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Coupling CFD and Analytical Modeling For Investigation of Monolayer Particle Resuspension by Transient Flows
Coupling CFD and Analytical Modeling For Investigation of Monolayer Particle Resuspension by Transient Flows
a r t i c l e i n f o a b s t r a c t
Article history: One of the main goals of public health studies is to determine the different factors affecting the
Received 12 March 2016 breathable air quality (BAQ). Particle resuspension can constitute significant threat to human health since
Received in revised form it results in the re-introduction of contaminated particles in the air after their deposition on surfaces.
19 May 2016
Particle resuspension by transient flows involves complex flows physics challenging its modeling.
Accepted 19 May 2016
Available online 20 May 2016
In the current work an analytical model is developed for modeling the probabilistic aspect of
monolayer particle resuspension by transient flows coupled with computational fluids dynamics model
predicting the stress variation on the surface. The developed analytical model incorporates the effect of
Keywords:
Monolayer particle resuspension
turbulent bursts, surface roughness in addition to the flow and particle/surface properties on monolayer
Transient flows particle resuspension. The coupling of the analytical and computational fluids dynamics models for
Turbulent bursts investigation of monolayer particle resuspension by transient flows was validated by published literature
Surface roughness data. Good agreement was obtained between literature data and models results revealing that the
Particle surface properties coupling between the analytical and computational fluid dynamics model is able of capturing the
principal physics affecting monolayer particle resuspension.
© 2016 Elsevier Ltd. All rights reserved.
http://dx.doi.org/10.1016/j.buildenv.2016.05.025
0360-1323/© 2016 Elsevier Ltd. All rights reserved.
2 C. Habchi et al. / Building and Environment 105 (2016) 1e12
fluctuating component of the lift force (referred to as the RRH particles are resuspended [23] and particle and flow hydrody-
model). By accounting for resonant energy transfer, RRH predicts namics close to surfaces have been modeled under variable con-
particle resuspension at lower velocities compared to models based ditions to assess particle resuspension [23,26]. However, knowing
on force/moment balances. However, the RRH model provides ac- the threshold velocity for particle resuspension does not allow the
curate predictions of resuspension in case of large particle di- tracking of the variation in time of particle resuspension. To our
ameters sensitive to vibration energy and not small particles [16]. knowledge, published modeling approaches have not proposed
Furthermore, RRH does not account for the drag force influence on transient particle resuspension modeling that considers the prob-
particle resuspension. Reeks and Hall [25] refined the RRH model abilistic effect of velocity fluctuation, surface roughness and parti-
by developing the ‘Rock‘n’Roll’ (RnR) model to include the effect of cle diameter variability. In addition, in the case of transient flows,
the drag force and to be valid for small particle diameters. Never- the time variation of surface friction velocity and its resulting effect
theless, the RnR is a 2-D model with the assumption of symmetric on mean and fluctuating components of the flow velocity near the
two-point asperity contact which limits its application to particular surface were not tackled by modeling although they are important
surface geometry. Besides, both RRH and RnR consider steady flows parameters for computing the variation of the resuspended fraction
with constant mean forces. with time. Thus, previous models cannot capture the different
A recent static model by Ibrahim et al. [23] overcame the ge- experimental observations of resuspension during transient flows
ometry and steady state constraints of the RnR, and discussed the [27,28].
possibility of three modes of particle resuspension involving the Modeling particle resuspension by transient flows is challenging
effect of turbulence bursts: direct lift-off, sliding, and rolling. The since it involves variation of the surface friction map with time in
dominant mode is reported to be the one requiring the less addition to the probabilistic effect created by turbulent bursts’
threshold friction velocity to occur [23]. events and surface roughness distribution. Therefore, proper
In ideal situation when factors affecting resuspension are not combination of analytical and numerical modeling should be used.
changing (e.g. turbulent flow fluctuations are absent, particles are In fact, particle resuspension is driven by removal forces and mo-
of uniform size, and surface roughness is constant), particle ments which are correlated empirically to surface shear magnitude
detachment occurs at one free stream velocity [23]. Nevertheless, in or friction velocity. However, surface shear stress distribution with
reality and because of the variability of these factors, resuspension position and time induced by transient flows involves complex
occurs over a range of velocities [23]. The threshold velocity for physics requiring substantial numerical computations using
particle detachment is defined as the velocity for which 50% of computational fluid dynamics (CFD). On the other hand, the
C. Habchi et al. / Building and Environment 105 (2016) 1e12 3
2. Methodology
computational cost.
u
The transient flow pattern are imposed as boundary condition to uþ ¼ (1b)
the developed CFD model using user-defined functions (UDF). A u*
robust CFD model that can accurately predict the airflow field and and u* represents the friction velocity given by
corresponding shear close to surfaces around deposited particles is
rffiffiffiffiffiffi
essential since it affects largely particle resuspension rates. There- tw
fore, the flow physics should be accurately modeled to capture u* ¼ (1c)
r
essentially turbulence effects and boundary layers development
near the surfaces and determine the corresponding shear stress where tw is the wall shear stress and r is the fluid density. The shear
distribution. The shear stress distribution constitutes a primordial distribution on the surface obtained from CFD is used as an input
factor since it represents the effect of the airflow pattern on particle for the analytical resuspension model.
resuspension. A tetrahedral unstructured grid was generated for its In the viscous sub-layer the mean normalized velocity can be
ability to adapt locally to fine flow scale structures in the devel- modeled [35] as
oping flow boundary layer region near surfaces of interest while
remaining coarse in regions of large flow structures away from the u* y
surfaces reducing the computational cost compared to structured
uþ ¼ yþ ¼ (1d)
n
grid, requiring a higher number of elements for equivalent mesh
refinement near the surfaces [32,33]. Fine element sizing and where y is the distance from the wall and n is the kinematic
inflation were used as mesh treatment for the surfaces because the viscosity.
control of the grid resolution close to the surfaces is essential to Within the viscous sublayer, the root mean square normalized
insure yþ values of the order of unity for resolution of the devel- fluctuating velocity u0þ
rms can be expressed as mentioned by Soltani
oping boundary layers. Enhanced wall treatment is selected with and Ahmadi [26]:
the turbulent RMS model to resolve accurately the developing
boundary layer. Mesh adaptation is performed to obtain yþ values u0þ þ
rms ¼ 0:25y þ 0:0325y
þ2
(1e)
in the required range (order of unity) for variable aerodynamics
The ratio of the maximum fluctuating velocity u0 max to the root
conditions to investigate accurately the flow physics for different
mean square fluctuating velocity was experimentally determined
airflow accelerations. For instance, a higher flow velocity requires a
by Johnson and Alfredsson [36] to be
larger mesh refinement near surfaces to maintain yþ values within
the recommended range. u0max
The Eulerian approach will be used to simulate air flow field ¼ 2:9 (1f)
u0rms
which can be considered as a continuous fluid [34]. ANSYS Fluent
software solves for the Navier-Stokes equations transformed to The velocity fluctuation at a certain position and time is variable
algebraic equations with different possible discretization schemes. and its occurrence can be modeled using a stochastic approach [31]
A second-order upwind discretization scheme is adopted for the as follows:
energy, momentum, turbulent intensity, and dissipation rate
equations. For pressure, the “PRESTO!” staggered scheme is u0 ¼ z u0rms (1g)
selected [31] and the SIMPLE algorithm couples the velocity and
pressure fields [31]. where z is a randomly distributed number following the normal
Gaussian distribution and u0rms is the root mean square (rms) fluc-
tuating velocity [31].
2.2. Analytical resuspension model The flow near the wall is dominated by eddies in the transverse
direction perpendicular to the stream wise flow leading to the
The surface shear map obtained from CFD was used as an input deviation of the flow within the viscous-sublayer from the main
for the developed analytical resuspension model. In fact, investi- flow direction [37]. Therefore, the vector of magnitude (Ut) parallel
gation of monolayer particle resuspension requires the determi- to the wall has two components ut (stream component) and wt
nation of the flow velocity and fluctuations at the particle center. As (transverse component). Hence Ut is given by
particles diameter range of interest for indoor air quality (IAQ) is in qffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffi qffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffiffi
micrometers, using only CFD modeling to resolve for velocity Ut ¼ u2t þ w2t ¼ u* uþ2 t þ wt
þ2
(1h)
variation at the particle center requires very high computational
time due to the needed very fine meshing which might not be According to Soltani and Ahmadi [26], the stream and transverse
realizable for sub-micrometers particle diameters. Furthermore, components u and w are correlated by the following equation:
many probabilistic factors affect monolayer particle resuspension
and require appropriate modeling. For this reason, the developed wþ ¼ 0:54uþ (1i)
CFD model was coupled with an analytical model to capture the
Replacing (1i) in (1h) gives
different physics affecting monolayer particle resuspension.
Ut ¼ 1:1365uþ u (1j)
2.2.1. Modeling of near wall velocity field
In order to account for turbulent bursts, flow fluctuations and
their effect on removal forces should be involved in the analytical
model. The stream wise velocity u can be divided into a mean u and 2.2.2. Forces and moments affecting resuspension
fluctuating u0 component as follows: Particle adhered to the surface is subjected to variable
competing forces and moments as shown in Fig. 2:
uþ ¼ uþ þ u0þ (1a)
a) The adhesive forces between the particle and the surface
where uþ represents the normalized stream-wise velocity given by b) The particle weight
C. Habchi et al. / Building and Environment 105 (2016) 1e12 5
c) The removal forces created by the flow which are mainly the position is essential for predicting resuspension rates and provided
drag and lift forces as input to the resuspension analytical model from the CFD model.
d) The surface stresses moment about the center O of the Once the shear stress variation on the surface is known, the friction
particle velocity, yþ values, velocities, forces and moments can be deter-
mined using Eqs. 1(aej) and 2(aee).
Micro-particles are embedded completely within the viscous
sublayer therefore their Reynolds number is relatively small so the 2.2.3. Modeling of resuspension condition
drag force FD can be modeled as reported by Stokes [23,26] as The condition of detachment depends on the mode of resus-
follows: pension (rolling, sliding, or lifting).
3 p f1 m dp a) Detachment by rolling:
FD ¼ Ut (2a.1)
Cc
0:5dp d FD þ aFL þ Ms a Fad;JKR þ W (3a)
2l
Cc ¼ 1 þ 1:257 þ 0:4e1:1dp =2l (2a.2)
dp where FD is the drag force, FL is the lift force, a is the particle/surface
contact area radius, d is the elastic deformation between the par-
where m is the fluid viscosity, f1 the correction factor found by ticle and the surface which can be neglected since (d <<< a) [26], Ms
O’Neill [38] to account for the wall effect, Cc the Cunningham is the surface stresses moment about the center of the particle, and
correction factor to account for the slip effect [31], dp the particle W is the particle weight.
diameter, l the molecular mean free path of air (equal to 0.07 mm The particle/surface contact area radius is given by
under normal pressure and temperature conditions) and Ut the
. 1=3
magnitude of the velocity vector at the particle center O parallel to
a ¼ 1:5p Wad d2p k (3b)
the wall (Fig. 2).
The surface stresses moment about the center of the particle is
given by Ref. [32]: where k is the stiffness constant depending on the particle/surface
materials and is given by
Ms ¼ 2 p m f2 Ut d2p (2b) 0
11
4 @ 1 sp
2
1 s2s A
where f2 is the correction factor found by O’Neill [38] to account for k¼ þ (3c)
3 Ep Es
the wall effect on the stress moment.
The lift force is given according to Saffman [39] by
where Ep, Es are the Young modulus of the particle and the surface
u *2 Utþ respectively; and sp ; ss are the Poisson ratio of the particle and the
FL ¼ 0:975r d3p (2c) surface respectively.
n
The adhesive force Fad,JKR between a particle and a smooth sur- b) Detachment by sliding:
face is modeled by the JKR theory [40] as
FD mf Fad;JKR þ W (3d)
Fad;JKR ¼ 0:75p dp Wad (2d)
where dp is the particle diameter, and Wad is the thermodynamic where mf is the static coefficient of friction.
work of adhesion which depend on the particle surface
combination. c) Detachment by lifting:
Surface roughness reduces the adhesive force and generally its
surface distribution obeys to the normal Gaussian distribution. The FL Fad;JKR þ W (3e)
roughness ratio Cr represents the ratio of the rough-to-smooth
surface pull-off forces which is equal to the rough-to-smooth ad-
hesive forces [23]. Cheng et al. [41] developed a theory to investi-
gate the effects of surface roughness on microparticle adhesion and 2.2.4. Probabilistic behavior of particle resuspension
represented graphically their main findings including the variation For each resuspension condition the threshold velocity, Ut,th can
graph of the reduction rate of the pull-off force 4r with the surface be determined. The lowest threshold velocity correspond to the
roughness standard variation. The reduction rate of the pull-off
force 4r is related to the roughness ratio Cr by the Eq. (2e.1)
allowing the determination of the Cr variation with surface
roughness:
Fp0 Fp Fp
4r ¼ ¼1 ¼ 1 Cr (2e.1)
Fp0 Fp0
where Fp0 and Fp are the pulleoff forces for smooth and rough
surfaces respectively.
Therefore, the reduced adhesive force Fad is given by
Friction velocity and/or shear stress variation with time and Fig. 3. Probability distribution of surface roughness.
6 C. Habchi et al. / Building and Environment 105 (2016) 1e12
dominant resuspension mode. Once Ut,th is determined, the prob- interaction with CFD, experimental literature information is needed
ability of resuspension Pr over the sample surface at a certain time t on transient monolayer particle resuspension and the effect of the
is driven by the surface roughness distribution probability pi, the particle and surface properties and airflow aerodynamics. For this
particle diameter distribution probability pj and the burst occur- reason, the published data of Ibrahim et al. [23,27] are used for the
rence resuspension probability pb,i,j which depend on the particle current model validation where they studied the effect of flow ac-
diameter and surface roughness combination expressed as celeration and particle and surface properties during transient
monolayer particle resuspension.
X
m X
n The experiments of Ibrahim et al. [23,27] were conducted in a
Pr ðtÞ ¼ pj *pi *pb;i;j ðtÞ (4a) wind tunnel consisting of a contraction section, an inlet section
j¼1 i¼1
(1 m long and a section area of 0.203 m 0.203 m), a test section
(1 m long) and a diffuser section. A glass substrate (0.105 m
where n and m are respectively the number of sub-intervals of
long 0.1 m width 0.00127 m thickness) of 17 Å average
surface roughness and particle diameter covering the total rough-
roughness standard deviation seeded with monolayer particle de-
ness and diameter ranges. The parameters pi and pj are the prob-
posit was placed in the wind tunnel test section [23,27]. Two par-
abilities of having the surface roughness and particle diameter
ticle types (stainless steel and glass) were used to investigate the
respectively in the interval of center i/j. The value of the probability
effect of different particle/surface combinations on transient
is equal to the hatched area under the curve as shown in Fig. 3
monolayer particle resuspension for a flow acceleration of 0.18 m/s2
which illustrates the probability distribution of surface roughness
[23].
as an example.
Ibrahim and Dunn [27] investigated by experimentation the
For each combination of surface roughness i and particle
effect of flow acceleration (varied from 0.01 to 23 m/s2) on particle
diameter j corresponds an adhesive force resulting in a threshold
detachment. They observed that as the flow acceleration increased
velocity Ut,th,i,j. The probability pb,i,j of resuspension by the flow is
above 0.3 m/s2, the detachment fraction decreased. To provide an
equal to the probability of having Ut higher than Ut,th,i,j and is given
explanation for their findings, Ibrahim and Dunn [27] measured the
by
instantaneous flow velocity at 80 mm from the surface for different
free stream accelerations. They noticed a delay of turbulence onset
pb;i;j ¼ 0 if Ut;th;i;j > Ut;max;i;j (4b)
with increased flow acceleration resulting in reduced occurrence of
turbulent burst events within the boundary layer. Table 1 sum-
pb;i;j ¼ 1 if Ut;th;i;j < Ut;min;i;j (4c) marizes the different boundary conditions from the experimental
set-up of Ibrahim et al. [23,27] that are used as inputs to our current
coupled CFD and analytical models for validation.
UZ
t;max;i;j
Simulations were performed of the fluid flow at the conditions
pb;i;j ¼ fb ðxÞ dx if Ut;min;i;j < Ut;th;i;j < Ut;max;i;j (4d) of the experimental set-up of Ibrahim and Dunn [27]. Fig. 4 illus-
Ut;th;i;j trates the CFD mesh treatment. A grid independence test was
conducted for appropriate mesh selection resulting in nearly
where Ut,max,i,j, Ut,min,i,j represent respectively the maximum and 4,034,000 elements. The wind tunnel bottom surfaces particularly
minimum velocity components parallel to the wall at the particle the sampling test surface were meshed with fine elements sizing of
center and fb(x) the Gaussian distribution function of Ut due to the 2 mm. Furthermore, five-layer inflation was used at surfaces and
occurrence of turbulent bursts events. mesh adaptation was performed to trap the flow physics for the
The detachment fraction DF represents the ratio of the number different accelerations studied.
of detached particles to the initial number of particles on the The ability of the current developed models in capturing the
seeded surface and its variation with time t can be computed ac- flow physics and transient boundary layer development near the
cording to the following expression: wall is assessed by comparing the near wall velocity variation with
Ndet ðt þ DtÞ Ndet ðtÞ þ Pr ðt þ DtÞ NðtÞ Ndet ðtÞ Pr ðt þ DtÞ ðNð0Þ Ndet ðtÞÞ
DF ðt þ DtÞ ¼ ¼ ¼ þ
Nð0Þ Nð0Þ Nð0Þ Nð0Þ (4e)
¼ DF ðtÞ þ Pr ðt þ DtÞ ð1 DF ðtÞÞ
time with CFD predictions. Then, Ibrahim et al. data [23] is used to
where Dt is the time step, Ndet(t) is the number of particles de- validate the predictions of the coupled CFD and analytical models of
tached from the sampling surface at time t, N (t) the number of the transient resuspension fraction from rough surface for different
particles remaining on the sampling surface at time t, and Pr(t þ Dt) particle/surface combinations by incorporating the probabilistic
the probability of resuspension over the sample surface at time factors affecting particle resuspension.
t þ Dt.
Table 1
Boundary conditions from the experimental set-up of Ibrahim et al. [23,27] used for model validation.
Boundary conditions from the experimental set-up of Ibrahim and Dunn [16,20]
Wind tunnel inlet section dimensions 1 m long; 0.203 m 0.203 m cross section area
Wind tunnel test section dimensions 1 m long; 0.203 m 0.203 m cross section area
Substrate dimensions 0.105 m long; 0.1 m width; 0.00127 m thickness
Airflow acceleration range [0.01 m/s2e23 m/s2]
Substrate material Glass
Average ratio of the rough to smooth surface 0.01
Standard deviation of the surface roughness height 17 Å
Type of deposits Monolayer deposition on glass substrate
Particles’ material Stainless steel/Glass
Stainless steel average diameter 70 mm
Glass average diameter 72 mm
Stainless steel density 8000 kg/m3
Glass density 2420 kg/m3
Stainless steel Young modulus 215 GPa
Glass Young modulus 80.1 GPa
Stainless steel poisson ratio 0.28
Glass poisson ratio 0.27
Adhesion energy of stainless steel on glass 0.15 J/m2
Adhesion energy of glass on glass 0.4 J/m2
In comparison with Ibrahim and Dunn findings [27], good increase of flow acceleration in accordance with the observation of
agreement was obtained for both accelerations as shown in Fig. 5 Ibrahim and Dunn [27].
with a relative error of the order of 10% showing that the CFD The transient shear stress variation on the surface is obtained
model is able to predict the effect of flow acceleration on sample from CFD allowing the determination of the friction velocity vari-
surface shear stress variation with free-stream Reynolds number ation with time from Eq. (1c). As the sample testing area was very
(Re ¼ rLU ∞
n ). Note that the free-stream Reynolds number is propor- small, no significant variation of the shear stress was recorded with
tional to time since the modeled flow has constant acceleration position. Then using Eqs. (1d)e(1f), the mean velocity, rms fluctu-
(Re ¼ rLan∞ t ). Thus, by proper mesh adaptation the CFD model can ating velocity, and maximum fluctuating velocity can be deter-
accurately predict the aerodynamics of the flow for variable ac- mined respectively as shown in Fig. 6.
celerations. A delay in the onset of turbulence is observed with the The instantaneous flow velocity is obtained by the summation
of the mean and fluctuating velocity components (Eq. (1aeb))
Fig. 5. Comparison of the mean velocity variation at 80 mm from the surface measured
by Ibrahim and Dunn [27] with the results obtained by coupling CFD and analytical
Fig. 4. CFD mesh treatment: a) 3D view; b) profile view; c) front view. models for a free stream acceleration of: a) 0.01 m/s2; and b) 23 m/s2.
8 C. Habchi et al. / Building and Environment 105 (2016) 1e12
Table 2
Parameters and their ranges for the parametric study or/and sensitivity analysis and
their range of variation.
Fig. 10. Effect of a) the particle diameter and b) particle density on the variation of the resuspended fraction with free-stream velocity.
shows the variation of the detachment fraction with respect to the stream velocity (Fig. 11a). Furthermore, the rate of particle resus-
free-stream velocity for variable surface roughness standard devi- pension variation with time is increased with reduced adhesive
ation. As the surface roughness standard deviation increases, sur- forces leading to narrower velocities range to reach 100%
face average roughness is increased and thus the mean adhesive resuspension. For surface roughness standard deviation lower than
force is reduced (Eq. (2e)) leading to higher resuspension rates 1 Å, the threshold velocity significantly increased such that no
for the same free-stream velocity. Furthermore, higher the surface particle detachment is observed for stream velocities lower than
roughness standard deviation, higher the surface maximum 12 m/s at the experimental conditions of Ibrahim and Dunn [27]
roughness explaining the initiation of resuspension at lower free (Fig. 11a).
Fig. 11. Effect of the a) surface roughness standard deviation and b) surface Young modulus of elasticity on the variation of the resuspended fraction with free-stream velocity.
C. Habchi et al. / Building and Environment 105 (2016) 1e12 11
Fig. 12. Effect of the flow acceleration on the variation of the resuspended fraction From the performed parametric study, the most affecting pa-
with time. rameters on particle resuspension are: the particle diameter, sur-
face roughness and flow acceleration. One widely used parameter
to characterize particle resuspension is the threshold velocity
3.2.2.2. Surface Young modulus of elasticity. The surface Young defined as the velocity required for resuspending 50% of the par-
modulus of elasticity is varied in the range of Young modulus for ticles. Fig. 13 shows the variation of threshold velocity with the
glass [50 GPa; 90 GPa] [43] and its effect on the resuspension increase of particle diameter, surface roughness, and flow acceler-
fraction with time is investigated. Fig. 11b displays the variation of ation which are the factors that govern the resuspension condition.
resuspension fraction with free stream velocity for different surface A sensitivity analysis is done on each of these factors to assess its
Young modulus. As the particle Young modulus of elasticity in- effect on particle resuspension.
creases, the contact radius between the particle and the surface is Fig. 13a illustrates the variation of the threshold velocity with
reduced (Eqs. (3b) and (3c)) and thus the moment of adhesive force particle diameter. It is observed that the rate of increase of
is reduced (Eq. (3a)) facilitating particle resuspension. However, as threshold velocity is accentuated with reduced particle diameter.
observed in Fig. 11b, particle resuspension is nearly insensitive to For instance, the threshold velocity is much more sensitive to the
the glass surface Young modulus within its variation range. variation of particle diameter for diameters below 50 mm (Fig. 13a).
Therefore, the sensitivity of resuspension to fine particle diameters
is higher than its sensitivity to coarse particle diameters.
Fig. 13b represents the threshold velocity variation with respect
to surface roughness standard deviation. The rate of increase of
threshold velocity is strengthened with reduced surface roughness.
In fact, it is shown in Fig. 13b that threshold velocity sensitivity to
surface roughness is significantly increased for roughness standard
deviation lower than 6 Å. Hence, the sensitivity of particle resus-
pension to surface roughness is much higher for relatively
smoother surfaces.
Fig. 13c shows the effect of flow acceleration on the variation of
threshold velocity. The rate of decrease of threshold velocity is
higher for smaller flow acceleration. For example, the slope of
decrease of threshold velocity becomes significant for flow accel-
eration below 2 m/s2. Thus, the sensitivity of particle resuspension
to the flow acceleration is more pronounced for smaller
acceleration.
4. Conclusion
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