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Chapter 8Coupled particle/fluid interaction Until this point, we have ignored the presence of a fluid medium surrounding the particles.. Because the coupling of the various particle and f

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7.5 Staggering schemes 77

0 5e+07 1e+08 1.5e+08 2e+08 2.5e+08 3e+08 3.5e+08

TIME

NORMAL FORCE TANGENTIAL FORCE

0 5e+07 1e+08 1.5e+08 2e+08 2.5e+08 3e+08 3.5e+08

TIME

NORMAL FORCE TANGENTIAL FORCE

Figure 7.14 The maximum force (and corresponding friction force) versus time

imparted on the immovable obstacle surface, max (I) The top graph is with charging and the bottom is without charging Notice that the maximum “signature” force is less with charging.

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78 Chapter 7 Advanced particulate flow models

-5e+08 -4e+08 -3e+08 -2e+08 -1e+08 0 1e+08 2e+08 3e+08 4e+08

TIME

TOTAL X NORMAL FORCE TOTAL Y NORMAL FORCE TOTAL Z NORMAL FORCE TOTAL X TANGENTIAL FORCE TOTAL Y TANGENTIAL FORCE TOTAL Z TANGENTIAL FORCE

-6e+08 -4e+08 -2e+08 0 2e+08 4e+08 6e+08 8e+08

TIME

TOTAL X NORMAL FORCE TOTAL Y NORMAL FORCE TOTAL Z NORMAL FORCE TOTAL X TANGENTIAL FORCE TOTAL Y TANGENTIAL FORCE TOTAL Z TANGENTIAL FORCE

Figure 7.15 The total force (and corresponding friction force) versus time

im-parted on the immovable obstacle surface, max (I) The top graph is with charging and the bottom is without charging Notice that the total “signature” force is less with charging.

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7.5 Staggering schemes 79

Z

Z

Z

Z

Figure 7.16 Top to bottom and left to right, slow impact of charged clouds The

clouds combine into a larger cloud.

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80 Chapter 7 Advanced particulate flow models

Z

Z

Z

Z

Figure 7.17 Top to bottom and left to right, fast impact of charged clouds The

clouds disperse.

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Chapter 8

Coupled particle/fluid interaction

Until this point, we have ignored the presence of a fluid medium surrounding the particles

We now focus on the modeling and simulation of the dynamics of particles, coupled with a surrounding fluid, while bringing in several of the effects discussed earlier in the form of a model problem Obviously, the number of research areas involving particles in a fluid un-dergoing various multifield processes is immense, and it would be futile to attempt to catalog all of the various applications However, a common characteristic of such systems is that the various physical fields (thermal, mechanical, chemical, electrical, etc.) are strongly coupled

This chapter develops a flexible and robust solution strategy to resolve coupled sys-tems comprising large groups of flowing particles embedded within a fluid A problem modeling groups of particles, which may undergo inelastic collisions in the presence of near-field forces, is considered The particles are surrounded by a continuous interstitial fluid that is assumed to obey the compressible Navier–Stokes equations Thermal effects are also considered Such particle/fluid systems are strongly coupled due to the mechanical forces and heat transfer induced by the fluid on the particles and vice versa Because the coupling of the various particle and fluid fields can dramatically change over the course of

a flow process, a primary focus of this work is the development of a recursive “staggering”

solution scheme, whereby the time steps are adaptively adjusted to control the error asso-ciated with the incomplete resolution of the coupled interaction between the various solid particulate and continuum fluid fields A central feature of the approach is the ability to account for the presence of particles within the fluid in a straightforward manner that can

be easily incorporated into any standard computational fluid mechanics code based on finite difference, finite element, or finite volume discretization A three-dimensional example is provided to illustrate the overall approach.42

Remark Although some portions of the presentation in this chapter may appear to

be redundant with earlier parts of the monograph, there are subtle differences, and thus it is felt that a self-contained chapter is pedagogically superior to continual referral to previous portions of the monograph, which may lead to possible ambiguities

42 It is assumed that the particles are small enough that their rotation with respect to their mass centers is deemed insignificant However, even in the event that the particles are not extremely small, we assume that any “spin” of the particles is small enough to neglect lift forces that may arise from the interaction with the surrounding fluid.

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82 Chapter 8 Coupled particle/fluid interaction

PROBLEM PROBLEM

FLUID-ONLY

Figure 8.1 Decomposition of the fluid/particle interaction (Zohdi [224]).

8.1 A model problem

We consider a sufficiently complex model problem comprising of a group of nonintersecting spherical particles (N pin total), each being small enough that their rotation with respect to

their mass centers is deemed insignificant The equation of motion for theith particle in the

system (Figure 8.1) is

m i ¨r i =  tot

wherer i is the position vector of theith particle and  tot

i represents all forces acting on

particlei In particular,  tot

i =  drag i +  nf i +  con

i +  f ric i represents the forces due to fluid drag, near-field interaction, interparticle contact forces, and frictional forces Clearly, under certain conditions one force may dominate over the others However, this is generally impossible to ascertain a priori, since the dynamics and coupling in the system may change dramatically during the course of the flow process

Remark Throughout this chapter, boldface symbols indicate vectors or tensors The

inner product of two vectorsu and v is denoted by u · v At the risk of oversimplification,

we ignore the distinction between second-order tensors and matrices Furthermore, we exclusively employ a Cartesian basis Hence, if we consider the second-order tensorA

with its matrix representation[A], then the product of two second-order tensors A · B is

defined by the matrix product[A][B], with components of A ij B jk = C ik The second-order inner product of two tensors or matrices isA : B = A ij B ij = tr([A T ][B]) Finally, the

divergence of a vectoru is defined by ∇ · u = u i,i, whereas for a second-order tensorA,

∇ · A describes a contraction to a vector with the components A ij,j

8.1.1 A simple characterization of particle/fluid interaction

We first consider drag force interactions between the fluid and the particles The drag force acting on an object in a fluid flow (occupying domainω and outward surface normal n) is

defined as

 drag=



whereσ f is the Cauchy stress For a Newtonian fluid,σ f is given by

σ f = −P f1+ λ ftrD f1+ 2µ f D f = −P f1+ 3κ ftrD f

3 1+ 2µ f D!

f , (8.3) whereP f is the thermodynamic pressure,κ f = λ f + 2

3µ f is the bulk viscosity, µ f is

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8.1 A model problem 83 the absolute viscosity,D f = 1

2(∇ x v f + (∇ x v f ) T ) is the symmetric part of the velocity

gradient, trD f is the trace ofD f, andD!

f = D f−trD f

3 1 is the deviatoric part ofD f The stress is determined by solving the following coupled system of partial differential equations (compressible Navier–Stokes):

Mass balance: ∂ρ f

∂t = −∇x · (ρ f v f ),

Energy balance: ρ f C f

∂θ

∂t + (∇ x θ f ) · v f



= σ f : ∇x v f + ∇x · (K f · ∇θ f ) + ρ f z f ,

Momentum balance: ρ f

∂v

f

∂t + (∇ x v f ) · v f



= ∇x · σ f + ρ f b f ,

(8.4) where, at a point,ρ f is the fluid density;v fis the fluid velocity;θ fis the fluid temperature;

C f is the fluid heat capacity;z f is the heat source per unit mass;Kf is the thermal conduc-tivity tensor, assumed to be isotropic of the formKf = K f1,K f being the scalar thermal conductivity; andb f represents body forces per unit mass The thermodynamic pressure is given by an equation of state:

The specific equation of state will be discussed later in the presentation

The fluid domain will require spatial discretization with some type of mesh, for exam-ple, using a finite difference, finite volume, or finite element method Usually, it is extremely difficult to resolve the flow in the immediate neighborhood of the particles, in particular

if there are several particles However, if the primary interest is in the dynamics of the

particles, as it is in this work, an appropriate approach, which permits coarser discretization

of the fluid continuum, is to employ effective drag coefficients, for example, defined via

C D def= || drag i ||

1

2"ρ f#ω i ||"v f#ω i − v i||2A i , (8.6)

where"(·)# ω i

def

= 1

|ω i|



ω i (·) dω iis the volumetric average of the argument over the domain occupied by the ith particle, "v f#ω i is the volumetric average of the fluid velocity,v i is the velocity of theith (solid) particle, and A i is the cross-sectional area of theith (solid)

particle For example, one possible way to represent the drag coefficient is with a piecewise definition, as a function of the Reynolds number (Chow [44]):

• For 0< Re ≤ 1, C D = 24

Re.

• For 1< Re ≤ 400, C D = 24

Re0.646

• For 400< Re ≤ 3 × 105,C D = 0.5.

• For 3× 105< Re ≤ 2 × 106,C D = 0.000366Re0.4275.

• For 2× 106< Re < ∞, C D = 0.18.

Here, the local Reynolds number for a particle isRedef

= 2b i "ρ f#ωi ||"v f#ωi −v i||

µ andb iis the radius

of theith particle The use of this simple concept makes it relatively straightforward to

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84 Chapter 8 Coupled particle/fluid interaction

account for the presence of the solid particles in the fluid by augmenting the flow calculations with drag forces (Figure 8.1) Algorithmically speaking, one must compute the fluid flow with reaction forces due to the presence of the particles To this end, one can use the volu-metric forces (b f) and heat sources (z f) within the fluid domain for this purpose by writing

ρ f



∂v f

∂t + (∇ x v f ) · v f



= ∇x · σ f + ρ f b f ,

b f = b D = − drag i

m i = −C D1"ρ f#ωi ||"v f#ωi −v i|| 2A i

m i d d = "v f#ωi −v i

||"v f#ωi −v i||



,

ρ f C



∂θ f

∂t + (∇ x θ f ) · v f



= σ f : ∇x v f + ∇x · (K f· ∇x θ f ) + ρ f z f ,

z f = z D = c v |b D · ("v f#ω i − v i )|,

(8.7)

where the drag force on the fluid,b D (per unit mass), is nonzero if its location coincides with the particle domain and is zero otherwise Here,z Dis the heat source due to the rate

of work done by the drag force on the fluid.43 Such source terms are easily projected onto a finite difference or finite element grid.44 This drag-based approach is designed to account for particles in the fluid using a coarse mesh In other words, the smallest (mesh) scale allowable is that associated with the dimensions of the particles Accordingly, we shall not employ meshes smaller than the particle length scale when simulations are performed later.

Remark More detailed analyses of fluid-particle interaction can be achieved in two

primary ways: (1) direct, brute-force, numerical schemes, treating the particles as part of the fluid continuum (as another fluid or solid phase), and thus meshing them in a detailed manner, or (2) with semi-analytical techniques, such as those based on approximation of the interaction between the particles and the fluid, employing an analysis of the (interstitial) fluid gaps using lubrication theory For a concise review of recent developments in such semi-analytical techniques, in particular methods that go beyond local analyses of flow

in a single fluid gap, using discrete network approximations, which account for multiple hydrodynamic interactions, see Berlyand and Panchenko [30] and Berlyand et al [31]

Although not employed here, discrete network approximations appear to be quite attractive for possibly improving the description of the interaction between the particles and the fluid, beyond a simple drag-based method (as adopted in this work), without resorting to detailed numerical meshing

8.1.2 Particle thermodynamics

Throughout the thermal analysis of the particles, we shall use relatively simple models

Consistent with the particle-based philosophy, it is assumed that the temperature within each particle is uniform (a lumped mass approximation) We remark that the validity of assuming a uniform temperature within a particle is dictated by the Biot number A small Biot number indicates that such an approximation is reasonable The Biot number for a

43 If the constantc vis not selected as unity, this can indicate endothermic or exothermic particle/fluid chemical reactions.

44 If the particles are significantly smaller than the mesh spacing, then the drag forces associated with the particles are computed from the nearest node/particle center pair.

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8.1 A model problem 85 sphere scales with the ratio of particle volume (V ) to particle surface area (a s), a V s = b

3, which indicates that a uniform temperature distribution is appropriate, since the particles are,

by definition, small Since it is assumed that the temperature fields are uniform within the particles, the gradient of the temperature within the particle is zero, i.e.,∇θ = 0 Therefore,

a Fourier-type law for the heat flux will register a zero value,q = −K · ∇θ = 0.

Under these assumptions, we consider an energy balance, governing the interconver-sions of mechanical, thermal, and chemical energy in a system, dictated by the first law of thermodynamics Accordingly, we require the time rate of change of the sum of the kinetic energy (K) and stored energy (S) to be equal to the sum of the work rate (power, P) and

the net heat supplied (H):

d

where we assume that the stored energy is composed solely of a thermal part,S = mCθ,

C being the heat capacity per unit mass Consistent with the assumption that the particles

deform negligibly during impact, the amount of stored mechanical energy is deemed

in-significant The kinetic energy is K = 1

2mv · v The mechanical power term is due to the

forces acting on a particle:

For the particles, it is assumed that a process of convection, for example, governed by Newton’s law of cooling and thermal radiation according to a simple Stefan–Boltzmann law, occurs Accordingly, the first law reads

m˙v · v + mC ˙θ

d(K+S) dt

=  tot · v

power=P

− hc a s (θ − θ o )

convection

+ mc v |b D · ("v f#ω − v)|

drag

− Ba s P(θ4− θ4

s )

radiation

H

,

(8.10) whereθ o is the temperature of the ambient fluid,h c is the convection coefficient (using

Newton’s law of cooling), andθ s is the temperature of the far-field surface (for example,

a container surrounding the flow) with which radiative exchange is made The Stefan–

Boltzmann constant isB = 5.67 × 10 −8 W

m2−K; 0≤ P ≤ 1 is the emissivity, which indicates

how efficiently the surface radiates energy compared to a black-body (an ideal emitter);

0 ≤ h cis the convection coefficient (Newton’s law of cooling); anda s is the surface area

of a particle It is assumed that the radiation exchange between the particles is negligible.45

BecausedK dt = m˙v · v =  tot · v = P, we obtain a simplified form of the first law, dS

and therefore Equation (8.10) becomes

mC ˙θ = −h c a s (θ − θ o ) + mc v |b D · ("v f#ω − v)| − Ba s P(θ4− θ4

s ), (8.11) whereθ o = "θ f#ωis the local average of the surrounding fluid temperature

Remark To account for the convective exchange between the fluid and the particles,

we amend the source term in Equation (8.7) for the fluid to read

z f = z D = c v |b f · ("v f#ω − v)| + h c a s (θ − θ m o ) (8.12)

45 Various arguments for such an assumption can be found in the classical text of Bohren and Huffman [33].

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86 Chapter 8 Coupled particle/fluid interaction

If the fluid is “radiationally” thick, then we assume that no radiation enters the system from the far field, namely, thatBa s Pθ4

s = 0 in Equation (8.11), and that any emission from the particle gets absorbed by the fluid Thus, in that situation, we can again amend the source term to read

z f = z D = c v |b f · ("v f#ω − v)| + h c a s (θ − θ m o ) + Ba s Pθ4. (8.13)

Remark We assume that various phenomena, such as near-field interaction, particle

contact, interparticle friction, and particle thermal sensitivity, are similar for the wet and dry particulate flow problems, with the primary difference being that drag forces from the surrounding fluid need to be determined via numerical discretization of the Navier–Stokes equations, which is next.46

8.2 Numerical discretization of the Navier–Stokes equations

We now develop a fully implicit staggering scheme, in conjunction with a finite difference discretization, to solve the coupled system Generally, such schemes proceed, within a discretized time step, by solving each field equation individually, allowing only the corre-sponding primary field variable (ρ f,v f, orθ f) to be active This effectively (momentarily)

decouples the system of differential equations After the solution of each field equation, the primary field variable is updated, and the next field equation is solved in a similar man-ner, with only the corresponding primary variable being active For accurate numerical solutions, the approach requires small time steps, primarily because the staggering error accumulates with each passing increment Thus, such computations are usually computa-tionally intensive

First, let us consider a finite difference discretization of the derivatives in the governing equations where, for brevity, we write (L indicates the time step counter, v L

f

def

= v f (t),

v L+1

f def= v f (t + !t), etc.) for each finite difference node (i, j , k)

ρ f i,j,k,L+1 = ρ i,j,k,L f − !tx · (ρ f v f ) i,j,k,L+1 , Z(P f i,j,k,L+1 , ρ f i,j,k,L+1 , θ f i,j,k,L+1 ) = 0,

θ f i,j,k,L+1 = θ f i,j,k,L − !t(∇ x θ f · v f ) i,j,k,L+1

+

 !t

ρ f C f f : ∇x v f+ ∇x · (K f· ∇x θ f ) + ρ f z f )

i,j,k,L+1

,

v i,j,k,L+1 f = v i,j,k,L f − !t(∇ x v f · v f ) i,j,k,L+1+!t

ρ f

x · σ f + ρ f b f i,j,k,L+1 ,

(8.14)

46 Clearly, the wetting of the particle surfaces, breaking of hydrodymanic films, etc., are nontrivial, but are outside the scope of this introductory treatment.

...

(8.14)

46 Clearly, the wetting of the particle surfaces, breaking of hydrodymanic films, etc., are nontrivial, but are outside the scope of this introductory treatment.

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