Percolation of a fine particle in static granular beds.

We study the percolation of a fine spherical particle under gravity in static randomly packed large-particle beds with different packing densities ϕ and large to fine particle size ratios R ranging from 4 to 7.5 using discrete element method simulations. The particle size ratio at the geometrical trapping threshold, defined by three touching large particles, R_{t}=sqrt[3]/(2-sqrt[3])=6.464, divides percolation behavior into passing and trapping regimes. However, the mean percolation velocity and diffusion of untrapped fine particles, which depend on both R and ϕ, are similar in both regimes and can be collapsed over a range of R and ϕ with the appropriate scaling. An empirical relationship for the local percolation velocity based on the local pore throat to fine particle size ratio and packing density is obtained, which is valid for the full range of size ratio and packing density we study. Similarly, in the trapping regime, the probability for a fine particle to reach a given depth is well described by a simple statistical model. Finally, the percolation velocity and fine particle diffusion are found to decrease with increasing restitution coefficient.

Segregation patterns in three-dimensional granular flows.

Flow of size-bidisperse particle mixtures in a spherical tumbler rotating alternately about two perpendicular axes produces segregation patterns that track the location of nonmixing islands predicted by a dynamical systems approach. To better understand the paradoxical accumulation of large particles in regions defined by barriers to transport, we perform discrete element method (DEM) simulations to visualize the three-dimensional structure of the segregation patterns and track individual particles. Our DEM simulations and modeling results indicate that segregation pattern formation in the biaxial spherical tumbler is due to the interaction of size-driven radial segregation with the weak spanwise component of the advective surface flow. Specifically, we find that after large particles segregate to the surface, slow axial drift in the flowing layer, which is inherent to spherical tumblers, is sufficient to drive large particles across nominal transport barriers and into nonmixing islands predicted by an advective flow model in the absence of axial drift. Axial drift alters the periodic dynamics of nonmixing islands, turning them into "sinks" where large particles accumulate even in the presence of collisional diffusion. Overall, our results indicate that weak perturbation of chaotic flow has the potential to alter key dynamical system features (e.g., transport barriers), which ultimately can result in unexpected physical phenomena.

Particle capture in a model chaotic flow.

To better understand and optimize the capture of passive scalars (particles, pollutants, greenhouse gases, etc.) in complex geophysical flows, we study capture in the simpler, but still chaotic, time-dependent double-gyre flow model. For a range of model parameters, the domain of the double-gyre flow consists of a chaotic region, characterized by rapid mixing, interspersed with nonmixing islands in which particle trajectories are regular. Capture units placed within the domain remove all particles that cross their perimeters without altering the velocity field. To predict the capture capability of a unit at an arbitrary location, we characterize the trajectories of a uniformly seeded ensemble of particles as chaotic or nonchaotic, and then use them to determine the spatially resolved fraction of time that the flow is chaotic. With this information, we can predict where to best place units for maximum capture. We also examine the time dependence of the capture process, and demonstrate that there can be a trade-off between the amount of material captured and the capture rate.

Identifying invariant ergodic subsets and barriers to mixing by cutting and shuffling: Study in a birotated hemisphere.

Mixing by cutting and shuffling can be mathematically described by the dynamics of piecewise isometries (PWIs), higher dimensional analogs of one-dimensional interval exchange transformations. In a two-dimensional domain under a PWI, the exceptional set, E[over ¯], which is created by the accumulation of cutting lines (the union of all iterates of cutting lines and all points that pass arbitrarily close to a cutting line), defines where mixing is possible but not guaranteed. There is structure within E[over ¯] that directly influences the mixing potential of the PWI. Here we provide computational and analytical formalisms for examining this structure by way of measuring the density and connectivity of ɛ-fattened cutting lines that form an approximation of E[over ¯]. For the example of a PWI on a hemispherical shell studied here, this approach reveals the subtle mixing behaviors and barriers to mixing formed by invariant ergodic subsets (confined orbits) within the fractal structure of the exceptional set. Some PWIs on the shell have provably nonergodic exceptional sets, which prevent mixing, while others have potentially ergodic exceptional sets where mixing is possible since ergodic exceptional sets have uniform cutting line density. For these latter exceptional sets, we show the connectivity of orbits in the PWI map through direct examination of orbit position and shape and through a two-dimensional return plot to explain the necessity of orbit connectivity for mixing.

Granular segregation induced by a moving subsurface blade.

Size-driven particle segregation can occur when an object such as a blade moves through an otherwise static bed of granular material. Here we use discrete element method (DEM) simulations to study segregation resulting from a subsurface blade moving through a bed of size-bidisperse spherical particles. Segregation increases with each pass of the blade until a surface layer of mostly large particles forms above a small-particle layer adjacent to the bottom wall. The rate of segregation decreases with each pass so that the degree of segregation asymptotically approaches its maximum value, and the number of passes to reach a steady segregation state increases as the bed depth is increased or the blade height decreased. In shallow beds, the characteristic number of passes for segregation, τ, scales with the inverse of the granular inertial number, I. In deep beds with small blade heights, the effect of the blade is more localized to its immediate vicinity, resulting in many more passes of the blade to reach a steady segregation state, and a corresponding deviation from the shallow bed scaling of τ with I^{-1}.

Pattern formation in a fully three-dimensional segregating granular flow.

Segregation patterns of size-bidisperse particle mixtures in a fully three-dimensional flow produced by alternately rotating a spherical tumbler about two perpendicular axes are studied over a range of particle sizes and volume ratios using both experiments and a continuum model. Pattern formation results from the interaction of size segregation with chaotic regions and nonmixing islands of the flow. Specifically, large particles in the flowing surface layer are preferentially deposited in nonmixing islands despite the effects of collisional diffusion and chaotic transport. The protocol-dependent structure of the unstable manifolds of the flow surrounding the nonmixing islands provides further insight into why certain segregation patterns are more robust than others.

Cutting and shuffling a hemisphere: Nonorthogonal axes.

We examine the dynamics of cutting-and-shuffling a hemispherical shell driven by alternate rotation about two horizontal axes using the framework of piecewise isometry (PWI) theory. Previous restrictions on how the domain is cut-and-shuffled are relaxed to allow for nonorthogonal rotation axes, adding a new degree of freedom to the PWI. A new computational method for efficiently executing the cutting-and-shuffling using parallel processing allows for extensive parameter sweeps and investigations of mixing protocols that produce a low degree of mixing. Nonorthogonal rotation axes break some of the symmetries that produce poor mixing with orthogonal axes and increase the overall degree of mixing on average. Arnold tongues arising from rational ratios of rotation angles and their intersections, as in the orthogonal axes case, are responsible for many protocols with low degrees of mixing in the nonorthogonal-axes parameter space. Arnold tongue intersections along a fundamental symmetry plane of the system reveal a new and unexpected class of protocols whose dynamics are periodic, with exceptional sets forming polygonal tilings of the hemispherical shell.

Modeling Segregation in Granular Flows.

Accurate continuum models of flow and segregation of dense granular flows are now possible. This is the result of extensive comparisons, over the last several years, of computer simulations of increasing accuracy and scale, experiments, and continuum models, in a variety of flows and for a variety of mixtures. Computer simulations-discrete element methods (DEM)-yield remarkably detailed views of granular flow and segregation. Conti-nuum models, however, offer the best possibility for parametric studies of outcomes in what could be a prohibitively large space resulting from the competition between three distinct driving mechanisms: advection, diffusion, and segregation. We present a continuum transport equation-based framework, informed by phenomenological constitutive equations, that accurately predicts segregation in many settings, both industrial and natural. Three-way comparisons among experiments, DEM, and theory are offered wherever possible to validate the approach. In addition to the flows and mixtures described here, many straightforward extensions of the framework appear possible.

Persistent structures in a three-dimensional dynamical system with flowing and non-flowing regions.

Mixing of fluids and mixing of solids are both relatively mature fields. In contrast, mixing in systems where flowing and non-flowing regions coexist remains largely unexplored and little understood. Here we report remarkably persistent mixing and non-mixing regions in a three-dimensional dynamical system where randomness is expected. A spherical shell half-filled with dry non-cohesive particles and periodically rotated about two horizontal axes generates complex structures that vary non-trivially with the rotation angles. They result from the interplay between fluid-like mixing by stretching-and-folding, and solids mixing by cutting-and-shuffling. In the experiments, larger non-mixing regions predicted by a cutting-and-shuffling model alone can persist for a range of protocols despite the presence of stretching-and-folding flows and particle-collision-driven diffusion. By uncovering the synergy of simultaneous fluid and solid mixing, we point the way to a more fundamental understanding of advection driven mixing in materials with coexisting flowing and non-flowing regions.

Effect of pressure on segregation in granular shear flows.

The effect of confining pressure (overburden) on segregation of granular material is studied in discrete element method (DEM) simulations of horizontal planar shear flow. To mitigate changes to the shear rate due to the changing overburden, a linear with depth variation in the streamwise velocity component is imposed using a simple feedback scheme. Under these conditions, both the rate of segregation and the ultimate degree of segregation in size bidisperse and density bidisperse granular flows decrease with increasing overburden pressure and scale with the overburden pressure normalized by the lithostatic pressure of the particle bed. At overburdens greater than approximately 20 times the lithostatic pressure at the bottom of the bed, the density segregation rate is zero while the size segregation rate is small but nonzero, suggesting that different physical mechanisms drive the two types of segregation. The segregation rate scales close to linearly with the inertial number for both size bidisperse and density bidisperse mixtures under various flow conditions, leading to a proposed pressure dependence term for existing segregation velocity correlations. Surprisingly, particle stiffness has only a minor effect on segregation, although it significantly affects the packing density.

Continuum modelling of segregating tridisperse granular chute flow.

Segregation and mixing of size multidisperse granular materials remain challenging problems in many industrial applications. In this paper, we apply a continuum-based model that captures the effects of segregation, diffusion and advection for size tridisperse granular flow in quasi-two-dimensional chute flow. The model uses the kinematics of the flow and other physical parameters such as the diffusion coefficient and the percolation length scale, quantities that can be determined directly from experiment, simulation or theory and that are not arbitrarily adjustable. The predictions from the model are consistent with experimentally validated discrete element method (DEM) simulations over a wide range of flow conditions and particle sizes. The degree of segregation depends on the Péclet number, Pe, defined as the ratio of the segregation rate to the diffusion rate, the relative segregation strength κij between particle species i and j, and a characteristic length L, which is determined by the strength of segregation between smallest and largest particles. A parametric study of particle size, κij , Pe and L demonstrates how particle segregation patterns depend on the interplay of advection, segregation and diffusion. Finally, the segregation pattern is also affected by the velocity profile and the degree of basal slip at the chute surface. The model is applicable to different flow geometries, and should be easily adapted to segregation driven by other particle properties such as density and shape.

Predicting mixing via resonances: Application to spherical piecewise isometries.

We present an analytic method to find the areas of nonmixing regions in orientation-preserving spherical piecewise isometries (PWIs), and apply it to determine the mixing efficacy of a class of spherical PWIs derived from granular flow in a biaxial tumbler. We show that mixing efficacy has a complex distribution across the protocol space, with local minima in mixing efficacy, termed resonances, that can be determined analytically. These resonances are caused by the interaction of two mode-locking-like phenomena.

Mixing and the fractal geometry of piecewise isometries.

Mathematical concepts often have applicability in areas that may have surprised their original developers. This is the case with piecewise isometries (PWIs), which transform an object by cutting it into pieces that are then rearranged to reconstruct the original object, and which also provide a paradigm to study mixing via cutting and shuffling in physical sciences and engineering. Every PWI is characterized by a geometric structure called the exceptional set, E, whose complement comprises nonmixing regions in the domain. Varying the parameters that define the PWI changes both the structure of E as well as the degree of mixing the PWI produces, which begs the question of how to determine which parameters produce the best mixing. Motivated by mixing of yield stress materials, for example granular media, in physical systems, we use numerical simulations of PWIs on a hemispherical shell and examine how the fat fractal properties of E relate to the degree of mixing for any particular PWI. We present numerical evidence that the fractional coverage of E negatively correlates with the intensity of segregation, a standard measure for the degree of mixing, which suggests that fundamental properties of E such as fractional coverage can be used to predict the effectiveness of a particular PWI as a mixing mechanism.

Mixing and transport from combined stretching-and-folding and cutting-and-shuffling.

While structures and bifurcations controlling tracer particle transport and mixing have been studied extensively for systems with only stretching-and-folding, and to a lesser extent for systems with only cutting-and-shuffling, few studies have considered systems with a combination of both. We demonstrate two bifurcations for nonmixing islands associated with elliptic periodic points that only occur in systems with combined cutting-and-shuffling and stretching-and-folding, using as an example a map approximating biaxial rotation of a less-than-half-full spherical granular tumbler. First, we characterize a bifurcation of elliptic island containment, from containment by manifolds associated with hyperbolic periodic points to containment by cutting line tangency. As a result, the maximum size of the nonmixing region occurs when the island is at the bifurcation point. We also demonstrate a bifurcation where periodic points are annihilated by the cutting-and-shuffling action. Chains of elliptic and hyperbolic periodic points that arise when invariant tori surrounding an elliptic point break up [according to Kolmogorov-Arnold-Moser (KAM) theory] can annihilate when they meet a cutting line. Consequently, the Poincaré index (a topological invariant of smooth systems) is not preserved.

Transient response in granular quasi-two-dimensional bounded heap flow.

We study the transition between steady flows of noncohesive granular materials in quasi-two-dimensional bounded heaps by suddenly changing the feed rate. In both experiments and simulations, the primary feature of the transition is a wedge of flowing particles that propagates downstream over the rising free surface with a wedge front velocity inversely proportional to the square root of time. An additional longer duration transient process continues after the wedge front reaches the downstream wall. The entire transition is well modeled as a moving boundary problem with a diffusionlike equation derived from local mass balance and a local relation between the flux and the surface slope.

Mixing with piecewise isometries on a hemispherical shell.

We introduce mixing with piecewise isometries (PWIs) on a hemispherical shell, which mimics features of mixing by cutting and shuffling in spherical shells half-filled with granular media. For each PWI, there is an inherent structure on the hemispherical shell known as the exceptional set E, and a particular subset of E, E+, provides insight into how the structure affects mixing. Computer simulations of PWIs are used to visualize mixing and approximations of E+ to demonstrate their connection. While initial conditions of unmixed materials add a layer of complexity, the inherent structure of E+ defines fundamental aspects of mixing by cutting and shuffling.

Shear-Rate-Independent Diffusion in Granular Flows.

We computationally study the behavior of the diffusion coefficient D in granular flows of monodisperse and bidisperse particles spanning regions of relatively high and low shear rate in open and closed laterally confined heaps. Measurements of D at various flow rates, streamwise positions, and depths collapse onto a single curve when plotted as a function of γd2, where d is the local mean particle diameter and γ is the local shear rate. When γ is large, D is proportional to γd2, as in previous studies. However, for γd2 below a critical value, D is independent of γd2. The acceleration due to gravity g and particle stiffness (or, equivalently, the binary collision time t(c)) together determine the transition in D between regimes. This suggests that while shear rate and particle size determine diffusion at relatively high shear rates in surface-driven flows, diffusion at low shear rates is an elastic phenomenon with time and length scales dependent on gravity (sqrt d/g) and particle stiffness (t(c)sqrt(dg), respectively.

Competitive autocatalytic reactions in chaotic flows with diffusion: prediction using finite-time Lyapunov exponents.

We investigate chaotic advection and diffusion in autocatalytic reactions for time-periodic sine flow computationally using a mapping method with operator splitting. We specifically consider three different autocatalytic reaction schemes: a single autocatalytic reaction, competitive autocatalytic reactions, which can provide insight into problems of chiral symmetry breaking and homochirality, and competitive autocatalytic reactions with recycling. In competitive autocatalytic reactions, species B and C both undergo an autocatalytic reaction with species A such that [Formula: see text] and [Formula: see text]. Small amounts of initially spatially localized B and C and a large amount of spatially homogeneous A are advected by the velocity field, diffuse, and react until A is completely consumed and only B and C remain. We find that local finite-time Lyapunov exponents (FTLEs) can accurately predict the final average concentrations of B and C after the reaction completes. The species that starts in the region with the larger FTLE has, with high probability, the larger average concentration at the end of the reaction. If B and C start in regions with similar FTLEs, their average concentrations at the end of the reaction will also be similar. When a recycling reaction is added, the system evolves towards a single species state, with the FTLE often being useful in predicting which species fills the entire domain and which is depleted. The FTLE approach is also demonstrated for competitive autocatalytic reactions in journal bearing flow, an experimentally realizable flow that generates chaotic dynamics.

Slow axial drift in three-dimensional granular tumbler flow.

Models of monodisperse particle flow in partially filled three-dimensional tumblers often assume that flow along the axis of rotation is negligible. We test this assumption, for spherical and double cone tumblers, using experiments and discrete element method simulations. Cross sections through the particle bed of a spherical tumbler show that, after a few rotations, a colored band of particles initially perpendicular to the axis of rotation deforms: particles near the surface drift toward the pole, while particles deeper in the flowing layer drift toward the equator. Tracking of mm-sized surface particles in tumblers with diameters of 8-14 cm shows particle axial displacements of one to two particle diameters, corresponding to axial drift that is 1-3% of the tumbler diameter, per pass through the flowing layer. The surface axial drift in both double cone and spherical tumblers is zero at the equator, increases moving away from the equator, and then decreases near the poles. Comparing results for the two tumbler geometries shows that wall slope causes axial drift, while drift speed increases with equatorial diameter. The dependence of axial drift on axial position for each tumbler geometry is similar when both are normalized by their respective maximum values.

Stratification, segregation, and mixing of granular materials in quasi-two-dimensional bounded heaps.

Segregation and mixing of granular mixtures during heap formation has important consequences in industry and agriculture. This research investigates three different final particle configurations of bidisperse granular mixtures--stratified, segregated and mixed--during filling of quasi-two-dimensional silos. We consider a large number and wide range of control parameters, including particle size ratio, flow rate, system size, and heap rise velocity. The boundary between stratified and unstratified states is primarily controlled by the two-dimensional flow rate, with the critical flow rate for the transition depending weakly on particle size ratio and flowing layer length. In contrast, the transition from segregated to mixed states is controlled by the rise velocity of the heap, a control parameter not previously considered. The critical rise velocity for the transition depends strongly on the particle size ratio.