1. Introduction
The propensity of confined self-propelled particles to accumulate at boundaries is a trademark of active matter and has been reported in many experiments on bacterial suspensions (Berke et al. Reference Berke, Turner, Berg and Lauga2008; Gachelin et al. Reference Gachelin, Miño, Berthet, Lindner, Rousselet and Clément2013; Figueroa-Morales et al. Reference Figueroa-Morales, Miño, Rivera, Caballero, Clément, Altshuler and Lindner2015) as well as simulations based on various models (Hernández-Ortiz, Stoltz & Graham Reference Hernández-Ortiz, Stoltz and Graham2005; Elgeti & Gompper Reference Elgeti and Gompper2013; Li & Ardekani Reference Li and Ardekani2014). Several disparate mechanisms have been proposed in explanation, including wall hydrodynamic interactions (Berke et al. Reference Berke, Turner, Berg and Lauga2008) and scattering due to collisions with the walls (Li et al. Reference Li, Bensson, Nisimova, Munger, Mahautmr, Tang, Maxey and Brun2011), though recent theoretical efforts have shown that the mere interplay of self-propulsion, stochastic processes and confinement is sufficient to explain accumulation (Lee Reference Lee2013; Elgeti & Gompper Reference Elgeti and Gompper2015; Ezhilan & Saintillan Reference Ezhilan and Saintillan2015). With few exceptions, however, these models have necessitated particle diffusion, which in reality is nearly negligible in bacterial suspensions, where stochasticity in the dynamics takes instead the form of run-and-tumble random walks (Berg Reference Berg1993).
An understanding of the distribution of active particles in confinement is especially critical for determining the mechanical force per unit area exerted by the suspension on the boundaries, or the so-called ‘swim pressure’. This novel concept, which has received much scrutiny recently, describes the force that must be applied on containing osmotic walls to keep self-propelled particles confined. Models based on the virial theorem (Takatori, Yan & Brady Reference Takatori, Yan and Brady2014; Yang, Manning & Marchetti Reference Yang, Manning and Marchetti2014; Winkler, Wysocki & Gompper Reference Winkler, Wysocki and Gompper2015) and on direct calculations of the wall mechanical pressure (Solon et al.
Reference Solon, Stenhammar, Wittkowski, Kardar, Kafri, Cates and Tailleur2015b
) in infinite or semi-infinite collections of spherical swimmers have all arrived at a simple ideal-gas law
${\it\Pi}_{i}$
for the swim pressure in the limit of infinite dilution:
where
$n$
is the mean number density,
${\it\zeta}$
is the viscous drag coefficient of a particle and
$D_{t}=V_{0}^{2}/3{\it\lambda}$
is the long-time translational diffusivity of an unconfined run-and-tumble swimmer expressed in terms of its speed
$V_{0}$
and mean tumbling rate
${\it\lambda}$
(Berg Reference Berg1993). Equation (1.1) and its extension to finite concentrations have proven useful to explain motility-induced phase separation in suspensions of self-propelled colloids (Takatori et al.
Reference Takatori, Yan and Brady2014; Takatori & Brady Reference Takatori and Brady2015), though its general validity as a thermodynamic equation of state for the pressure of active matter remains controversial (Mallory et al.
Reference Mallory, Sarić, Valeriani and Cacciuto2014; Ray, Reichhardt & Olson Reichhardt Reference Ray, Reichhardt and Olson Reichhardt2014; Ginot et al.
Reference Ginot, Theurfauff, Levis, Ybert, Bocquet, Berthier and Cottin-Bizonne2015) and appears to be limited to unconfined spherical particles (Yang et al.
Reference Yang, Manning and Marchetti2014; Solon et al.
Reference Solon, Fily, Baskaran, Cates, Kafri, Kardar and Tailleur2015a
,Reference Solon, Stenhammar, Wittkowski, Kardar, Kafri, Cates and Tailleur
b
).
In this work, we analyse the simple case of a dilute suspension of athermal run-and-tumble spherical swimmers confined between two parallel flat plates. We propose in § 2 a kinetic model based on two probability density functions describing the spatial and orientational distribution of the particles inside the gap and at the walls, which are coupled via flux conditions and only account for the effects of swimming and orientation decorrelation by tumbling. Further, our model implicitly captures hard-wall steric interactions without resorting to a soft potential to describe wall collisions as in previous theories (Solon et al. Reference Solon, Fily, Baskaran, Cates, Kafri, Kardar and Tailleur2015a ,Reference Solon, Stenhammar, Wittkowski, Kardar, Kafri, Cates and Tailleur b ). A semi-analytical solution method is outlined in § 3, which provides the full probability density functions and allows for a direct calculation of the mechanical swim pressure exerted on the walls in terms of the polarization of the surface distributions. Results for the distributions and swim pressure are presented in § 4, where they are shown to compare very favourably with Monte Carlo simulations.
2. Problem definition and theoretical model
2.1. Problem formulation
As a minimal model for an active suspension in confinement, we consider a dilute collection of self-propelled spherical particles confined between two infinite parallel plates separated by a distance
$2H$
(see figure 1). The swimmers are non-Brownian and simply perform a run-and-tumble random walk: straight runs of duration
${\it\tau}$
at constant velocity
$V_{0}$
along the unit director
$\boldsymbol{p}$
alternate with instantaneous tumbling events causing random and uncorrelated reorientations of
$\boldsymbol{p}$
. The time
${\it\tau}$
between tumbles is an exponentially distributed random variate with mean
${\it\lambda}^{-1}$
, where the tumbling rate
${\it\lambda}$
is assumed to be independent of position and orientation. To elucidate the interplay between run-and-tumble dynamics and confinement, we focus on the dilute limit and entirely neglect interparticle interactions. Particle–wall interactions are purely steric: as a swimmer meets one of the two surfaces, the normal component of its swimming motion is cancelled by a hard-core repulsive force, causing it to stay at and push against the wall until a subsequent tumbling event reorients it into the bulk. Tumbling events occurring at the walls can lead to reorientation into the wall or into the bulk, so that a particle at a surface may need to undergo more than one tumble before it is able to escape.
Problem definition: run-and-tumble particles are confined between two flat plates separated by
$2H$
. The distribution of particles is a function of
$z$
and
$q=\boldsymbol{p}\boldsymbol{\cdot }\hat{\boldsymbol{z}}=\cos {\it\theta}\in (-1,1)$
. Orientations pointing towards the top and bottom walls are parametrized by
$q^{\uparrow }=q$
and
$q^{\downarrow }=-q$
respectively, both defined in
$(0,1)$
.
There are only two length scales in the problem: the mean run length
$\ell _{r}=V_{0}{\it\lambda}^{-1}$
and the channel width
$2H$
. We define their ratio as the Péclet number
$Pe=\ell _{r}/2H=V_{0}/2{\it\lambda}H$
, where the two limits
$Pe\rightarrow 0$
and
$Pe\rightarrow \infty$
describe weak and strong confinement respectively. Due to the symmetry of the problem, the distribution of particles in the channel only depends on two degrees of freedom: the wall-normal coordinate
$z\in (-H,H)$
and the wall-normal component of the particle director
$q=\boldsymbol{p}\boldsymbol{\cdot }\hat{\boldsymbol{z}}=\cos {\it\theta}\in (-1,1)$
. It is convenient to distinguish particles pointing towards the top and bottom walls, and to this end we divide the unit sphere of orientations into two hemispheres and define two distinct orientation coordinates
$q^{\uparrow }=q\in (0,1)$
and
$q^{\downarrow }=-q\in (0,1)$
for particles pointing up or down respectively, as depicted in figure 1.
The distribution of particles in the channel is then fully described by a bulk probability density function
${\it\psi}(z,q)$
and two surface probability density functions
${\it\psi}_{s}^{\uparrow }(q^{\uparrow })$
and
${\it\psi}_{s}^{\downarrow }(q^{\downarrow })$
, which are only defined over half of the orientations since the surfaces cannot sustain a concentration of particles pointing towards the bulk. By symmetry, we expect
for
$q^{\uparrow }=q^{\downarrow }$
. Next, we describe the coupled bulk/surface conservation equations satisfied by these distributions, together with the appropriate boundary conditions.
2.2. Bulk conservation equation
The steady bulk probability density function
${\it\psi}(z,q)$
satisfies the conservation equation
The left-hand side describes transport along
$z$
due to self-propulsion. Run-and-tumble dynamics is captured by the right-hand side, where the first term accounts for depletion due to swimmers tumbling away from orientation
$q$
and the second term for restoration due to swimmers tumbling from orientations
$q^{\prime }$
into
$q$
. It is also useful to define the orientational moments of order
$j$
of the bulk probability density function on the full sphere and on the upper/lower hemispheres of orientations as
and we note that the zeroth, first and second moments correspond to the concentration, polarization and nematic alignment fields:
By symmetry, it is straightforward to see that full moments of even order are even functions of
$z$
whereas those of odd order are odd functions. With these notations, the bulk conservation equation (2.2) simplifies to
Taking the zeroth and first orientational moments of (2.6) and applying symmetry conditions immediately shows that the polarization is zero and the nematic alignment is uniform across the channel:
where
$S_{0}$
is a constant independent of
$z$
.
2.3. Surface conservation equations
Similarly, conservation equations for the steady surface probability density functions at the walls can be written. We first define the surface concentration and polarization as
and note that the values of
$c_{s}$
and
$m_{s}$
are the same at both walls. With these notations, the conservation equation at the upper wall (
$z=+H$
) reads
and a similar equation holds at
$z=-H$
. The right-hand side in (2.9) describes tumbling processes at the wall. The left-hand side, on the other hand, captures the flux of particles that enter the surface from the bulk by self-propulsion, and is therefore proportional to the bulk probability density function
${\it\psi}(H,q^{\uparrow })$
next to the wall. Evaluating the zeroth and first moments of (2.9) yields simple relations between
$c_{s}$
and
$m_{s}$
and the values of the bulk moments in the vicinity of the wall:
2.4. Boundary condition and particle number conservation
Equation (2.9) can be interpreted as a boundary condition for orientations pointing into the wall. For orientations pointing away from the wall, the swimming flux away from the wall must be balanced by tumbling of particles from the surface towards the bulk. Simply stated, particles on the surface that tumble to an orientation pointing into the bulk are transported away by self-propulsion. This leads to the additional condition
As
$c_{s}$
is constant and finite, this condition suggests divergence and discontinuity of the bulk probability density function for orientations parallel to the wall (
$q^{\downarrow }\rightarrow 0$
), as will indeed be verified in our analytical solution and stochastic simulations. Taking the zeroth and first moments of (2.11) provides the two additional relations
Finally, the above system of equations for the bulk and surface distributions is supplemented by a constraint on the total number of particles in the channel:
where
$N$
is the particle number in a vertical slice of unit horizontal cross-section.
3. Method of solution and swim pressure calculation
3.1. Integral equation for the moments
We now outline a solution method for the system described in § 2. As a first step, we derive an integral equation relating the bulk orientational moments to the concentration field. The bulk concentration equation (2.6) can be viewed as a linear inhomogeneous ordinary differential equation for
${\it\psi}(z,q)$
, where
$q$
is a parameter. We solve it by the method of variation of constants, treating orientations
$q^{\uparrow }$
and
$q^{\downarrow }$
separately. After applying the boundary condition (2.11), we obtain a general expression for the bulk density function:
It should be noted that the bulk and surface concentrations
$c(z)$
and
$c_{s}$
both appear on the right-hand side and are still unknown. However, (3.1) shows that their knowledge entirely specifies the bulk distribution
${\it\psi}(z,q)$
. The bulk moments of order
$j$
on both hemispheres of orientations are immediately obtained by integration:
where
$\mathscr{E}_{j}$
is the exponential integral function defined as
Finally, the moment of order
$j$
on the full sphere of orientations can be shown to be
3.2. Concentration field and solution procedure
Setting
$j=0$
in (3.4) immediately provides an integral equation for the yet unknown concentration profile:
Dividing through by
$c_{s}$
, we obtain an equation for
$c(z)/c_{s}$
that can be solved numerically. For finite
$\ell _{r}$
, we find that an approximate solution is easily obtained iteratively by casting (3.5) in the form
$c_{k+1}(z)/c_{s}=f[c_{k}(z)/c_{s}]$
, starting with an initial guess which we take to be
$c_{0}(z)=0$
. In strong confinement (
$Pe\gtrsim 10$
), the solution converges in
$O(20)$
iterations, though more iterations are required in wider channels.
To complete the solution for the concentration field, the value of the surface concentration
$c_{s}$
must be calculated. Having previously obtained
$c(z)/c_{s}$
, it is easily evaluated by recasting the constraint (2.13) as
Knowledge of
$c(z)$
and
$c_{s}$
then directly provides all of the remaining variables. The bulk probability density function is given by (3.1), while the bulk partial and full moments can be calculated using (3.2) and (3.4). Finally, the surface orientation distribution is provided by (2.9) and the surface polarization by (2.10b
). Solutions obtained by this method are presented in § 4, where excellent agreement with results from Monte Carlo simulations will be shown.
3.3. Swim pressure calculation
The above formulation provides a direct way of estimating the swim pressure in the system, which is simply the force per unit area exerted by the particles at the walls as they push on the surface. Specifically, the normal component of the motion of each particle at the upper wall is resisted by a force
${\it\zeta}V_{0}q^{\uparrow }$
, where
${\it\zeta}$
is the viscous drag coefficient of one particle (Takatori et al.
Reference Takatori, Yan and Brady2014). Knowing the surface probability density function
${\it\psi}_{s}^{\uparrow }$
, an expression for the swim pressure is then easily found as
where
$m_{s}$
is the surface polarization. Combining (2.10b
) and (2.12b
) to solve for
$m_{s}$
yields a simple relation between the swim pressure and the second moment
$S_{0}$
of the bulk distribution function:
In bulk unconfined systems, previous models have led to the ideal-gas pressure
${\it\Pi}_{i}$
of (1.1), which contains no information on particle orientations due to isotropy but follows the same scaling as (3.8). To compare the two predictions, we define a dimensionless pressure as the ratio of (3.8) and (1.1):
where
$n=N/2H$
is the mean number density in our system. Here,
$\mathscr{P}-1$
quantifies the departure from the ideal-gas swim pressure. In an infinitely wide channel (
$Pe\rightarrow 0$
), the bulk distribution at the centreline is expected to be isotropic, implying
$S_{0}=n/3$
and therefore
$\mathscr{P}\rightarrow 1$
. This will be confirmed in our numerical results in § 4, where we also show that
$\mathscr{P}$
deviates from
$1$
when
$Pe>0$
as a result of confinement.
Concentration profiles across the channel for various values of
$Pe=\ell _{r}/2H$
: (a) full concentration
$c(z)$
and (b) partial ‘up’ concentration
$c^{\uparrow }(z)$
. The solid lines show the semi-analytical solution of § 3 and the symbols are Monte Carlo simulation results.
4. Results and comparison with simulations
4.1. Simulation method
To validate our model, we also performed Markov-chain Monte Carlo simulations of run-and-tumble swimmers between two hard walls. During a run of duration
${\it\tau}$
, the swimmer trajectory simply evolves as
$\boldsymbol{x}(t+{\rm\Delta}t)=\boldsymbol{x}(t)+V_{0}\boldsymbol{p}{\rm\Delta}t$
, where
${\rm\Delta}t$
is a short time step. Each run is then followed by a tumbling event, where the new orientation vector
$\boldsymbol{p}$
is picked randomly on the unit sphere. The time
${\it\tau}$
between two consecutive tumbles is drawn from an exponential distribution with cumulative distribution function
$F({\it\tau})=1-\exp [-{\it\lambda}{\it\tau}]$
. When a swimmer meets a wall, it remains there and continues to tumble until it reorients towards the bulk and swims away. Time-averaged bulk and surface probability density functions were extracted from orientational and spatial histograms, and convergence was checked with respect to
${\rm\Delta}t$
and to the duration of the simulation.
4.2. Theoretical and numerical results
Solutions for the bulk concentration profile are depicted in figure 2, where both the full concentration
$c(z)$
and the partial ‘up’ concentration
$c^{\uparrow }(z)$
are plotted for various values of the Péclet number, which measures the degree of confinement. The full concentration profiles in figure 2(a) show significant accumulation at the walls, with wall boundary layers whose thickness scales with
$\ell _{r}$
. An interesting and unique feature of non-interacting and non-aligning spherical run-and-tumble particles is that accumulation occurs in the absence of polarization, and
$m(z)$
is found to be strictly zero throughout the channel, as already derived in (2.7). A non-zero polarization would indeed lead to a net flux of particles in the wall-normal direction, which cannot happen in a confined athermal system, unlike in Brownian suspensions where this flux can be balanced by diffusion (Ezhilan & Saintillan Reference Ezhilan and Saintillan2015). The profiles also show the presence of a singularity in
$c(z)$
at the walls, which is a direct consequence of the boundary condition (2.11) and is also obvious from the solution (3.5) where
$\mathscr{E}_{1}(0)$
diverges. Concentration singularities were also predicted by Elgeti & Gompper (Reference Elgeti and Gompper2015), though their model did not capture orientation distributions. As confinement becomes significant and
$Pe$
increases, the bulk concentration decreases throughout the channel to reach nearly zero at
$Pe=200$
, indicating that strongly confined particles spend most of their time at the boundaries. Excellent quantitative agreement is obtained between theory and Monte Carlo simulations.
Figure 2(b) also shows the partial ‘up’ concentration obtained by only counting particles pointing towards the top wall. The asymmetry of the profiles and the singularity at the bottom wall indicate that on average there are more particles pointing away from the wall than towards it inside the wall accumulation layers. However, in order to satisfy no net polarization in the bulk, this implies that those particles pointing towards the wall are more strongly polarized than those pointing away. This point is confirmed in figure 3(a,b), showing the orientation distributions in the bulk in the vicinity of the top wall for orientations pointing away from and towards the wall. Figure 3(a) confirms the divergence of the bulk probability density in the neighbourhood of orientations parallel to the wall (
$q^{\downarrow }\rightarrow 0$
), as expected from boundary condition (2.11), which is also captured by the simulations. The presence of this discontinuity can be rationalized as follows: particles that leave the surface at an orientation
$q^{\downarrow }\gtrsim 0$
swim nearly parallel to the surface and therefore remain there much longer than particles leaving in other orientations. The distribution of particles pointing towards the wall in figure 3(b) shows no such singularity, but exhibits a weak finite peak at a critical value of
$q^{\uparrow }$
for an intermediate range of Péclet numbers between 5 and 50, whose physical origin remains unclear. The orientation distribution
${\it\psi}_{s}^{\uparrow }(q^{\uparrow })$
of particles on the top wall is shown in figure 3(c) and shows a preferential alignment normal to the wall rather than parallel to it. However, this distribution becomes nearly isotropic under very strong confinement (
$Pe=1000$
), for reasons that we elucidate below.
Bulk probability density at the top wall for (a) orientations pointing away from the wall and (b) orientations pointing towards it. (c) Surface probability density at the top wall as a function of
$q^{\uparrow }$
. The solid lines show the semi-analytical solution of § 3 and the symbols are Monte Carlo simulation results.
Taking moments of
${\it\psi}_{s}^{\uparrow }(q^{\uparrow })$
provides the surface concentration
$c_{s}$
and surface polarization
$m_{s}$
, which are plotted versus the Péclet number in figure 4(a,b). Both quantities increase with increasing confinement, but asymptote as
$Pe\rightarrow \infty$
. The asymptote for
$c_{s}$
is
$N/2$
, meaning that in very narrow channels the particles spend all of their time at the boundaries; indeed, the time
$2H/V_{0}$
it takes them to cross the gap is infinitesimal compared with the mean run time
${\it\lambda}^{-1}$
. This is also consistent with the decrease in the bulk concentration seen in figure 2(a). In this limit, particles tumbling away from one wall reach the other wall nearly instantaneously, leading to an isotropic surface orientation distribution in agreement with figure 3(c), hence the asymptote of
$N/4$
for the wall polarization.
(a) Surface concentration
$c_{s}$
, (b) surface polarization
$m_{s}$
and (c) dimensionless pressure
$\mathscr{P}$
as functions of the Péclet number
$Pe=\ell _{r}/2H$
. The solid lines show the semi-analytical solution of § 3 and the symbols are Monte Carlo simulation results.
Lastly, the dependence of the dimensionless swim pressure
$\mathscr{P}$
on the degree of confinement is illustrated in figure 4(c). In the limit of weak confinement (
$H\gg \ell _{r}$
or
$Pe\rightarrow 0$
), the swim pressure is seen to tend to the ideal-gas law of (1.1) in both our model and simulations:
$\mathscr{P}\rightarrow 1$
or
${\it\Pi}_{s}\rightarrow {\it\Pi}_{i}$
. This corresponds to the limit of a single wall where the gap width
$2H$
plays no role, and validates the results of previous studies in infinite or semi-infinite systems for which the expression for
${\it\Pi}_{i}$
was first derived (Takatori et al.
Reference Takatori, Yan and Brady2014; Solon et al.
Reference Solon, Stenhammar, Wittkowski, Kardar, Kafri, Cates and Tailleur2015b
). Confinement, however, causes a decrease in the swim pressure, which in fact tends to zero for fixed
$n$
in very narrow gaps. The high-
$Pe$
asymptote for
$m_{s}$
describes the limiting behaviour:
as
$Pe\rightarrow \infty$
(or
$H\rightarrow 0$
), which corresponds to
$N/2$
particles pushing with an average force of
${\it\zeta}V_{0}/2$
against each wall. The decrease in pressure and the details of the asymptote agree with the previous two-dimensional results of Yang et al. (Reference Yang, Manning and Marchetti2014), who also verified them in numerical simulations of self-propelled disks. They are also consistent with the study of Ray et al. (Reference Ray, Reichhardt and Olson Reichhardt2014), who analysed the force on two nearby parallel plates in an active particle bath and proposed that the pressure inside the gap in a one-dimensional system with constant run length varies as
${\it\Pi}_{i}/(1+Pe)$
.
4.3. Summary and discussion
We have presented a simple continuum model for a dilute suspension of spherical run-and-tumble particles confined between two hard walls and interacting via purely steric forces with the walls. The model improves upon our previous theory for confined Brownian suspensions (Ezhilan & Saintillan Reference Ezhilan and Saintillan2015) by allowing us to address the limit of zero temperature within a continuum framework and by incorporating a more realistic treatment of surface interactions and exchange processes between surfaces and the bulk. This description also provides a direct and simple way of calculating the mechanical swim pressure exerted on the walls and serves as a complementary approach to the work of Solon et al. (Reference Solon, Stenhammar, Wittkowski, Kardar, Kafri, Cates and Tailleur2015b ), where a continuous description of the same problem using a soft potential for wall interactions was used to calculate the pressure. We have outlined an elegant approach to derive a semi-analytical solution for the probability density functions, and demonstrated excellent quantitative agreement between our model and results from discrete Monte Carlo simulations.
Our theoretical predictions and simulation results have highlighted several striking features of confined suspensions of run-and-tumble particles, namely the presence of a singularity and discontinuity in the bulk probability density function for orientations nearly parallel to the walls in the near-wall region, and the existence of a concentration boundary layer of thickness of the order of
$\ell _{r}$
that actually diverges at the walls. Our pressure calculations were shown to match the recently proposed ideal-gas equation of state of active matter in wide channels, thus further validating this ideal-gas law and confirming the prediction that the precise nature of particle–wall steric interactions has no impact on the wall mechanical pressure for spherical particles (Solon et al.
Reference Solon, Stenhammar, Wittkowski, Kardar, Kafri, Cates and Tailleur2015b
). We demonstrated, however, that confinement leads to departures from this ideal behaviour and specifically to a decrease in the swim pressure, which in fact vanishes in the limit of an infinitely narrow gap when the mean number density is held fixed. In this case, we found that swimmers spend all of their time at the boundaries, which provides the basis for previous models of strongly confined systems that only account for the surface distribution of swimmers (Fily, Baskaran & Hagan Reference Fily, Baskaran and Hagan2014).
While capturing the salient features of confined active suspensions, the problem under consideration remained minimal. Yet, the kinetic model presented here could be further modified to incorporate other effects and provide a more realistic description of biological or synthetic active systems. In particular, many active particles are rod-shaped and therefore also incur an aligning torque as they interact with boundaries. Recent theoretical work has shown that the wall pressure is modified in that case and becomes dependent upon the details of particle–wall interactions (Solon et al. Reference Solon, Fily, Baskaran, Cates, Kafri, Kardar and Tailleur2015a ; Wysocki, Elgeti & Gompper Reference Wysocki, Elgeti and Gompper2015). In addition, experiments show that the surface-to-bulk tumbling of biological swimmers as well as certain types of synthetic swimmers is not uncorrelated but rather results in the preferential release of the particles near a specific angle (Volpe et al. Reference Volpe, Buttinoni, Vogt, Kümmerer and Bechinger2011; Kantsler et al. Reference Kantsler, Dunkel, Polin and Goldstein2013; Molaie et al. Reference Molaie, Barry, Stocker and Sheng2014). Incorporation of such details in our model is straightforward and would modify the distribution of particles near the walls, with unexpected consequences for the mechanical pressure. Our basic model, validated here in the dilute limit, could also be modified to account for hydrodynamic couplings and to study the structure of the self-generated flows and collective dynamics of interacting active particles in confinement. In more complicated problems such as the ones described above, a complete solution for the bulk and surface probability density functions may not be tractable semi-analytically. Orientational moment equations with a suitable closure model (Saintillan & Shelley Reference Saintillan and Shelley2013; Ezhilan & Saintillan Reference Ezhilan and Saintillan2015) probably would not perform well either because of the near-wall singularities in the bulk probability density function as well as complications arising from having to develop governing equations and closure approximations for the partial moments as opposed to the full ones. Extension of the present model to non-planar boundaries, whether concave or convex, is not straightforward either but would be of great interest for the theoretical description of active particle transport in complex geometries or of their interaction with and transport of passive payloads. This rich avenue is the focus of our current work.
Acknowledgements
The authors thank J. F. Brady for seminal discussions and A. Solon for insightful comments. This work was supported by NSF grants CBET-1532652 and DMS-1463965.