneous turbulence is carried out using a standard pseudo-spectral numerical method. The flow settings simulated include stationary forced and decaying passive-scalar turbulence, as well as decaying anisotropic active-scalar turbulence. The Schmidt number is unity in all cases. The results are compared with, and are found to be in very good agreement with, previous similar DNS studies. The well-validated DNS data are divided into 19 sets, and are employed to study different large eddy simulation (LES) subgrid-scale (SGS) models for the SGS scalar flux. The models examined include three eddy-viscosity-type models (Smagorinsky, Vreman and Sigma with a constant SGS Schmidt number), a Dynamic Structure model and two versions of the Gradient (Gradient and Modulated Gradient) model. The models are investigated with respect to their ability to predict the orientation, and the magnitude, of the SGS scalar flux. Eddy-viscosity models are found to predict the magnitude of the SGS scalar flux accurately, but are poor at predicting the orientation of the SGS scalar flux. The Dynamic Structure and Gradient models are better than eddy-viscosity models at predicting both the magnitude and direction. However, neither of them can be realised in an actual LES, without carrying additional transport equations. Based on these observations, four new models are proposed – combining directions from Dynamic Structure and Gradient models, and magnitudes from Smagorinsky and Vreman eddy-viscosity models. These models are expected to be better than eddy-viscosity and Modulated Gradient models, and this is confirmed by preliminary a posteriori tests.     

Relevance of the subgrid-scales for large eddy simulations of turbulence-radiation interactions in a turbulent plane jet

An a priori study based on direct numerical simulation (DNS) of a non-isothermal turbulent plane jet has been carried out in order to analyse the role of the small-scales of turbulence on thermal radiation. Filtered DNS and large eddy simulation (LES) without subgrid-scale (SGS) model have been estimated for the radiative heat transfer. The comparison of the results highlights the subgrid-scale influence over the filtered radiation quantities, such as the radiative intensity and the radiative emission. The influence of the optical thickness is also studied. It is shown that the subgrid-scales are not significant near the centerline of the jet, where the radiative heat transfer is more important, and therefore that the SGS can be neglected in this configuration. However, when the optical thickness increases, the SGS become relevant and SGS modeling may be needed.     

The effect of subgrid-scale models on the entrainment of a passive scalar in a turbulent planar jet

Classical large-eddy simulation (LES) modelling assumes that the passive subgrid-scale (SGS) models do not influence large-scale quantities, even though there is now ample evidence of this in many flows. In this work, direct numerical simulation (DNS) and large-eddy simulations of turbulent planar jets at Reynolds number Re_H = 6000 including a passive scalar with Schmidt number Sc = 0.7 are used to study the effect of several SGS models on the flow integral quantities e.g. velocity and scalar jet spreading rates. The models analysed are theSmagorinsky, dynamic Smagorinsky, shear-improved Smagorinsky and the Vreman. Detailed analysis of the thin layer bounding the turbulent and non-turbulent regions – the so-called turbulent/non-turbulent interface (TNTI) – shows that this region raises new challenges for classical SGS models. The small scales are far from equilibrium and contain a high fraction of the total kinetic energy and scalar variance, but the situation is worse for the scalar than for the velocity field. Both a-priori and a-posteriori (LES) tests show that the dynamic Smagorinsky and shear-improved models give the best results because they are able to accurately capture the correct statistics of the velocity and passive scalar fluctuations near the TNTI. The results also suggest the existence of a critical resolution Δ_x, of the order of the Taylor scale λ, which is needed for the scalar field. Coarser passive scalar LES i.e. Δ_x ≥ λ results in dramatic changes in the integral quantities. This fact is explained by the dynamics of the small scales near the jet interface.     

Evaluation of assumed-PDF methods in two-phase flows using direct numerical simulation

The hypothesis of uncorrelated temperature (T) and vapor-fuel mass fraction (Y_v), frequently made when modeling reaction rates using assumed-PDF models, is examined utilizing transitional databases from direct numerical simulation (DNS) of three-dimensional mixing-layers two-phase (TP) flows with evaporation. Because the databases do not contain chemical reaction, which would further correlate variables, finding here a correlation between T and Y_v is sufficient for invalidating reaction rate modeling of the joint (T, Y_v) probability distribution function (PDF) as a product of the marginal PDFs. The databases comprise four multicomponent fuels, two mass loadings and two free-stream gas temperatures. For comparison, databases for single-phase (SP) flows are also analyzed at two initial Reynolds numbers. The examination is conducted in the mixing layer excluding the free streams and in a more restricted part of the mixing layer constituting its core. The analysis is performed at the DNS and large eddy simulation (LES) scales, and subgrid scale (SGS). To obtain the LES database, the DNS database is filtered, and an evaluation of the examined correlation at the LES and SGS scales is made at two filter sizes. At the DNS scale, T and Y_v are practically uncorrelated for SP flows, showing the weak influence of the perfect-gas equation of state, whereas for TP flows the correlation is strong and increases with mass loading indicating the powerful effect of the phase change. At the LES scale, the findings emulate those at the DNS scale. The fluctuations of the SGS scale are uncorrelated for SP flows, but the product of the marginal PDFs is different from the joint PDF. For TP flows, the fluctuations are correlated and the correlation increases with temperature, casting doubt on current assumed PDFs used to model chemistry in reacting sprays. These results are independent of filter size. The joint PDFs for TP and SP fluctuations are successfully modeled.     

Anomalous Scaling of Structure Functions and Dynamic Constraints on Turbulence Simulations

The connection between anomalous scaling of structure functions (intermittency) and numerical methods for turbulence simulations is discussed. It is argued that the computational work for direct numerical simulations (DNS) of fully developed turbulence increases as Re ⁴, and not as Re ³ expected from Kolmogorov’s theory, where Re is a large-scale Reynolds number. Various relations for the moments of acceleration and velocity derivatives are derived. An infinite set of exact constraints on dynamically consistent subgrid models for Large Eddy Simulations (LES) is derived from the Navier–Stokes equations, and some problems of principle associated with existing LES models are highlighted     

Experimental study of velocity-scalar filtered joint density function for LES of turbulent combustion

The velocity-scalar filtered joint density function (FJDF) used in large eddy simulation (LES) of turbulent combustion is experimentally studied. Measurements are made in the fully developed region of an axisymmetric turbulent jet using an array consisting of three X-wires and resistance-wire temperature sensors. Filtering in the cross-stream and streamwise directions is realized by using the array and by invoking Taylor’s hypothesis, respectively. The means of the FJDF conditional on the subgrid-scale (SGS) turbulent kinetic energy and the SGS scalar variance at a given location range from close to joint normal to bimodal with the peaks separated in both velocity and scalar spaces, which correspond to qualitatively different mixing regimes. For close to joint normal FJDFs, the SGS fields are well mixed. For bimodal FJDFs, the conditionally filtered scalar diffusion and dissipation strongly depend on the SGS velocity and scalar, consistent with a combination of diffusion layers and plane strain in the SGS fields, which is similar to the counter-flow model for laminar flamelets. The results suggest that in LES, both mixing regimes could potentially be modeled accurately. The velocity field affects the SGS variance and the filtered scalar dissipation rate primarily by changing the degree of nonequilibrium of the SGS scalar and the SGS time scale, respectively. This study further demonstrates the importance of including velocity in mixing models.     

Investigating asymptotic suction boundary layers using a one-dimensional stochastic turbulence model

The turbulent asymptotic suction boundary layer is studied using a one-dimensional turbulence (ODT) model. ODT is a fully resolved, unsteady stochastic simulation technique. While flow properties reside on a one-dimensional domain, turbulent advection is represented using mapping events whose occurrences are governed by a random process. Due to its reduced spatial dimensionality, ODT achieves major cost reductions compared to three-dimensional (3D) simulations. A comparison to recent direct numerical simulation (DNS) data at moderate Reynolds number (Re = u_∞ / v₀ = 333, where u_∞ and v₀ are the free stream and suction velocity, respectively) suggests that the ODT model is capable of reproducing several velocity statistics, i.e. mean velocity and turbulent kinetic energy budgets, while peak turbulent stresses are under-estimated by ODT. Variation of the Reynolds number in the range Re ∈ [333,400,500,1000] shows that ODT can reproduce various trends observed as a result of increased suction in turbulent asymptotic suction boundary layers, i.e. the reduction of Reynolds stresses and enhanced skin friction. While up to Re = 500 our results can be directly compared to recent LES data, the simulation at Re = 1000 is currently not feasible through full 3D simulations, hence ODT may assist the design of future DNS or LES simulations at larger Reynolds numbers.     

On the effect of an anisotropy-resolving subgrid-scale model on large eddy simulation predictions of turbulent open channel flow with wall roughness

A large eddy simulation (LES) was conducted of turbulent flow in a channel with a rough wall on one side and a free surface on the other by adopting an anisotropy-resolving subgrid-scale (SGS) model. A shear Reynolds number of Re_τ = 395 was used based on the mean friction velocity and channel height. To investigate the grid dependency of the LES results caused by the SGS model, three grid resolutions were tested under the same definition of a roughness shape by using the immersed boundary method. The results obtained were compared with direct numerical simulation data with and without the wall roughness and those without the extra anisotropic term. The primary focus was on how the present anisotropic SGS model with coarser grid resolutions can properly provide the effects of roughness on the mean velocity and turbulent stresses, leading to a considerable reduction of the computational cost of LES.     

Assessment of dynamic closure for premixed combustion large eddy simulation

Turbulent piloted Bunsen flames of stoichiometric methane–air mixtures are computed using the large eddy simulation (LES) paradigm involving an algebraic closure for the filtered reaction rate. This closure involves the filtered scalar dissipation rate of a reaction progress variable. The model for this dissipation rate involves a parameter β_c representing the flame front curvature effects induced by turbulence, chemical reactions, molecular dissipation, and their interactions at the sub-grid level, suggesting that this parameter may vary with filter width or be a scale-dependent. Thus, it would be ideal to evaluate this parameter dynamically by LES. A procedure for this evaluation is discussed and assessed using direct numerical simulation (DNS) data and LES calculations. The probability density functions of β_c obtained from the DNS and LES calculations are very similar when the turbulent Reynolds number is sufficiently large and when the filter width normalised by the laminar flame thermal thickness is larger than unity. Results obtained using a constant (static) value for this parameter are also used for comparative evaluation. Detailed discussion presented in this paper suggests that the dynamic procedure works well and physical insights and reasonings are provided to explain the observed behaviour.     

A new approach to sub-grid surface tension for LES of two-phase flows

In two-phase flow, the presence of inter-phasal surface – the interface – causes additional terms to appear in LES formulation. Those terms were ignored in contemporary works, for the lack of model and because the authors expected them to be of negligible influence. However, it has been recently shown by a priori DNS simulations that the negligibility assumption can be challenged. In the present work, a model for one of the sub-grid two-phase specific terms is proposed, using deconvolution of the velocity field and advection of the interface using that field. Using the model, the term can be included into LES. A brief presentation of the model is followed by numerical tests that assess the model’s performance by comparison with a priori DNS results.