1 Introduction
The tendency of granular material to acquire static charges in gas–solid flows has been known for a long time (Lacks & Mohan Reference Lacks and Mohan2011). This phenomenon is known as triboelectrification (or tribocharging for short). In many industrial systems, triboelectrification causes problems, such as wall sheeting in polyethylene reactors (Hendrickson Reference Hendrickson2006) and sparking in pneumatic conveying (Jones & King Reference Jones and King1991). On the other hand, some recent applications such as triboelectric separators (Zelmat et al. Reference Zelmat, Rizouga, Tilmatine, Medles, Miloudi and Dascalescu2013; Chen & Honaker Reference Chen and Honaker2015) and triboelectric generators (Fan, Tian & Wang Reference Fan, Tian and Wang2012; Kim et al. Reference Kim, Chae, Han, Lee, Ki, Oh, Lee, Kim, Jang and Baik2016; Wang Reference Wang2017) rely on triboelectrification.
The actual charge transfer mechanisms responsible for triboelectrification are poorly understood, and multiple theories exist (Lacks & Mohan Reference Lacks and Mohan2011). Currently the two most prominent theories are based on electron transfer (Harper Reference Harper1967) and ion transfer (McCarty & Whitesides Reference McCarty and Whitesides2008). In electron transfer theory, as the name suggests, electrons are transferred between material surfaces in contact based on the electric field at contact and the difference in the work functions of the two materials. Here, the work function refers to the energy needed to remove a single electron from the material surface (Harper Reference Harper1967). While the original electron transfer model (Harper Reference Harper1967) captures the triboelectric charging of metals fairly well, it is known to perform poorly for insulating materials (Lowell & Rose-Innes Reference Lowell and Rose-Innes1980). This led to the notion of effective work function values as phenomenological quantities to quantify the tendency of insulators to charge (Matsusaka et al. Reference Matsusaka, Maruyama, Matsuyama and Ghadiri2010). Whitesides and co-workers (Wiles et al. Reference Wiles, Fialkowski, Radowski, Whitesides and Grzybowski2004; McCarty, Winkleman & Whitesides Reference McCarty, Winkleman and Whitesides2007) suggested that mobile ions could also be responsible for triboelectrification. This theory is supported by the fact that triboelectrification of insulators correlates well with the hydrophilicity/hydrophobicity of surfaces (Schella, Herminghaus & Schröter Reference Schella, Herminghaus and Schröter2016) and that electron transfer could not explain the extent of charging in some experiments (Waitukaitis et al. Reference Waitukaitis, Lee, Pierson, Forman and Jaeger2014).
The most commonly used computational models for triboelectrification are based on the aforementioned concept of the effective work function difference or contact potential difference between surfaces (Harper Reference Harper1967; Matsuyama & Yamamoto Reference Matsuyama and Yamamoto1995; Tanoue et al. Reference Tanoue, Tanaka, Kitano and Masuda2001; Matsusaka et al. Reference Matsusaka, Maruyama, Matsuyama and Ghadiri2010; Laurentie, Traoré & Dascalescu Reference Laurentie, Traoré and Dascalescu2013; Korevaar et al. Reference Korevaar, Padding, Van Der Hoef and Kuipers2014; Mizutani, Yasuda & Matsusaka Reference Mizutani, Yasuda and Matsusaka2015; Grosshans & Papalexandris Reference Grosshans and Papalexandris2016, Reference Grosshans and Papalexandris2017). Other modelling approaches described in the literature include particle-polarization-based charging (Pähtz, Herrmann & Shinbrot Reference Pähtz, Herrmann and Shinbrot2010; Siu et al. Reference Siu, Cotton, Mattson and Shinbrot2014; Yoshimatsu et al. Reference Yoshimatsu, Araújo, Shinbrot and Herrmann2016, Reference Yoshimatsu, Araújo, Wurm, Herrmann and Shinbrot2017b ), using the particle electron surface density (Duff & Lacks Reference Duff and Lacks2008), high- and low-energy electrons (Kok & Lacks Reference Kok and Lacks2009), particle-temperature-variation-based charging (Gu et al. Reference Gu, Wei, Su and Yu2013), and the saturation charge density of the surface limited by dielectric breakdown (Korevaar et al. Reference Korevaar, Padding, Van Der Hoef and Kuipers2014). These other approaches have mostly been targeted to explain triboelectrification of particles made of the same material when they are brought into repeated contact. In the present study, we are interested in analysing particle charging resulting from contact with bounding surfaces made of a different material, and so we do not pursue these alternate approaches, and focus instead on models based on the effective work function for triboelectrification.
The work-function-based model of Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) has been used previously to describe triboelectrification of granular material in both gas–solid flows (Kolehmainen et al. Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a ) and granular systems (Laurentie et al. Reference Laurentie, Traoré, Dragan and Dascalescu2010; Naik et al. Reference Naik, Saurabh, Vipul, Bruno, Abramov, Yu and Chaudhuri2015, Reference Naik, Sarkar, Hancock, Rowland, Abramov, Yu and Chaudhuri2016; Kolehmainen et al. Reference Kolehmainen, Sippola, Raitanen, Ozel, Boyce, Saarenrinne and Sundaresan2017b ). This model takes into account the electric field at the contact point, which has been shown to impact insulator triboelectrification (Zhou et al. Reference Zhou, Wang, Yang, Zhu, Niu, Lin, Liu and Wang2014; Mizutani et al. Reference Mizutani, Yasuda and Matsusaka2015). Furthermore, in the Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) model, charge acquired by a particle following repeated contact with a wall made of different material increases linearly with the surface area of the particle, which is consistent with a recent study by Chowdhury et al. (Reference Chowdhury, Sowinski, Ray, Passalacqua and Mehrani2018). Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) found good agreement with simulations and experiments when work function values were calibrated using experimental data. Naik et al. (Reference Naik, Saurabh, Vipul, Bruno, Abramov, Yu and Chaudhuri2015) used quantum chemical calculations to obtain work function values, and obtained decent agreement between the experiments and simulations of tribocharging of particles flowing in a chute. The main difference between the model by Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) and other work-function-based models (Pei et al. Reference Pei, Wu, England, Byard, Berchtold and Adams2013; Grosshans & Papalexandris Reference Grosshans and Papalexandris2016) is that Laurentie model takes into account the ambient electric field coming from many-body effects that has been shown experimentally to alter the triboelectrification (Zhou et al. Reference Zhou, Wang, Yang, Zhu, Niu, Lin, Liu and Wang2014).
Electrostatic effects in both granular and gas–solid flows have been studied widely in the literature experimentally (Mehrotra, Muzzio & Shinbrot Reference Mehrotra, Muzzio and Shinbrot2007; Park & Fan Reference Park and Fan2007; Sowinski, Mayne & Mehrani Reference Sowinski, Mayne and Mehrani2012; Jalalinejad, Bi & Grace Reference Jalalinejad, Bi and Grace2015; Lee et al. Reference Lee, Waitukaitis, Miskin and Jaeger2015; Fotovat et al. Reference Fotovat, Alsmari, Grace and Bi2016; Yang et al. Reference Yang, Ge, Zhou, Sun, Huang, Wang, Lungu, Liao, Jiang and Yang2018) and also numerically (Hogue et al. Reference Hogue, Calle, Weitzman and Curry2008; Hassani et al. Reference Hassani, Zarghami, Norouzi and Mostoufi2013; Kolehmainen et al. Reference Kolehmainen, Ozel, Boyce and Sundaresan2016; Yang et al. Reference Yang, Zi, Huang, Wang, Lungu, Liao, Yang and Su2016c ; Yoshimatsu et al. Reference Yoshimatsu, Araújo, Shinbrot and Herrmann2017a ). Conducting walls attract charged particles, which has been suggested as a mechanism for wall sheeting (Hendrickson Reference Hendrickson2006). Particle charging has been found to decrease the bubble size (Hassani et al. Reference Hassani, Zarghami, Norouzi and Mostoufi2013; Jalalinejad et al. Reference Jalalinejad, Bi and Grace2015), and has been found to affect fine particle entrainment in circulating fluidized beds (Fotovat et al. Reference Fotovat, Alsmari, Grace and Bi2016; Yang et al. Reference Yang, Zi, Huang, Wang, Lungu, Liao, Yang and Su2016c ). For further information on the electrostatics in fluidization the reader is referred to a recent review paper (Fotovat, Bi & Grace Reference Fotovat, Bi and Grace2017).
Eulerian modelling on electrically charged gas–solid flows has been limited to predefined charges. Al-Adel, Saville & Sundaresan (Reference Al-Adel, Saville and Sundaresan2002) studied fully developed gas–particle flows in vertical risers equipped with conducting walls and showed that particle charges led to lateral segregation of particles. In their analysis, the electrostatic force entered the particle-phase momentum balance as a body force. Rokkam, Fox & Muhle (Reference Rokkam, Fox and Muhle2010) performed transient simulations of a two-fluid model for flow of a mixture of gas and charged particles, where the electrostatic force was modelled as a body force to solid phase and the macroscopic polarization effects were accounted for by adjusting the mean electrical permittivity of the mixture. Jalalinejad et al. (Reference Jalalinejad, Bi and Grace2015), Jalalinejad, Bi & Grace (Reference Jalalinejad, Bi and Grace2016) used a similar approach to model a charged bubbling fluidized bed. Both Rokkam et al. (Reference Rokkam, Sowinski, Fox, Mehrani and Muhle2013) and Jalalinejad et al. (Reference Jalalinejad, Bi and Grace2016) concluded that the model was in good agreement with the experimental results when the particle charges (treated as input parameters) were assigned appropriately.
Two-fluid model equations can be derived from the Boltzmann equation of number density function of particles by ensemble averaging. For non-rarefied flows with a non-negligible number of collisions, the collision operator accounting for the rate of change of the number density function due to particle–particle collisions needs to be closed. Kinetic theory of granular flow (KTGF) achieves a closed form for the collision operator by assuming a known form for the number density function of particles (Jenkins & Savage Reference Jenkins and Savage1983; Lun et al. Reference Lun, Savage, Jeffrey and Chepurniy1984). The KTGF at an early stage assumed that the particle density function followed a Maxwellian velocity distribution (Jenkins & Savage Reference Jenkins and Savage1983; Lun et al. Reference Lun, Savage, Jeffrey and Chepurniy1984). More complex kinetic theories assume a perturbed Maxwellian distribution (Jenkins & Richman Reference Jenkins and Richman1985, Reference Jenkins and Richman1986; Boelle, Balzer & Simonin Reference Boelle, Balzer and Simonin1995).
While the original kinetic theory was developed for frictionless monodisperse particles (Jenkins & Savage Reference Jenkins and Savage1983; Lun et al. Reference Lun, Savage, Jeffrey and Chepurniy1984), it has been extended to include multiple particle species (Jenkins & Mancini Reference Jenkins and Mancini1989), inter-particle cohesion (Takada, Saitoh & Hayakawa Reference Takada, Saitoh and Hayakawa2016) and particle friction (Lun & Savage Reference Lun and Savage1987; Yang, Padding & Kuipers Reference Yang, Padding and Kuipers2016a ,Reference Yang, Padding and Kuipers b ). Kinetic theory has also been applied to heat transfer problems (Hsiau & Hunt Reference Hsiau and Hunt1993; Boateng & Barr Reference Boateng and Barr1996; Hunt Reference Hunt1997).
Charge transfer in the framework of the Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) model is very similar to heat transfer, with the exception of the electric field effect. In this work, we derive a model based on kinetic theory to describe the interplay between flow and charge transfer in a mixture of gas and a monodisperse assembly of identical particles, using the Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) model for charge transfer. The ensemble-averaged collision operator is decomposed into flux and source terms following Jenkins & Richman (Reference Jenkins and Richman1985). To close the resulting flux and source terms we assume a Maxwellian distribution for the number density function of particles. Since the Maxwellian-based formulation is known to underestimate diffusion, we include a self-diffusion term from Hsiau & Hunt (Reference Hsiau and Hunt1993) originally deduced for heat transfer. In addition, we propose a boundary condition for the particle charge at conducting solid walls and test the model and boundary condition against discrete element model (DEM) simulations.
2 Theoretical derivation
2.1 Particle number density function
Let
$f_{p}(\boldsymbol{x},\boldsymbol{c}_{p},q_{p},t)$
denote the number density function of particles at position
$\boldsymbol{x}$
with velocity
$\boldsymbol{c}_{p}$
and charge
$q_{p}$
. Hence, the number of particles with velocity between
$\boldsymbol{c}_{p}$
and
$\boldsymbol{c}_{p}+\text{d}\boldsymbol{c}_{p}$
and charge between
$q_{p}$
and
$q_{p}+\text{d}q_{p}$
at position
$\boldsymbol{x}$
and time
$t$
is given by
$f_{p}\,\text{d}\boldsymbol{c}_{p}\,\text{d}q_{p}$
. The evolution of the particle number density function follows the Boltzmann equation:
where
$\text{d}/\text{d}t$
is the rate of any particle property change along the particle path due to the exchange with the fluid and the influence of resolved fields. The notation
$\langle {\mathcal{G}}|\boldsymbol{c}_{p},q_{p}\rangle$
is the expected value
$\langle {\mathcal{G}}|c_{p,j}={\mathcal{C}}_{p,j},q_{p}={\mathcal{q}}_{p}\rangle$
, and
$(\unicode[STIX]{x2202}f_{p}/\unicode[STIX]{x2202}t)_{coll}$
is the rate of distribution function change due to particle–particle interactions.
2.2 Discrete particle equations
The Lagrangian approach provides a direct description of discrete phases by tracking particles of the system. By following Gatignol (Reference Gatignol1983) and Maxey (Reference Maxey1983), the equation of motion for an isolated particle can be written as
where the first term is the instantaneous undisturbed pressure gradient at the particle centre (Archimedes force) and
$g_{i}$
is the acceleration due to gravity in the
$i$
th direction. The third term represents the fluid–particle drag force. In (2.2),
$m_{p}=\unicode[STIX]{x1D70C}_{p}V_{p}$
is the mass of a particle,
$\unicode[STIX]{x1D70C}_{p}$
is the particle density,
$V_{p}$
is the particle volume and
$u_{g,i}$
is the gas velocity of the undisturbed flow. The relaxation time of a single particle
$\unicode[STIX]{x1D70F}_{p}^{\ast }$
is given by
where
$\unicode[STIX]{x1D70C}_{g}$
is the fluid density,
$C_{D}$
is the drag coefficient, given by Schiller & Naumann (Reference Schiller and Naumann1935) as
where
with
$\unicode[STIX]{x1D708}_{g}$
the kinematic viscosity of the gas and
$d_{p}$
the particle diameter. Here
$F_{e,i}$
is the electrostatic force, which is given by
where
$E_{i}$
is the resolved electric field and dielectrophoretic forces are neglected (LaMarche et al.
Reference LaMarche, Muzzio, Shinbrot and Glasser2010). The resolved electric field is computed by solving a Poisson equation
for the electrical potential
$\unicode[STIX]{x1D719}$
, where
$\unicode[STIX]{x1D70C}$
is the charge density and
$\unicode[STIX]{x1D716}$
is the (mixture) electrical permittivity. Then, the resolved electric field is obtained by taking the gradient of the electrical potential
$\unicode[STIX]{x1D719}$
:
2.3 Particle moment equations
The dispersed phase average of any function
$\unicode[STIX]{x1D713}(\boldsymbol{c}_{p},q_{p})$
can be obtained by integrating over the particle property space as
where
$n_{p}$
is the mean number of particles per unit volume, or namely particle number density given by
By definition, the mean velocity of particles is
and the fluctuating part of the disperse phase velocity is
The particle kinetic tensor is given by
The mean particle charge is
and the fluctuating part of the phase charge is
The charge variance is then given by
The correlations between the velocity fluctuations and the charge fluctuation are defined as
Enskog’s general equation for the change of a function
$\unicode[STIX]{x1D713}(\boldsymbol{c}_{p},q_{p})$
can be derived from the transport equation of the number density function (2.1) by integrating over the particle property space and using the relation
$n_{p}\,m_{p}=\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}$
, where
$\unicode[STIX]{x1D6FC}_{p}$
is the solid phase volume fraction, as
The mean collisional rate of change of the particle property
${\mathcal{C}}(m_{p}\unicode[STIX]{x1D713})$
is the change of
$(m_{p}\unicode[STIX]{x1D713})$
due to all collisions. The particle charge is not changed by the resolved field except during the contact. Thus,
and the last term in (2.18) drops outs.
2.4 Mass balance
$(\unicode[STIX]{x1D713}=1)$
The mass balance equation for the solid phase is given by
where
${\mathcal{C}}(m_{p})$
represents the exchange of mass between particles during collisions due to breakup and coalescence. In this study,
${\mathcal{C}}(m_{p})=0$
. It is also assumed in this study that there is no mass exchange between the solid and gas phases.
2.5 Momentum balance
$(\unicode[STIX]{x1D713}=u_{p,i})$
The transport equation for solid phase momentum is given by
$$\begin{eqnarray}\displaystyle \unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}\left[\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}t}+U_{p,j}\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}x_{j}}\right]U_{p,i} & = & \displaystyle {\mathcal{C}}(m_{p}c_{p,i}^{\prime })-\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}x_{j}}(\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}\langle c_{p,i}^{\prime }c_{p,j}^{\prime }\rangle )-\unicode[STIX]{x1D6FC}_{p}\frac{\unicode[STIX]{x2202}P_{g}}{\unicode[STIX]{x2202}x_{i}}\nonumber\\ \displaystyle & & \displaystyle -\,\unicode[STIX]{x1D6FD}(U_{p,i}-U_{g,i})+\frac{\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}}{m_{p}}\,Q_{p}\,E_{i}+\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}g_{i},\end{eqnarray}$$
where
$\unicode[STIX]{x1D6FD}=\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}/\unicode[STIX]{x1D70F}_{p}$
. The first two terms on the right-hand side represent the rate of exchange of momentum during collisions and the rate of transport of momentum by the velocity fluctuations, respectively. They are modelled together as the divergence of a solid phase effective stress tensor:
$-\unicode[STIX]{x2202}\unicode[STIX]{x1D6F4}_{p,ij}/\unicode[STIX]{x2202}x_{j}$
, where
Assuming a Maxwellian velocity distribution, one can deduce (Ding & Gidaspow Reference Ding and Gidaspow1990) that
and
Here,
$\unicode[STIX]{x1D6E9}$
is the granular temperature, defined as
$\unicode[STIX]{x1D6E9}=\langle c_{p,i}^{\prime }c_{p,i}^{\prime }\rangle /3$
,
$e_{c}$
is the coefficient of restitution for particle–particle collisions and
$g_{0}$
is the value of the radial distribution function at contact. The third and forth terms represent the interfacial force between phases. The fifth term is the electrostatic force acting on the solid phase and the last term is the gravitational force.
2.6 Transport equation for granular temperature
The transport equation for granular temperature has been derived in the literature by many authors. For the assumed Maxwellian velocity distribution, one obtains (Ding & Gidaspow Reference Ding and Gidaspow1990)
$$\begin{eqnarray}\displaystyle \frac{3}{2}\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}t}(\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}\unicode[STIX]{x1D6E9})+\frac{3}{2}\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}x_{i}}(\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}U_{p,i}\unicode[STIX]{x1D6E9}) & = & \displaystyle \frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}x_{i}}\left(\unicode[STIX]{x1D705}_{p}\frac{\unicode[STIX]{x2202}\unicode[STIX]{x1D6E9}}{\unicode[STIX]{x2202}x_{i}}\right)-\unicode[STIX]{x1D6F4}_{p,ij}\frac{\unicode[STIX]{x2202}U_{p,i}}{\unicode[STIX]{x2202}x_{j}}\nonumber\\ \displaystyle & & \displaystyle -\,12(1-e_{c}^{2})\frac{\unicode[STIX]{x1D6FC}_{p}^{2}\unicode[STIX]{x1D70C}_{p}\,g_{0}}{d_{p}\sqrt{\unicode[STIX]{x03C0}}}\unicode[STIX]{x1D6E9}^{3/2}-3\unicode[STIX]{x1D6FD}\unicode[STIX]{x1D6E9},\end{eqnarray}$$
with the granular temperature conductivity
$\unicode[STIX]{x1D705}_{p}$
given by
The derivation of the last term on the right-hand side of (2.26) assumes that the fluctuations in gas and particle velocities are uncorrelated (Ding & Gidaspow Reference Ding and Gidaspow1990). Modifications to this term as well as additional terms arise when these fluctuations are not uncorrelated (Koch & Sangani Reference Koch and Sangani1999; Gobin et al. Reference Gobin, Neau, Simonin, Llinas, Reiling and Sélo2003; Garzó et al. Reference Garzó, Tenneti, Subramaniam and Hrenya2012). We do not consider these refinements in the present study, although one can extend the analysis to include these additional terms.
2.7 Transport equation for particle charge
$(\unicode[STIX]{x1D713}=q_{p}/m_{p})$
Using (2.18), the balance equation for solid phase charge can be written as
The first term on the right-hand side represents the change of charge during collisions and its analytical evaluation will be given in the next section. The second term on the right-hand side represents the correlation between charge and velocity fluctuations. In this study, we limit our attention to systems where these fluctuations are essentially uncorrelated.
2.7.1 Collision kernel for triboelectric charging,
${\mathcal{C}}(q_{p})$
Following Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013), the rate of triboelectric charge transfer from particle
$i$
to particle
$j$
is modelled as
where
$\boldsymbol{k}$
is the unit vector that points from particle
$j$
to particle
$i$
,
$H(\cdot )$
is the Heaviside function,
${\mathcal{A}}_{ij}$
is the contact area between particles
$i$
and
$j$
during a collision,
$\boldsymbol{E}_{ij}$
is the electric field at the contact point,
$\unicode[STIX]{x1D711}_{i}$
is the effective work function of particle
$i$
,
$\unicode[STIX]{x1D6FF}_{c}$
is the electron transfer cutoff distance,
$e$
is the elementary charge and
$\unicode[STIX]{x1D700}_{0}$
is the electrical permittivity in a vacuum. Assuming that the contact area during the collision is independent of the charge transfer and the initial charge, one can solve equation (2.29) to obtain a formula for the charge transferred during the collision (see Kolehmainen et al.
Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a
):
where
$\unicode[STIX]{x1D6FC}_{q}$
is a geometrical quantity depending on the type of collision (Kolehmainen et al.
Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a
) and
${\mathcal{A}}_{max}$
denotes the maximum contact area during the collision.
Let us consider a binary collision between monodisperse particles
$p1$
and
$p2$
(
$\unicode[STIX]{x0394}\unicode[STIX]{x1D711}=0$
) with velocities
$\boldsymbol{c}_{p1}$
and
$\boldsymbol{c}_{p2}$
and charges
$q_{p1}$
and
$q_{p2}$
. The quantity
$\unicode[STIX]{x1D6FD}_{q}$
in (2.30) for particle–particle collisions is given by
where
$\boldsymbol{E}_{12}^{+}$
is the total electric field given by
with the resolved electric field
$\boldsymbol{E}_{12}$
(see (2.8)) at the contact point. The particle charges
$q_{p1}^{+}$
and
$q_{p2}^{+}$
after collision are given by
The maximum overlapping area
${\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})$
can be estimated by a Hertzian collision model as given by Kolehmainen et al. (Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a
)
where
$\boldsymbol{w}=\boldsymbol{c}_{p2}-\boldsymbol{c}_{p1}$
is the relative velocity between particles. The effective Young’s modulus, radius and mass in the above equations are defined by
where
$\unicode[STIX]{x1D708}$
is the particle Poisson ratio.
Following Jenkins & Richman (Reference Jenkins and Richman1985), the mean collisional rate of change of charge
${\mathcal{C}}(q_{p})$
can be written as
where the first term is collisional flux (representing the redistribution of
$q_{p}$
by particle–particle collisions) given by
and the second term is collisional source (representing the transfer of
$q_{p}$
during collisions) given by
with the joint number density function
$f_{p}^{\ast }$
The density function
$f_{p}^{\ast }$
can be written as
with an assumption of an uncorrelated motion of particles and
$g_{0}$
being the radial distribution function at the contact (see, for example, Jenkins & Savage Reference Jenkins and Savage1983). Approximating the number density functions via Taylor series and ignoring higher-order terms, one obtains
As noted earlier, in this study we assume an uncorrelated Maxwellian distribution for both velocity and charge, and write
$$\begin{eqnarray}f_{p}(\boldsymbol{c}_{p},q_{p},\boldsymbol{x},t)=n_{p}\underbrace{\frac{1}{(2\unicode[STIX]{x03C0}\unicode[STIX]{x1D6E9}_{p})^{3/2}}\exp \left[-\frac{(\boldsymbol{c}_{p}-\boldsymbol{U}_{p})^{2}}{2\unicode[STIX]{x1D6E9}_{p}}\right]}_{f_{p,c}}\underbrace{\frac{1}{(2\unicode[STIX]{x03C0}{\mathcal{Q}}_{p})^{1/2}}\exp \left[-\frac{(q_{p}-Q_{p})^{2}}{2{\mathcal{Q}}_{p}}\right]}_{f_{p,q}},\end{eqnarray}$$
where
$\unicode[STIX]{x1D6E9}_{p}$
is the granular temperature and
${\mathcal{Q}}_{p}$
is the variance of charge. They are given by
Substituting (2.31)–(2.38) into (2.40) and (2.41) and performing the integrations gives (see appendix A for details)
and
where the triboelectric conductivity
$\unicode[STIX]{x1D70E}_{q}$
and the triboelectric diffusivity
$\unicode[STIX]{x1D705}_{q}$
are given by
and
where
$n_{p}$
is the number density given by
$\unicode[STIX]{x1D6FC}_{p}\unicode[STIX]{x1D70C}_{p}/m_{p}$
and
$\unicode[STIX]{x1D6E4}(\cdot )$
is the gamma function. The Soret-like term (Rahman & Saghir Reference Rahman and Saghir2014)
$Q_{p}(\unicode[STIX]{x2202}\ln ({\mathcal{Q}}_{p})/\unicode[STIX]{x2202}x_{i})$
is generally small compared to diffusion due to the gradient of the charge density, and will be neglected for the rest of this paper.
2.8 Self-diffusion of charge
The Maxwellian distribution is known to underpredict the diffusion coefficient
$\unicode[STIX]{x1D705}_{q}$
as it only accounts for the diffusion resulting from transfer of charge from one particle to another during contact. In reality, charge diffusion occurs through random motion of particles as well (Yang et al.
Reference Yang, Padding and Kuipers2016a
,Reference Yang, Padding and Kuipers
b
), which could be captured by postulating a perturbed Maxwellian distribution. In the present study, where we have limited our attention to only a Maxwellian distribution, we simply add the contribution due to self-diffusion of particles derived by Hsiau & Hunt (Reference Hsiau and Hunt1993) for heat conduction, which takes the following form in the case of charge diffusion:
With these modifications the charge transport equation becomes
2.9 Charge transfer boundary conditions
We now formulate boundary conditions for charge transfer at a conducting wall. Following Sakiz & Simonin (Reference Sakiz and Simonin1999), the particle velocity space in the immediate vicinity of the wall is split into two subdomains: particles moving towards the wall and particles moving away from the wall:
and
where
$\boldsymbol{k}$
is the normal vector at the wall pointing into the flow domain. The density function
$f_{p}$
can be also split in the same way into
$f_{p}=f_{p}^{+}+f_{p}^{-}$
, where functions
$f_{p}^{\pm }$
are given by
and
The numbers of reflected and incident particles are obtained by
and the corresponding partial averages are
The reflected and incident density functions
$f_{p}^{\pm }$
are connected by the kernel
$R(\boldsymbol{c}^{-},q_{p}^{-},\boldsymbol{c}^{+},q_{p}^{+})$
that denotes the probability of an incident particle with charge
$q_{p}^{-}$
and velocity
$\boldsymbol{c}_{p}^{-}$
being reflected with charge
$q_{p}^{+}$
and velocity
$\boldsymbol{c}_{p}^{+}$
(Cercignani Reference Cercignani1975):
As the reflected particle velocity and charge depend only on the incident quantities, we can write
where
$\unicode[STIX]{x1D6FF}(\cdot )$
stands for Dirac’s delta function; and
$\unicode[STIX]{x1D6EC}(\cdot )$
and
$\unicode[STIX]{x1D6F9}(\cdot )$
are functions depending on the particle–wall interaction model. For velocity
$\unicode[STIX]{x1D6F9}(\cdot )$
satisfies
where
$e_{w}$
is the particle–wall restitution coefficient.
According to the model by Laurentie et al. (Reference Laurentie, Traoré and Dascalescu2013) the reflected charge is (analogous to (2.33))
where
$\unicode[STIX]{x0394}\unicode[STIX]{x1D711}$
refers to the difference in the effective work functions of the wall material and the particle, and
$E_{w}$
is the prevailing electric field due to all sources other than the particle under consideration. Inserting (2.61), (2.62) and (2.63) into (2.60) gives
where
$J_{\unicode[STIX]{x1D6F9},\unicode[STIX]{x1D6EC}}$
is the determinant of the Jacobian matrix
$\unicode[STIX]{x2202}(\unicode[STIX]{x1D6F9},\unicode[STIX]{x1D6EC})/\unicode[STIX]{x2202}(\boldsymbol{c}_{p}^{-},q_{p}^{-})$
. Multiplying both sides of (2.64) by
$\text{d}q_{p}^{+}\,\text{d}\boldsymbol{c}_{p}^{+}$
, integrating, and invoking
$n_{p}=n_{p}^{+}+n_{p}^{-}$
leads to following connection between number density
$n_{p}$
and the incident number density
$n_{p}^{-}$
(for details, see Sakiz & Simonin Reference Sakiz and Simonin1999):
Furthermore, equation (2.64) can be used to connect the mean quantities:
$$\begin{eqnarray}\displaystyle \langle \unicode[STIX]{x1D713}(\boldsymbol{c}_{p},q_{p})\rangle & = & \displaystyle \frac{n_{p}^{-}}{n_{p}}\langle \unicode[STIX]{x1D713}(\boldsymbol{c}_{p},q_{p})\rangle ^{-}+\frac{n_{p}^{+}}{n_{p}}\langle \unicode[STIX]{x1D713}(\boldsymbol{c}_{p},q_{p})\rangle ^{+}\nonumber\\ \displaystyle & = & \displaystyle \frac{e_{w}}{1+e_{w}}\langle \unicode[STIX]{x1D713}(\boldsymbol{c}_{p},q_{p})\rangle ^{-}+\frac{1}{1+e_{w}}\langle \unicode[STIX]{x1D713}(\unicode[STIX]{x1D6F9}(\boldsymbol{c}_{p}),\unicode[STIX]{x1D6EC}(\boldsymbol{c}_{p},q_{p}))\rangle ^{-}.\end{eqnarray}$$
Assuming an uncorrelated Maxwellian distribution for
$f_{p}^{-}(\boldsymbol{c}_{p},q_{p},\boldsymbol{x},t)$
and inserting
$\unicode[STIX]{x1D713}=q_{p}$
into (2.66) we obtain the following relation for the incident mean charge
$\langle q_{p}\rangle ^{-}$
and the mean charge
$Q_{p}$
:
To estimate the charge transfer from a wall to particles we first write:
where
$\langle \unicode[STIX]{x0394}q\rangle ^{-}$
is the average charge transferred per collision,
$k_{i}$
is the wall normal unit vector pointing into the flow domain and
${\dot{n}}_{w}$
is the number of collisions per unit time per unit area. Equation (2.68) does not account for the correlation between the transferred charge and the likelihood of a particle experiencing a wall collision. We link the collision frequency to granular pressure divided by the average momentum transferred to the wall by a single particle:
The average charge transferred by a wall collision becomes
$$\begin{eqnarray}\displaystyle & = & \displaystyle \unicode[STIX]{x1D700}_{0}\left(\frac{\displaystyle \sqrt{2\unicode[STIX]{x03C0}}d_{p}\left(\frac{15\,m_{p}}{16Y^{\ast }\sqrt{r}}\right)^{2/5}\unicode[STIX]{x1D6E4}\left(\frac{9}{10}\right)}{2\sqrt[10]{2}}\unicode[STIX]{x1D6E9}^{2/5}\right)\nonumber\\ \displaystyle & & \displaystyle \times \,\left(\frac{\unicode[STIX]{x0394}\unicode[STIX]{x1D711}}{\unicode[STIX]{x1D6FF}_{c}e}-\frac{2\langle q_{p}\rangle ^{-}}{\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}}+E_{w,i}k_{i}\right).\end{eqnarray}$$
Collecting all the terms and rearranging yields
where the triboelectric conductivity at the wall
$\unicode[STIX]{x1D70E}_{q,w}$
is given by
$$\begin{eqnarray}\unicode[STIX]{x1D70E}_{q,w}=\unicode[STIX]{x1D700}_{0}\unicode[STIX]{x1D6FC}_{p}\left(1+2(1+e_{w})\unicode[STIX]{x1D6FC}_{p}g_{0}\right)\left(\frac{\displaystyle 6\left(\frac{15\,m_{p}}{16Y^{\ast }\sqrt{r}}\right)^{2/5}\unicode[STIX]{x1D6E4}\left(\frac{9}{10}\right)}{\sqrt[10]{2}(1+e_{w})d_{p}^{2}}\right)\unicode[STIX]{x1D6E9}^{9/10}.\end{eqnarray}$$
Equating the fluxes given by (2.49) and (2.73), and taking the dot product with the wall normal vector
$\boldsymbol{k}$
, yields a boundary condition for particle charge:
with the non-dimensional coefficient
$\tilde{\unicode[STIX]{x1D6FE}}_{q}$
being
$$\begin{eqnarray}\tilde{\unicode[STIX]{x1D6FE}}_{q}=\frac{\displaystyle \frac{\sqrt{\unicode[STIX]{x03C0}}\unicode[STIX]{x1D6E4}(19/10)}{2^{3/5}(1+e_{w})}\left(\frac{15m_{p}}{16Y^{\ast }\sqrt{r^{\ast }}}\right)^{2/5}\unicode[STIX]{x1D6E9}^{2/5}}{\unicode[STIX]{x03C0}d_{p}}.\end{eqnarray}$$
It should be noted that assuming
$\tilde{\unicode[STIX]{x1D6FE}}_{q}\approx 0$
would be equivalent to assuming that
$\langle q_{p}\rangle ^{-}\equiv Q_{p}$
. The case when
$\tilde{\unicode[STIX]{x1D6FE}}_{q}\geqslant 1$
describes physically a case where the particle charge transfer due to charge itself at conducting wall would be larger than the charge on the particle. In context of the present model, it would require the contact area during a wall collision to become comparable to or exceed the particle surface area, which is clearly not physically possible due to geometrical constraints. Hence,
$\tilde{\unicode[STIX]{x1D6FE}}_{q}$
is much smaller than unity for real systems.
2.10 Summary of model equations
The model equations are cast in dimensionless form using length
$L$
, velocity
$U_{c}$
, density
$\unicode[STIX]{x1D70C}_{p}$
, charge
$q_{eq}=\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}\unicode[STIX]{x0394}\unicode[STIX]{x1D711}/(2\unicode[STIX]{x1D6FF}_{c}e)$
(Kolehmainen et al.
Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a
) and electric potential
$\unicode[STIX]{x1D719}_{c}=q_{eq}L^{2}/(V_{p}\unicode[STIX]{x1D700}_{0})$
as characteristic quantities to obtain the following set of equations:
Here
$\tilde{g}_{i}=g_{i}/g$
, the Froude number
$Fr$
is given by
$Fr=U_{c}^{2}/(gL)$
, the gas phase Reynolds number is defined as
$Re_{g}=U_{c}L/\unicode[STIX]{x1D708}_{f}$
, the scaled gas–particle drag coefficient is
$\tilde{\unicode[STIX]{x1D6FD}}=L\unicode[STIX]{x1D6FD}/(\unicode[STIX]{x1D70C}_{p}U_{c})$
and
$\tilde{\unicode[STIX]{x1D707}}_{g}$
is the ratio of the effective fluid viscosity to the actual fluid viscosity.
The non-dimensional form of the particle-phase momentum equation becomes
where
and
$El$
denotes a scaled electrostatic force, referred here as the electrical inertial number, which is given by
$El=q_{eq}^{2}L^{2}/(\unicode[STIX]{x1D700}_{0}\unicode[STIX]{x1D70C}_{p}V_{p}^{2}U_{c}^{2})$
. The electrical inertial number can be viewed as the Eulerian counterpart of the non-dimensional electrical settling velocity
$v_{c}^{\ast }$
introduced by Karnik & Shrimpton (Reference Karnik and Shrimpton2012) for charged dilute turbulent gas–particle flows. The two have a connection:
when
$L=U_{c}/\unicode[STIX]{x1D70F}_{St}$
, in which
$\unicode[STIX]{x1D70F}_{St}$
is the Stokesian relaxation time and the
$U_{c}$
is the turbulent root-mean-square velocity.
The non-dimensional forms of granular temperature and charge transport equations become
$$\begin{eqnarray}\displaystyle & \displaystyle \hspace{-156.0pt}\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}\tilde{t}}\unicode[STIX]{x1D6FC}_{p}\tilde{\unicode[STIX]{x1D6E9}}+\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}\tilde{x}_{i}}\unicode[STIX]{x1D6FC}_{p}\tilde{U} _{p,i}\tilde{\unicode[STIX]{x1D6E9}}=\frac{\unicode[STIX]{x2202}}{\unicode[STIX]{x2202}\tilde{x}_{i}}\unicode[STIX]{x1D6FC}_{p}\tilde{\unicode[STIX]{x1D705}}_{p}\frac{\unicode[STIX]{x2202}\tilde{\unicode[STIX]{x1D6E9}}}{\unicode[STIX]{x2202}\tilde{x}_{i}}+\tilde{\unicode[STIX]{x1D70F}}_{p,ij}\frac{\unicode[STIX]{x2202}\tilde{U} _{p,i}}{\unicode[STIX]{x2202}\tilde{x}_{j}} & \displaystyle \nonumber\\ \displaystyle & \displaystyle \qquad \qquad \qquad \quad -\,(3(1-e_{c}^{2})g_{0})\unicode[STIX]{x1D6FC}_{p}^{2}\tilde{\unicode[STIX]{x1D6E9}}\left(\frac{4L}{d_{p}}\sqrt{\frac{\tilde{\unicode[STIX]{x1D6E9}}}{\unicode[STIX]{x03C0}}}-\frac{\unicode[STIX]{x2202}\tilde{U} _{p,i}}{\unicode[STIX]{x2202}\tilde{x}_{i}}\right)-3\tilde{\unicode[STIX]{x1D6FD}}\tilde{\unicode[STIX]{x1D6E9}}, & \displaystyle\end{eqnarray}$$
$$\begin{eqnarray}\displaystyle & \displaystyle \tilde{\unicode[STIX]{x1D705}}_{p}=\left(\frac{\displaystyle g_{0}(1+e_{c})\frac{d_{p}}{L}}{\sqrt{\unicode[STIX]{x03C0}}}\right)\unicode[STIX]{x1D6FC}_{p}\sqrt{\tilde{\unicode[STIX]{x1D6E9}}_{p}}, & \displaystyle\end{eqnarray}$$
$$\begin{eqnarray}\displaystyle & \displaystyle \tilde{\unicode[STIX]{x1D705}}_{q}=\frac{\displaystyle \left(2^{-6/5}\frac{5\sqrt{\unicode[STIX]{x03C0}}}{21}d_{p}^{2}\unicode[STIX]{x1D6E4}\left(\frac{12}{5}\right)\frac{r}{2}\left(\frac{15m_{p}}{16Y^{\ast }\sqrt{r/2}}\right)^{2/5}U_{c}^{8/10}\right)g_{0}\unicode[STIX]{x1D6FC}_{p}^{2}\tilde{\unicode[STIX]{x1D6E9}}_{p}^{9/10}}{LV_{p}} & \displaystyle\end{eqnarray}$$
Connecting with our earlier work Kolehmainen et al. (Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a
), the electrical inertial number can be expressed in terms of
$e/g=q_{eq}^{2}/(m_{p}g)/(4\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2})$
, the ratio that described the ratio of electrical forces at contact to gravitational force on particle and the Froude number as
The collisional triboelectric flux at the wall can be expressed in following non-dimensional form:
with
and
As can be seen from (2.98), the work function difference cancels out from the boundary condition due to the choice of
$\tilde{Q}_{p}=Q_{p}/q_{eq}$
. Hence, the non-dimensional charge
$\tilde{Q}_{p}$
remains independent of the effective work function difference if the system geometry or behaviour is left unchanged. However, the electrical inertial number does depend on the work function difference, and for significantly charged systems
$\tilde{Q}_{p}$
may depend on the effective work function difference in a complicated fashion (see Kolehmainen et al.
Reference Kolehmainen, Ozel, Boyce and Sundaresan2017a
).
Equating the non-dimensional collisional flux at the wall to the interior flux (
$-\tilde{\unicode[STIX]{x1D703}}_{i}=\tilde{\unicode[STIX]{x1D70E}}_{q}\tilde{E}_{i}+(\tilde{\unicode[STIX]{x1D705}}_{q}+\tilde{\unicode[STIX]{x1D705}}_{q}^{\ast })(\unicode[STIX]{x2202}\tilde{Q}_{p}/\unicode[STIX]{x2202}\tilde{x}_{i})$
) yields the boundary condition for the charge:
For very dilute flow, the contribution from the macroscopic electric field becomes weaker,
$\tilde{E}_{i}\approx 0$
and
$(\unicode[STIX]{x2202}\tilde{Q}_{p}/\unicode[STIX]{x2202}\tilde{x}_{i})k_{i}\approx 0$
. With these conditions, equation (2.99) leads to
$\tilde{Q}_{p}=1$
or
$Q_{p}=q_{eq}$
, which is consistent with the definition of the equilibrium charge. Equations (2.89), and (2.92) to (2.99) are the new results derived in the present study.
3 Validation test cases
In this section, we validate constitutive relations for triboelectric conductivity
$\unicode[STIX]{x1D70E}_{q}$
, triboelectric diffusivity
$\unicode[STIX]{x1D705}_{q}$
and the boundary condition for the charge transfer equation by using hard-sphere DEM simulation results. Details of the DEM code with tribocharging are given in appendix B. We consider two test cases: (i) transient simulations in a fully periodic domain with a specified initial spatial distribution of particle charges and (ii) a steady-state charge distribution in a periodic channel bounded by conducting walls in one of the directions.
3.1 Fully periodic domain
To test our Eulerian charge transfer model we performed simulations in a fully periodic box with elastic particles (
$d_{p}=250~\unicode[STIX]{x03BC}\text{m}$
,
$\unicode[STIX]{x1D70C}_{p}=1500~\text{kg}~\text{m}^{-3}$
,
$Y=0.5~\text{MPa}$
,
$\unicode[STIX]{x1D708}=0.42$
). The box had dimensions of
$192\,d_{p}\times 12\,d_{p}\times 12\,d_{p}$
. Simulations were performed for three different particle volume fractions:
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
,
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.25$
and
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
. Particles were distributed homogeneously and were assigned velocities randomly, consistent with a constant granular temperature
$\unicode[STIX]{x1D6E9}=0.01\,\text{m}^{2}~\text{s}^{-2}$
and zero mean velocity. The gas drag and electrostatic forces were neglected while solving for the motion of the particles; as a result, the particle distribution remained homogeneous at all times, while the spatial distribution of particle charge evolved with time. As the domain-averaged electric charge is zero at all times, the macroscopic electric field obtained by solving the Poisson equation is spatially periodic in the domain. This simplified problem allows us to test the validity of the charge transfer model.
Particles were assigned initial charges:
where
$x$
is the
$x$
coordinate of the particle and
$Q_{0}=10^{-15}\,\text{C}$
is the initial particle charge. Due to periodicity and the absence of mean convection of charge, the problem simplifies to
where
$a$
,
$b$
and
$c$
are constants depending on particle properties, volume fraction and granular temperature:
Equation (3.2) can be solved using sine series to obtain
where
$L$
is the box length and
$\unicode[STIX]{x1D6FE}_{n}$
are coefficients corresponding to initial charge distribution:
The analytical solution given by (3.6) was compared against hard-sphere DEM simulation results to validate the used approach.
As the value of the radial distribution function at contact
$g_{0}$
has a significant impact on the charge transfer rate, we computed it directly from the actual DEM data produced by the present simulations.
3.2 Periodic channel with conducting walls
To assess the validity of the boundary condition given by (2.99) we performed simulations in a periodic channel with dimensions
$L\times L_{p}\times L_{p}$
, where
$L_{p}=8\,d_{p}$
with particle diameter
$d_{p}=75~\unicode[STIX]{x03BC}\text{m}$
, and particle density
$\unicode[STIX]{x1D70C}_{p}=1500~\text{kg}~\text{m}^{-3}$
. The channel width
$L$
was varied, and we performed simulations for three different values:
$64\,d_{p}$
,
$128\,d_{p}$
and
$256\,d_{p}$
. Particles were frictionless and had a restitution coefficient of unity; hence there was no decay of kinetic energy. For each channel width, simulations were performed for three different solid volume fractions, namely
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
,
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.25$
and
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
, and one granular temperature
$\unicode[STIX]{x1D6E9}=0.01~\text{m}^{2}~\text{s}^{-2}$
. Channel walls were assumed to be made of a conducting material and were modelled with a constant electric potential boundary condition; the work function difference between the channel walls and particles was assumed as
$0.001\,\text{eV}$
(
$q_{eq}=15.6~\text{fC}$
). Lastly, particles and the walls had the same Young’s modulus of
$0.5~\text{MPa}$
and the same Poisson ratio of
$0.42$
.
The particle dynamics simulations were carried out following the same hard-sphere approach explained in appendix B with an exception that the channel was mirrored in the wall normal directions in order to use the spectral approach to determine the electric field. As in the test problem mentioned in § 3, the gas drag, gravity and electrostatic force acting on the particles were neglected so that the particle distribution remained uniform; this allowed us to focus on assessing the accuracy of the charge transfer boundary condition. The mesh size for the spectral method was set to
$2\,d_{p}$
in each direction. Particle dynamics simulations were continued until the total charge in the system and the charge profile had become steady, independent of time.
We solved the Eulerian model equations (equations (2.89), (2.90) and (2.99)) numerically by a finite-difference method employing
$128$
mesh points in the wall normal direction. Gradients in the periodic directions and the time derivatives were ignored as our interest lies in comparing the steady-state solution afforded by the Eulerian model with the results from the particle dynamics simulations. Gradient and divergence operators in the finite-difference formulation were discretized by a second-order central difference scheme, and the resulting linear algebraic problem was solved using Gaussian elimination. It should be noted that even though the physical properties were specified in dimensional form, the entire problem could easily have been stated in terms of dimensionless groups; presenting an example in dimensional terms still achieves the desired model assessment. The results in the following sections are presented in terms of dimensional quantities.
3.3 Comparison of Euler–Euler results with hard-sphere DEM simulations
Figure 1 shows both the periodic channel and box simulation results and the model predictions for
$0.25$
and
$0.35$
volume fractions. As can be seen from the figure, the developed model predictions are close to the particle dynamics simulation results for
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
, but differ slightly for moderate volume fraction
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.25$
. We noted the results become exact if the triboelectric conductivity
$\unicode[STIX]{x1D70E}_{q}$
was increased by
${\sim}10\,\%$
and
${\sim}20\,\%$
for the volume fractions
$0.35$
and
$0.25$
, respectively.
(a) Periodic box simulation with
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.25$
, (b) periodic channel with
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.25$
, (c) periodic box simulation with
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
and (d) periodic channel with
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
. The time for the periodic box is scaled by
$t^{\ast }=t\sqrt{\unicode[STIX]{x1D6E9}}/d_{p}$
and the charge in the beginning of the simulation is
$Q_{0}=\pm 10^{-15}$
. The equilibrium charge for the channel simulations is
$q_{eq}=15.6\,\text{fC}$
. The channel width for the periodic channel simulations was varied and is given in the legend of (b) and (d). The radial distribution functions at contact were estimated from the DEM data and are
$1.8$
and
$2.5$
for
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.25$
and
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
, respectively.

(a) Periodic box simulation with
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
and (b) periodic channel with
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
. See figure 1 caption for details. The radial distribution function at contact is estimated from the DEM data and is
$1.6$
for
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
.

Figure 2 shows the periodic box and periodic channel simulation results for a lower volume fraction (
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
) along with the predictions of the Eulerian model. The model predictions diverge further from DEM simulations results. It was found that the source of difference in the results originated from underpredicting the triboelectric conductivity for this volume fraction by
${\sim}40\,\%$
.
In the periodic domain simulations, the charge density profile remains mostly flat in each half-domain, but decreases in magnitude with increasing time, with transition occurring in a relatively short distance at the boundaries of the half-domains. This pattern can readily be attributed to the dominance of the triboelectric charge conductivity term (which appears through the first term on the right-hand side of (3.2)) in this validation example. This test problem provides a satisfactory validation of the model for triboelectric charge conductivity.
In the wall-bounded tribocharging example, we found that both
$\unicode[STIX]{x1D705}_{q}$
and
$\unicode[STIX]{x1D705}_{q}^{\ast }$
should be taken into account to capture the spatial variation of charge density. At high particle volume fractions, triboelectric charge diffusivity
$\unicode[STIX]{x1D705}_{q}$
is more important than charge diffusion due to particle migration
$\unicode[STIX]{x1D705}_{q}^{\ast }$
, since
$\unicode[STIX]{x1D705}_{q}/\unicode[STIX]{x1D705}_{q}^{\ast }\propto (\unicode[STIX]{x1D6FC}_{p}g_{0})^{2}$
. At lower particle volume fractions,
$\unicode[STIX]{x1D705}_{q}^{\ast }$
contributes more than
$\unicode[STIX]{x1D705}_{q}$
. This test problem validates the wall boundary condition and the charge diffusivity models. Taken together, these two examples lend support to all the constitutive models proposed in this study.
Whereas the results from this study cannot be compared with any experiments directly, the higher charge observed at the wall is consistent with the findings of Sowinski et al. (Reference Sowinski, Mayne and Mehrani2012). In the proposed model, the charge distribution in the channel depends on the ratio of triboelectric diffusivity and triboelectric conductivity (
$(\unicode[STIX]{x1D705}_{q}+\unicode[STIX]{x1D705}_{q}^{\ast })/\unicode[STIX]{x1D70E}_{q}$
). The gradient of charge at the wall becomes steeper as the ratio of diffusivity to conductivity decreases. In particular, when Young’s modulus is decreased both
$\unicode[STIX]{x1D705}_{q}$
and
$\unicode[STIX]{x1D70E}_{q}$
decrease at the same rate, but
$\unicode[STIX]{x1D705}_{q}^{\ast }$
remains unchanged. Hence, for very stiff particles the charge profile would approach a flat line; variation would be confined to a thin boundary layer near the bounding wall and be uniform in the bulk.
4 Conclusions
In this study, we have derived an Eulerian triboelectric charge transfer model from the Boltzmann equation and a boundary condition for charge transfer at a conducting wall. The charge transfer model is closed by assuming a Maxwellian distribution for both particle charge and velocity and assuming that the two are independent. As the assumption of a Maxwellian velocity distribution is known to underestimate the diffusion coefficient, a correction is added following the same reasoning presented by Hsiau & Hunt (Reference Hsiau and Hunt1993).
The principal findings from the model derivation are that the combined effects of tribocharging and particle motion on charge transport can be understood through the following contributions: convection, triboelectric conductivity (
$\unicode[STIX]{x1D70E}_{q}$
), triboelectric diffusion (
$\unicode[STIX]{x1D705}_{q}$
) and charge diffusion through random motion of particles (
$\unicode[STIX]{x1D705}_{q}^{\ast }$
). Out of these,
$\unicode[STIX]{x1D705}_{q}^{\ast }$
is more significant than
$\unicode[STIX]{x1D705}_{q}$
. The analysis shows that the severity of the charge gradient near a boundary is determined by the ratio of triboelectric conductivity and charge diffusivity.
The derived transport equation for charge has a resemblance to a scalar transport equation in granular flows such as heat transfer between solid particles, with an exception of the electric field. The electric field term
$\unicode[STIX]{x1D70E}_{q}\boldsymbol{E}$
can be interpreted as a triboelectric current density and exhibits a similar mathematical form to electrostatics of conductors, where an electric field generates a current that depends on the metal conductivity. While Zhou et al. (Reference Zhou, Wang, Yang, Zhu, Niu, Lin, Liu and Wang2014) has shown that an external electric field modifies the triboelectric behaviour, there is no published study that measures the triboelectric current to the best of the authors’ knowledge. It remains to be shown experimentally that an external electric field spans a current in an agitated granular material.
The proposed Eulerian model was tested against hard-sphere DEM simulations in a fully periodic box with a prescribed initial charge distribution. We also carried out hard-sphere DEM simulations in a periodic channel with conducting walls to probe the validity of the boundary condition. The charge transfer model predicted the DEM results fairly well for high volume fraction (
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.35$
), but differed noticeably for low volume fraction (
$\langle \unicode[STIX]{x1D6FC}_{p}\rangle =0.15$
). The discrepancies in the results are attributed to the validity of the assumptions of Maxwellian distributions of particle charge and velocity for the low-volume-fraction flow regime. We have included a correction for the triboelectric charge diffusivity, but neglected the one for the triboelectric conductivity as there is no prior example for a similar mechanism from other disciplines of granular mechanics.
Our analysis assumes that there is no correlation between particle charge and velocity. This assumption is justified for high volume fraction and low electric field as follows. Particle charge and momentum are redistributed in a rapid fashion due to the high collision frequency, and the impulse due to the electric field has a negligible effect on particle motion. However, the scenario becomes different when particle–particle collisions are not abundant and the duration between sequential collisions is long. For the latter case, the electrostatic force can create a significant acceleration of particles between the collisions. Hence, it can be expected that for low solid volume fractions the particle charge and velocity would become correlated. The probability density function of particle velocity is also known to deviate from Maxwellian for low volume fractions, and therefore it is unlikely that the current model would work well for low volume fractions. This is also consistent with our comparisons with DEM simulations that showed increased deviation from the model predictions when solid volume fraction was decreased.
The present model accounts for electrostatic interactions between particles, but it does not take into account the effect of electrostatics on solid phase stresses. Furthermore, insulating particles exhibit dielectrophoresis (Siu et al. Reference Siu, Pittman, Cotton and Shinbrot2015) that increases the particle collision frequency in the direction of the electric field. This phenomenon would lead to a nonlinear relationship between the triboelectric current and the electric field as opposed to the linear relation used in this study. The charge diffusion would also become anisotropic as opposed to the isotropic coefficient derived in this work. These microscopic interactions are also likely to further alter solid phase stresses and granular temperature. Additionally, the microscopic triboelectric charging model used in this study lacks some experimentally identified properties, such as tribocharging between identical particles (Lee et al. Reference Lee, Waitukaitis, Miskin and Jaeger2015) or particle-size-dependent charging (Carter & Hartzell Reference Carter and Hartzell2017). These effects would increase the local variance of the particle charge, but in the present model charge variance affected the solution only via the Soret-like term, which was deemed negligible. Analysis of these effects will be pursued in future studies.
Although a Maxwellian form of probability density function is a reasonable assumption for homogeneous cases (cases considered in this study), the distribution function is expected to be different under gradients of solid phase velocity and granular temperature. A natural extension of this study will be to deviate the Maxwellian form by using Grad’s method (Jenkins & Richman Reference Jenkins and Richman1985). For dilute gas–solid flows with tribocharging, the correlation between particle charge and velocity should be accounted for. A possible approach to model the particle velocity–charge correlation is to decompose the particle charge into correlated and uncorrelated parts by following Février, Simonin & Squires (Reference Février, Simonin and Squires2005) and Fox (Reference Fox2014), and develop mesoscopic Eulerian transport equations for the correlated part of charge. It is also necessary to develop the transport equation for charge variance (similar to the transport equation for granular temperature) to account for the effect of a high charge density gradient on triboelectric conductivity and diffusivity. Additionally, typical industrial applications of triboelectric charging, such as triboelectric separators used for coal separation (Blissett & Rowson Reference Blissett and Rowson2012) or plastic waste recovery (Bendimerad et al. Reference Bendimerad, Tilmatine, Ziane and Dascalescu2009), involve particles with a size distribution and with different chemical and physical properties. To model such applications, the present model would need to be extended to include multiple different species, similar to Jenkins & Mancini (Reference Jenkins and Mancini1989).
Acknowledgements
This material is based upon work supported by the National Science Foundation grant no. CBET-1601986 and ExxonMobil Res. & Eng. Co.
Appendix A. Analytical derivation of charge transfer collisional kernel
The source term
$\unicode[STIX]{x1D712}(q_{p})$
for charge transfer vanishes since
$q_{p1}^{+}-q_{p1}+q_{p2}^{+}-q_{p2}\equiv 0$
due to charge conservation. The flux term
$\unicode[STIX]{x1D703}_{i}(q_{p})$
can be split into two integrals:
where
and
The first integral
$\unicode[STIX]{x1D703}_{1}(q_{p})$
can be simplified as
$$\begin{eqnarray}\displaystyle \unicode[STIX]{x1D703}_{1}(m_{p}q_{p}) & = & \displaystyle \int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,\left[\boldsymbol{E}_{12}\boldsymbol{\cdot }\boldsymbol{k}+\frac{q_{p2}-q_{p1}}{\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}}\right][\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\,\boldsymbol{k}f_{p1}f_{p2}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & = & \displaystyle \frac{n_{p}^{2}}{(2\unicode[STIX]{x03C0}\unicode[STIX]{x1D6E9}_{p})^{3}}\boldsymbol{E}_{12}\boldsymbol{\cdot }\int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}(\boldsymbol{k}\otimes \boldsymbol{k}){\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\nonumber\\ \displaystyle & & \displaystyle \times \,\exp \left[-\frac{(\boldsymbol{c}_{p1}-\boldsymbol{U}_{p})^{2}+(\boldsymbol{c}_{p2}-\boldsymbol{U}_{p})^{2}}{2\unicode[STIX]{x1D6E9}_{p}}\right]\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\nonumber\\ \displaystyle & = & \displaystyle \frac{n_{p}^{2}}{(2\unicode[STIX]{x03C0}\unicode[STIX]{x1D6E9}_{p})^{3}}\boldsymbol{E}_{12}\boldsymbol{\cdot }\unicode[STIX]{x1D644}^{v},\end{eqnarray}$$
since the charge contribution vanishes
The remaining integral of
$\unicode[STIX]{x1D703}_{1}(m_{p}q_{p})$
can be integrated by changing the variables from
$\boldsymbol{c}_{p1}$
and
$\boldsymbol{c}_{p2}$
to
$\boldsymbol{G}=\boldsymbol{c}_{p1}+\boldsymbol{c}_{p2}-2\boldsymbol{U}_{p}$
and
$\boldsymbol{w}=\boldsymbol{c}_{p1}-\boldsymbol{c}_{p2}$
which gives:
The innermost integration respect to
$\boldsymbol{k}$
can be calculated when the unit vector
$\boldsymbol{k}$
is expressed in spherical coordinates with respect to
$\boldsymbol{w}$
:
$$\begin{eqnarray}\boldsymbol{k}=\left[\begin{array}{@{}c@{}}\cos \unicode[STIX]{x1D711}^{\prime }\sin \unicode[STIX]{x1D703}^{\prime }\\ \sin \unicode[STIX]{x1D711}^{\prime }\sin \unicode[STIX]{x1D703}^{\prime }\\ \cos \unicode[STIX]{x1D703}^{\prime }\end{array}\right],\end{eqnarray}$$
where
$\unicode[STIX]{x1D703}^{\prime }$
is angle between
$\boldsymbol{k}$
and
$\boldsymbol{w}$
. This yields
$\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}\,\text{d}\boldsymbol{k}=w\,\cos \unicode[STIX]{x1D703}^{\prime }\sin \unicode[STIX]{x1D703}^{\prime }\,\text{d}\unicode[STIX]{x1D703}^{\prime }\,\text{d}\unicode[STIX]{x1D711}^{\prime }$
. Substituting these simplifies the
$\unicode[STIX]{x1D703}_{1}(q_{p})$
flux as:
$$\begin{eqnarray}\displaystyle \unicode[STIX]{x1D703}_{1}(q_{p}) & = & \displaystyle \frac{n_{p}^{2}}{2(2\unicode[STIX]{x03C0}\unicode[STIX]{x1D6E9}_{p})^{3}}\boldsymbol{E}_{12}\boldsymbol{\cdot }\int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}\,\unicode[STIX]{x1D64D}\unicode[STIX]{x1D6EC}\unicode[STIX]{x1D64D}^{\text{T}}w\,{\mathcal{A}}_{max}(w)\nonumber\\ \displaystyle & & \displaystyle \times \,\exp \left[-\frac{(\boldsymbol{c}_{p1}-\boldsymbol{U}_{p})^{2}+(\boldsymbol{c}_{p2}-\boldsymbol{U}_{p})^{2}}{2\unicode[STIX]{x1D6E9}_{p}}\right]\,\text{d}\boldsymbol{w}\,\text{d}\boldsymbol{G},\end{eqnarray}$$
where
${\mathcal{A}}_{max}(w)$
satisfies
${\mathcal{A}}_{max}(w)\cos ^{4/5}(\unicode[STIX]{x1D703}^{\prime })={\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})$
,
$\unicode[STIX]{x1D6EC}$
denotes the integral respect to
$\boldsymbol{k}$
and is given by
$$\begin{eqnarray}\unicode[STIX]{x1D6EC}=\int _{0}^{2\unicode[STIX]{x03C0}}\int _{0}^{\unicode[STIX]{x03C0}/2}\boldsymbol{k}\otimes \boldsymbol{k}\,\cos ^{9/5}\unicode[STIX]{x1D703}^{\prime }\sin \unicode[STIX]{x1D703}^{\prime }\,\text{d}\unicode[STIX]{x1D703}^{\prime }\,\text{d}\unicode[STIX]{x1D711}^{\prime }=\unicode[STIX]{x03C0}\left[\begin{array}{@{}ccc@{}}\frac{25}{168} & 0 & 0\\ 0 & \frac{25}{168} & 0\\ 0 & 0 & \frac{5}{12}\end{array}\right],\end{eqnarray}$$
and
$\unicode[STIX]{x1D64D}$
is a rotation matrix representing rotation that transforms
$\boldsymbol{w}$
parallel to
$z$
-axis. The velocity coordinates can be expressed also in terms of spherical coordinates:
and
With the change of variables, the flux
$\unicode[STIX]{x1D703}_{1}(q_{p})$
becomes
$$\begin{eqnarray}\displaystyle \unicode[STIX]{x1D703}_{1}(q_{p}) & = & \displaystyle \frac{n_{p}^{2}}{(2\unicode[STIX]{x03C0}\unicode[STIX]{x1D6E9}_{p})^{3}}\boldsymbol{E}_{12}\boldsymbol{\cdot }\int _{0}^{2\unicode[STIX]{x03C0}}\int _{0}^{\unicode[STIX]{x03C0}}\,\unicode[STIX]{x1D64D}\unicode[STIX]{x1D6EC}\unicode[STIX]{x1D64D}^{\text{T}}\sin \unicode[STIX]{x1D703}\,\text{d}\unicode[STIX]{x1D703}\,\text{d}\unicode[STIX]{x1D711}\nonumber\\ \displaystyle & & \displaystyle \times \int _{0}^{\infty }{\mathcal{A}}_{max}(w)\,\exp \left[-\frac{w^{2}}{4\unicode[STIX]{x1D6E9}_{p}}\right]w^{3}\,\text{d}w\nonumber\\ \displaystyle & & \displaystyle \times \int _{0}^{\infty }2\unicode[STIX]{x03C0}\exp \left[-\frac{G^{2}}{4\unicode[STIX]{x1D6E9}_{p}}\right]G^{2}\,\text{d}G.\end{eqnarray}$$
The first integral then becomes
where
$\unicode[STIX]{x1D644}$
is the identity tensor; the second integral is given by
and the third integral evaluates as
Collecting the results from (A 13)–(A 15) to (A 12) leads to
The second flux term in
$\unicode[STIX]{x1D703}_{2}(q_{p})$
can be simplified to
$$\begin{eqnarray}\displaystyle \unicode[STIX]{x1D703}_{2}(q_{p}) & = & \displaystyle \int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,(\boldsymbol{E}_{12}^{+}\boldsymbol{\cdot }\boldsymbol{k})[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\,\boldsymbol{k}f_{p1}f_{p2}\boldsymbol{k}\boldsymbol{\cdot }\unicode[STIX]{x1D735}\ln \frac{f_{p2}}{f_{p1}}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & = & \displaystyle \int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,\left[\boldsymbol{E}_{12}\boldsymbol{\cdot }\boldsymbol{k}+\frac{q_{p2}-q_{p1}}{\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}}\right]\nonumber\\ \displaystyle & & \displaystyle \times \,[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\,\boldsymbol{k}f_{p1}f_{p2}\boldsymbol{k}\boldsymbol{\cdot }\unicode[STIX]{x1D735}\ln \frac{f_{p2}}{f_{p1}}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & = & \displaystyle \int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,(\boldsymbol{E}_{12}\boldsymbol{\cdot }\boldsymbol{k})\boldsymbol{k}\,[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]f_{p1}f_{p2}\boldsymbol{k}\boldsymbol{\cdot }\unicode[STIX]{x1D735}\ln \frac{f_{p2}}{f_{p1}}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & & \displaystyle +\,\int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,\frac{q_{p2}-q_{p1}}{\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}}[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\,\boldsymbol{k}f_{p1}f_{p2}\boldsymbol{k}\boldsymbol{\cdot }\unicode[STIX]{x1D735}\ln \frac{f_{p2}}{f_{p1}}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & = & \displaystyle \boldsymbol{E}_{12}\boldsymbol{\cdot }\int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}\,{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]f_{p1}f_{p2}(\boldsymbol{k}\otimes \boldsymbol{k}\otimes \boldsymbol{k})\nonumber\\ \displaystyle & & \displaystyle \boldsymbol{\cdot }\,\unicode[STIX]{x1D735}\ln \frac{f_{p2}}{f_{p1}}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & & \displaystyle +\,\int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}{\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,\frac{q_{p2}-q_{p1}}{\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}}[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\,f_{p1}f_{p2}(\boldsymbol{k}\otimes \boldsymbol{k})\nonumber\\ \displaystyle & & \displaystyle \boldsymbol{\cdot }\,\unicode[STIX]{x1D735}\ln \frac{f_{p2}}{f_{p1}}\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2}\,\text{d}q_{p1}\,\text{d}q_{p2}.\end{eqnarray}$$
The first integral with the third rank tensor
$\boldsymbol{k}\otimes \boldsymbol{k}\otimes \boldsymbol{k}$
vanishes since integrations over an odd-dimensional tensor are zero. Expanding the natural logarithm of the particle density function ratios yields
As before, the integrations over the charge difference vanish, hence the third and fourth terms involving particle velocities integrate to zero. Hence, the second flux term becomes
$$\begin{eqnarray}\displaystyle \unicode[STIX]{x1D703}_{2}(q_{p}) & = & \displaystyle \frac{n_{p}^{2}}{(2\unicode[STIX]{x03C0}\unicode[STIX]{x1D6E9})^{3}}\nonumber\\ \displaystyle & & \displaystyle \times \,\int \frac{q_{p2}-q_{p1}}{\unicode[STIX]{x03C0}\unicode[STIX]{x1D700}_{0}d_{p}^{2}}\left(\frac{1}{2{\mathcal{Q}}_{p}^{2}}(q_{p2}^{2}-q_{p1}^{2})\unicode[STIX]{x1D735}{\mathcal{Q}}_{p}-\frac{1}{{\mathcal{Q}}_{p}}(q_{p2}-q_{p1})\unicode[STIX]{x1D735}Q_{p}\right)f_{p1,q}f_{p2,q}\,\text{d}q_{p1}\,\text{d}q_{p2}\nonumber\\ \displaystyle & & \displaystyle \cdot \,\int _{\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}>0}(\boldsymbol{k}\otimes \boldsymbol{k}){\mathcal{A}}_{max}(\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k})\,[\boldsymbol{w}\boldsymbol{\cdot }\boldsymbol{k}]\nonumber\\ \displaystyle & & \displaystyle \times \,\exp \left[-\frac{(\boldsymbol{c}_{p1}-\boldsymbol{U}_{p})^{2}+(\boldsymbol{c}_{p2}-\boldsymbol{U}_{p})^{2}}{2\unicode[STIX]{x1D6E9}_{p}}\right]\,\text{d}\boldsymbol{k}\,\text{d}\boldsymbol{c}_{p1}\,\text{d}\boldsymbol{c}_{p2},\end{eqnarray}$$
where
$f_{p1,q}$
and
$f_{p2,q}$
denote normal distribution density functions of charge with mean
$Q_{p}$
and variance
${\mathcal{Q}}_{p}$
.
The velocity integral (same as
$I^{v}$
) can be evaluated in the same way as done for
$\unicode[STIX]{x1D703}_{1}(q_{p})$
and becomes
$$\begin{eqnarray}\displaystyle I^{v} & = & \displaystyle \int _{0}^{2\unicode[STIX]{x03C0}}\int _{0}^{\unicode[STIX]{x03C0}}\,\unicode[STIX]{x1D64D}\unicode[STIX]{x1D6EC}\unicode[STIX]{x1D64D}^{\text{T}}\sin \unicode[STIX]{x1D703}\,\text{d}\unicode[STIX]{x1D703}\,\text{d}\unicode[STIX]{x1D711}\int _{0}^{\infty }{\mathcal{A}}_{max}(w)\,\exp \left[-\frac{w^{2}}{4\unicode[STIX]{x1D6E9}_{p}}\right]w^{3}\,\text{d}w\nonumber\\ \displaystyle & & \displaystyle \times \,\int _{0}^{\infty }2\unicode[STIX]{x03C0}\exp \left[-\frac{G^{2}}{4\unicode[STIX]{x1D6E9}_{p}}\right]G^{2}\,\text{d}G\nonumber\\ \displaystyle & = & \displaystyle \frac{20}{21}\unicode[STIX]{x03C0}^{2}\unicode[STIX]{x1D644}\times 2^{4/5}\,16\unicode[STIX]{x03C0}\,\unicode[STIX]{x1D6E4}\left(\frac{12}{5}\right)r^{\ast }\left(\frac{15m_{p}}{32Y^{\ast }\sqrt{r^{\ast }}}\right)^{2/5}\unicode[STIX]{x1D6E9}_{p}^{12/5}\unicode[STIX]{x03C0}\sqrt{\unicode[STIX]{x03C0}}\unicode[STIX]{x1D6E9}_{p}^{3/2}.\end{eqnarray}$$
The charge integration gives
and
Finally, the second flux term becomes
Appendix B. Discrete element modelling with tribocharging
We simulated the motion of colliding particles using a time-driven approach with a hard-sphere collision model. In the time-driven approach, we first predict particle positions at the beginning of the time step by
where
$\unicode[STIX]{x0394}t$
is the time step,
$\boldsymbol{x}_{i}^{(n)}$
is the particle position at time
$n\unicode[STIX]{x0394}t$
,
$\boldsymbol{c}_{i}^{(n)}$
is the particle velocity at time instant
$n\unicode[STIX]{x0394}t$
and
$\boldsymbol{x}_{i}^{(n+1)\ast }$
is the predicted particle location. If particles
$i$
and
$j$
overlap (
$\Vert \boldsymbol{x}_{i}^{(n+1)\ast }-\boldsymbol{x}_{j}^{(n+1)\ast }\Vert <d_{p}$
, where
$d_{p}$
is the particle diameter), the time is reversed for these two particles to first time of contact,
$(n+f)\unicode[STIX]{x0394}t$
, where
$0<f<1$
. Subsequently, particle velocities are updated according to the hard-sphere model:
and
where
$\boldsymbol{n}_{ij}$
is a unit vector pointing from particle
$i$
to particle
$j$
, and
$e_{c}$
is the restitution coefficient (
$e_{c}$
was set to
$1$
for DEM simulations). The particle position is then integrated from time
$(n+f)\unicode[STIX]{x0394}t$
to the current time step
$n+1$
with the updated velocities:
The charge transfer during a collision is given by (2.30) as
The charges of the particles are then updated as
and
For wall collisions, the particle
$j$
is treated as an mirrored particle with the same charge as particle
$i$
and a work function difference
$\unicode[STIX]{x0394}\unicode[STIX]{x1D711}$
between them.
The electric field at a particle position was computed by a spectral method (B 8):
Here, the symbol
$\boldsymbol{k}$
is the vector wavenumber,
$\unicode[STIX]{x1D70C}$
is the charge density, and
${\mathcal{F}}$
and
${\mathcal{F}}^{-1}$
refer to the Fourier and inverse Fourier transforms, respectively. The charge density in any computational cell is related to charges of all the particles in that cell as
$\unicode[STIX]{x1D70C}=\sum _{i}^{cell}q_{i}/V_{cell}$
, where
$V_{cell}$
is the volume of the computational cell.

