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Journal for Multiscale Computational Engineering, 12 (5): 451–463 (2014) A REDUCED COMPUTATIONAL MODEL FOR PREDICTION OF ELECTRICAL RESISTANCE IN FIBROUS COMPOSITES Xiaobo Guo, Yun-Bo Yi, * & Maciej S. Kumosa Department of Mechanical and Materials Engineering, University of Denver, Denver, Colorado 80208, USA * Address all correspondence to Yun-Bo Yi, E-mail: [email protected] The effective conductivity of a fibrous composite is investigated using the Monte Carlo simulation scheme and the finite-element method. The conductive fibers are modeled as randomly distributed resistors in a nonconductive matrix. The gap elements are constructed between neighboring fibers to model the interfiber contact. The resistance of a gap element is defined as a function of the gap distance and the contact area. The quantitative analysis is performed on the basis of an equivalent resistor network, and the relationships between the overall conductivity and various geometric parameters such as the volume fraction, the fiber aspect ratio, the fiber orientation angle, the tunneling effect, and the fiber length distribution, have been studied. The key results such as the percolation thresholds have been validated by the data reported in the literature. Compared to the full three-dimensional simulations, the reduced model presented in this work is computationally more efficient and can be used in other applications as well. KEY WORDS: fibrous composites, electrical resistance, finite element analysis 1. INTRODUCTION Conductive fibrous composites such as carbon nanotubes (CNTs) have been studied intensively in the literature. It has been demonstrated that CNTs can significantly increase the mechanical (Cheng et al., 2009), thermal (Zhou et al., 2010), and electrical (Thostenson et al., 2009) properties of composites because of their high stiffness, high thermal/electrical conductivity, as well as low weight. However, in some applications, the property change in the CNTs/composite can be a tradeoff that needs careful consideration. For example, Fig. 1 shows a new power trans- mission line consisting of Aluminum Conductor Composite Core (ACCC) (Alawar et al., 2005; Burks et al., 2011). In this composite the corrosion resistant E-glass/epoxy layer is used to prevent a direct electrical path between the aluminum conducting wires in the periphery and the conductive carbon fibers in the core, thus preventing the galvanic reaction (Peng and Nie, 2013) between them. The current design of the insulating layer has shown a relatively weak mechanical stiffness and is vulnerable to external mechanical loads. A potential method to increase the mechanical stiffness of the ECR/epoxy layer is adding CNTs. However, the addition of the conductive CNTs can raise the elec- trical conductivity in the composite and thus increase the probability of galvanic reaction. The overall addition of the conductive fiber contents should therefore be controlled below the percolation threshold (Bauhofer and Kovacs, 2009) to ensure that the barrier can still function as an electrical insulator. Prior researches in the field of electrically conductive fiber composite were mainly experimental (Yi and Choi, 1999; Chen et al., 2004). The manufacturing techniques of composite samples, experimental conditions, polymer matrix, and surface treatment were the main concerns in these studies (Iwashita et al., 2000). Analytical or semi- analytical solutions based on the effective medium theories and variational theories were also developed to investigate various effects on the effective conductivity (Xu, 2009, 2012). But it is usually difficult to apply these methods to a material system containing the filler with complex geometry, such as chopped short fibers. 1543–1649/14/$35.00 c 2014 by Begell House, Inc. 451

A Reduced Computational Model for Prediction of Electrical

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Journal for Multiscale Computational Engineering, 12 (5): 451–463 (2014)

A REDUCED COMPUTATIONAL MODEL FORPREDICTION OF ELECTRICAL RESISTANCE INFIBROUS COMPOSITES

Xiaobo Guo, Yun-Bo Yi,∗ & Maciej S. Kumosa

Department of Mechanical and Materials Engineering, University of Denver, Denver, Colorado80208, USA

∗Address all correspondence to Yun-Bo Yi, E-mail: [email protected]

The effective conductivity of a fibrous composite is investigated using the Monte Carlo simulation scheme and thefinite-element method. The conductive fibers are modeled as randomly distributed resistors in a nonconductive matrix.The gap elements are constructed between neighboring fibers to model the interfiber contact. The resistance of a gapelement is defined as a function of the gap distance and the contact area. The quantitative analysis is performed on thebasis of an equivalent resistor network, and the relationships between the overall conductivity and various geometricparameters such as the volume fraction, the fiber aspect ratio, the fiber orientation angle, the tunneling effect, and thefiber length distribution, have been studied. The key results such as the percolation thresholds have been validated bythe data reported in the literature. Compared to the full three-dimensional simulations, the reduced model presented inthis work is computationally more efficient and can be used in other applications as well.

KEY WORDS: fibrous composites, electrical resistance, finite element analysis

1. INTRODUCTION

Conductive fibrous composites such as carbon nanotubes (CNTs) have been studied intensively in the literature. Ithas been demonstrated that CNTs can significantly increase the mechanical (Cheng et al., 2009), thermal (Zhou etal., 2010), and electrical (Thostenson et al., 2009) properties of composites because of their high stiffness, highthermal/electrical conductivity, as well as low weight. However, in some applications, the property change in theCNTs/composite can be a tradeoff that needs careful consideration. For example, Fig. 1 shows a new power trans-mission line consisting of Aluminum Conductor Composite Core (ACCC) (Alawar et al., 2005; Burks et al., 2011).In this composite the corrosion resistant E-glass/epoxy layer is used to prevent a direct electrical path between thealuminum conducting wires in the periphery and the conductive carbon fibers in the core, thus preventing the galvanicreaction (Peng and Nie, 2013) between them. The current design of the insulating layer has shown a relatively weakmechanical stiffness and is vulnerable to external mechanical loads. A potential method to increase the mechanicalstiffness of the ECR/epoxy layer is adding CNTs. However, the addition of the conductive CNTs can raise the elec-trical conductivity in the composite and thus increase the probability of galvanic reaction. The overall addition of theconductive fiber contents should therefore be controlled below the percolation threshold (Bauhofer and Kovacs, 2009)to ensure that the barrier can still function as an electrical insulator.

Prior researches in the field of electrically conductive fiber composite were mainly experimental (Yi and Choi,1999; Chen et al., 2004). The manufacturing techniques of composite samples, experimental conditions, polymermatrix, and surface treatment were the main concerns in these studies (Iwashita et al., 2000). Analytical or semi-analytical solutions based on the effective medium theories and variational theories were also developed to investigatevarious effects on the effective conductivity (Xu, 2009, 2012). But it is usually difficult to apply these methods to amaterial system containing the filler with complex geometry, such as chopped short fibers.

1543–1649/14/$35.00 c⃝ 2014 by Begell House, Inc. 451

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FIG. 1: Schematic of ACCC used in power transmission lines.

The predictive computational modeling by using resistor networks in conjunction with the Monte Carlo schemehowever, has been proved very successful. The pioneering study in this area should be attributed to Kirkpatrick (1973),who developed both numerical (i.e., finite differential approximations) and analytical (i.e., Green’s function) models.In the numerical model, the conductive fillers are generated randomly in the nonconductive matrix and then modeledas resistors. The overall conductivity of the composite depends on the long chains formed by the connected fillers. Asa virtual experiment, such a model has the advantage of altering design parameters with a minimal cost.

It is well known that in addition to the volume fraction of fiber contents, the conductivity of a fibrous composite isalso determined by other characteristic parameters such as the fiber aspect ratio, orientation, shape, and distribution.Researches were conducted on the effect of CNTs’ aspect ratio and orientation distribution on the effective conduc-tivity using statistical continuum theory based on two-dimensional and three-dimensional models (Baniassadi et al.,2011). Yi et al. (2004) investigated the waviness effect of CNTs on the percolation threshold while Dalmas et al.(2006) applied the finite-element method to study the effective conductivity. A more comprehensive investigation byconsidering the effect of shear flow and the curvature of fibers was performed by Eken et al. (2011), who developeda resistor network model that is analogous to an electrical circuit. In addition, Zhang and Yi (2008) developed athree-dimensional resistor network model by using the finite-element method to discretize the surfaces of short fiberswith nonconductive cores covered by a layer of conductive coating. This model was successfully implemented forevaluating the effective conductivity under the effects of various morphological parameters.

The Monte Carlo simulation method itself, however, always involves some uncertainties in the solution due tothe scaling effects. Fish (2006) developed the computational homogenization theory to overcome this difficulty bybridging different scales in heterogeneous stochastic materials for a variety of solid mechanics problems (Fish andFan, 2008; Yuan and Fish, 2008). In particular, a multiscale computational approach compatible with conventionalfinite-element schemes was developed to exploit the similarity between the engineering global–local design practiceand multilevel approaches (Fish and Shek, 2000). This theory, based on a rigorous mathematical foundation, permitsconsideration of uncertainties in stochastic materials without exhausting the available computational resources (Fishand Wu, 2011).

When the size scale reaches submicrometer or nanometer, the electric charge transfer can occur between fibers viathe tunneling effect (Balberg and Binenbaum, 1987; Wang and Ogale, 1993). Some composites (Banerjee and Mandal,1995; Karasek et al., 1996) were reported to conduct at a much lower volume fraction than expected theoretically(Ezquerra et al., 1986; Scher and Zallen, 1970). According to the tunneling mechanism, fully explained by quantummechanics, electrons may pass through thin, insulating films in the gaps between adjacent fibers, thus the average gapdistance determines the electrical conductance of the dispersions (Jing et al., 2000). In the computational models, astrategy for appropriately modeling the tunneling effects would be to construct a number of “gap elements” aroundthe neighboring fibers. Each gap will have a gap resistance to take into account the tunneling effect.

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In the situations when the tunneling effect is completely absent, the conductance of the contacting surfaces playsan essential role in the overall conduction of the system. Mechanical deformations along the contact surfaces of fibersare also inevitable during the mixture and compression processes in manufacturing. When impermeable conductivelayers or the surfaces of fibers are involved, the contact resistance (Allaoui et al., 2009) may be significant. Theconcept of the gap elements or “gap resistors” can thus be employed to model the contact resistance that is determinedby the distance and the contact area as well

With the incorporation of these gap elements in the models discussed above, the goal of the current researchis to study various factors that affect the effective electrical conductivity and the associate percolation threshold. Areduced computational model is developed in this context. The research findings are not only useful in the industryapplications of the ACCC conductors aforementioned, but also applicable in the predictions of the material propertiesof other advanced composites that contain conductive fibers.

2. METHODS

2.1 Model Overview

The fundamental simulation model in the present study is based on the equivalent resistor network consisting ofrandom fibers, with each fiber modeled as a set of one-dimensional conductive elements. The resistance of eachelement is determined by the length, cross-sectional area, and the conductivity (or resistivity) of the material. Therandomness in the network is achieved by a few random parameters that determine the center locations and theorientation angles of each fiber, as shown in Fig. 2(a). The center coordinates (x, y, z) of a fiber and its orientationangles (θ, ϕ) are homogeneously and randomly generated inside a cubic specimen of side lengthL. θ representsthe angle in thex–y plane andϕ is the angle between the fiber centerline and thez axis. A pseudo-random numbergenerator is employed to produce a sequence of random parameters uniformly distributed on the interval [0, 1]. Eachfiber is assumed as a cylindrical geometry of constant length and diameter. The fibers are distributed according to theprescribed probability density functions that follow the standard Poisson process in statistical analysis. The exampleshown in Fig. 2(b) contains 200 random fibers of uniform length.

2.2 Interconnections among Fibers and Construction of Gap Resistors

The electrical resistance of a random fibrous network is determined by not only the resistances of individual fibersbut also those of the interconnections. In the present model, the interconnections among fibers are realized by theiroverlapping joints. Therefore, in addition to constructing the resistors to model separate fibers, gap elements havebeen introduced to simulate the contact resistances. When the distance of the centerlines of the two adjacent fibers

(a) (b) (c)

FIG. 2: (a) Cylindrical fiber in three-dimensional space.(b) Computational model showing 200 random fibers.(c) Fibers A and B are modeled as two separate resistors while a gap element is constructed at the nearest distancebetween them.

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come closer to the diameter (i.e., the two fibers touch each other), a gap element will be formed to connect the twofibers. Each gap element is a one-dimensional resistor connecting the two nodes located on a pair of neighboring fiberswhere the distance is the minimum between them. The overall resistance of the system is therefore a collective effectof the two types of conduction, as illustrated in Fig. 2(c). This model is named the reduced computational model sinceit is a resistor network model reduced from a three-dimensional configuration.

Accurate determination of the gap resistance is difficult due to the complicated conditions on the contact surfaces.Here we model the resistance of each gap element as a function of the gap distance, and the contact area which isalso a function of the distance itself. To find the distance, the two fibers in contact are represented by vectors in space,and it is not difficult to find the minimum distance between them via the analytic method. While the mathematicalsolution provides the distance between two infinitely long lines, a fiber of finite length always contains two end points.The minimum distance between the extended lines could be located outside these end points. To resolve this issue wedivide each fiber into a number of nodes, and the distance between each pair of the nodes was examined exhaustively.The minimum value among these distances is chosen as the gap distance between the two fibers. The method is notrestricted to linear fibers only, but also applicable to more complex geometries such as curly fibers. We can definea threshold of the distance beyond which the fibers can be considered as completely separate, and in this case thegap elements become redundant, as shown by the green lines in Fig. 3. When a fiber has no connections with theothers, the entire fiber becomes redundant and should be removed from the model. Elimination of the redundant gapelements or fibers has been completed according to a prescribed gap threshold, which in the current study is set to thefiber diameter,D, since the interconnections of fibers are realized by their overlapping joints. This value can also beadjusted to incorporate the tunneling effect, for example, in Fig. 3(d) the gap threshold value is set to be greater thanthe fiber diameter but could still be in the range of the tunneling effect.

Once the lengths of the gap elements are determined, the subsequent steps are needed to obtain the cross-sectionalarea of a gap element. This area is a function of both the distance and the angle between two fibers. In the limit, whenboth the distance and the angle are zero, the contact area is the product of the fiber length and the diameter. The anglecan be computed from the vector operations based on the two vectorsA andB formed by the fiber centerlines, asshown in Fig. 4. In particular, a vector is defined along the centerline of a fiber, and its length is the distance betweenthe two end points along its axis. The angle can be found from the scalar product of the two vectors as follows:

θ = arccos

(A · B|A||B|

)(1)

We establish a local coordinate system on one of the two fibers in contact, and define they axis to be the centerlineof the fiber and thez axis to be the normal direction perpendicular to the plane formed by the two fibers. The gapelement is then directed along thez axis. Assume that the two fibers form an angleθ and the distance between themis d. The surface equations of the two fibers can be written as

x2 + z2 = r2 (2)

and(x cos θ+ y sin θ)

2+ (z − d)2 = r2 (3)

wherer is the fiber radius. The profile of the overlapping region of the two fibers can be found by combining Eqs. (2)and (3), i.e.,

y =±√

x2 − d2 ± 2d√r2 − x2 − x cos θ

sin θ(4)

Apparentlythe projected area of the curve in thex–y plane is a function of the distanced and the angleθ betweenthe two fibers. By dividing the ranges of bothx andy into a number of small segments, the enclosed area of thecurve can be computed via summing the segments located in the interior of the region. In a special situation wherethe two fibers have a zero distance, the contact area will be a function ofθ alone, as shown in Fig. 5. In addition, afew representative configurations are presented in the same figure to illustrate how the enclosed area changes with theangle. This area is used as the cross-sectional area of the gap element in computing the effective conductivity.

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(a) (b)

(c) (d)

FIG. 3: (a) Searching scheme for the minimum distance between two fibers with the green line representing theminimum distance.(b) Schematic showing the case when the minimum distances are located at the end points ratherin the middle.(c) Green lines represent the redundant elements that are longer than the prescribed threshold distancewhile the red lines are the ones that should be retained in the model.(d) Randomly distributed fibers with gap elementsincorporated.

2.3 Finite-Element Model

It is known that the resistanceR of a wire linearly increases with sample length and decreases with sample area andthat the conductance is the reciprocal of the resistance. As a result the conductanceK is given by

K =Aσ

L(5)

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FIG. 4: Vector formation to determine the included angle between two fibers of arbitrary orientations.

FIG. 5: Contact areaS as a function of the angleθ between two fibers. Each fiber has a unit radius.(a) θ = 5◦, S =43.3770;(b) θ = 30◦, S = 7.5611;(c) θ = 60◦, S = 4.3654;(d) θ = 85◦, S = 3.7806.

whereL is the length andA is the cross-sectional area that is defined asA = π(D/2)2 for a circular section;σ is theconductivity. If we assume a unit conductivity for both fibers and gap resistors, the conductance is simply the ratioof the cross-sectional area to the length. The computational model that contains the fiber elements and gap elementsis first developed on the Matlab platform. The geometric periodic boundary conditions (i.e., the fibers across thecell boundaries are periodically placed on the opposite sides) are applied to minimize the effects of the boundaries.Since Matlab is not an ideal platform for finite-element analysis due to its slow speed in matrix operations, the modelparameters are exported to the commercial software code ABAQUSc⃝ for the subsequent finite-element analysis. Theinput file to ABAQUSc⃝ contains the nodal positions of the elements, the material properties of the conductive fibersand gap elements with the definitions of the gap contact. The element type here is one-dimensional continuum elementwith linear interpolating functions. Therefore the computational time is greatly reduced in comparison with a modelusing three-dimensional volumetric elements. A steady state heat transfer analysis is then performed to estimate theelectrical conductivity, due to the analogy in the mechanisms of electrical conduction and thermal conduction. Theboundary condition is specified in such a way that there is a unit voltage difference (i.e., unit temperature differencein the thermal analysis) between the two opposite sides of the unit cell in thez direction while the other sides areinsulated It can be easily shown that the computed reactive flux is equivalent to the overall conductance For a unit cellspecimen this conductance is the equivalent conductivity of the entire system.

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3. RESULTS AND DISCUSSION

3.1 Effects of Fiber Density

Figure 6 shows the effects of the fiber number and volume fraction on the electrical conductivity. The fibers aremaintained to have the same radius 0.03 and length 0.3, which are normalized by the side length of the simulationcell. These parameters were chosen because of the following considerations: (1) if the fibers are too long, individualfibers may penetrate the entire domain, yielding a trivial solution of the problem; (2) however, if the fibers are too short,a large number of fibers are required to reach percolation, resulting in an intensive computational effort. For example,if a shorter fiber length 0.1 were chosen, the number of fibers at the percolation point would be approximately 30times the number used in the current model. The total number of fibers to reach a sufficiently large conductivity wouldthen be around 20,000 based on the maximum fiber number involved in Fig. 6. Roughly speaking, it is quite commonfor a fiber to have pair connections with 20∼30 or even more neighboring fibers for a fiber density well above thepercolation threshold. That would require a discretization of each fiber into 20∼30 or more regular elements plus thegap elements. While the computation of percolation threshold for 20,000 fibers is not a major issue, the finite-elementmodeling of the conductivity would likely involve millions of elements when the interfiber connection or the tunnelingeffect is incorporated. Since the simulations are run for multiple times for each number of fibers, the total amount ofcomputational time will grow exponentially with the fiber number. It is well known that the percolation thresholdof fibers in terms of volume fraction is relatively small compared to other geometries such as spheres and disks;modeling fibers is actually more computationally intensive in that the number of fibers required to reach percolation issignificantly more than spheres or disks due to the small diameter of fibers. For example, for spheres of diameter 0.3,only about 20 spheres are needed to have percolation whereas the number of fibers for percolation is a few hundredaccording to Fig. 7(a). Due to the above reasons, a fiber length approximately one-third of the cell size was chosen toaccommodate multiple fibers across the domain; meanwhile the computational time was minimized.

From Fig. 6 it is obvious that the effective conductivity increases monotonically with the fiber number as well asthe volume fraction, because the total volume of the conductive material and the interconnections among fibers (thusthe probability of fibers to form a conducting chain) both increase as more fibers are added to the system. The errorbars show the variations in the result due to the randomness in the fiber locations and orientations. Twenty simulationswere run to obtain these error bars. The standard deviation varies between 1× 10−3 and 2× 10−3 in terms of thenormalized conductivity, or 2∼50% of the mean value of conductivity depending on the fiber density in the model.We also observed a decrease in the uncertainty when the fiber length was reduced. It has been found that as the fiber

(a) (b)

FIG. 6: Effective conductivityk (normalized by the conductivity of the fiber material) as a function of(a) the fibernumber and(b) the volume fraction.

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length fell below 0.1, the variation in the result became negligible. This is because more fibers are required to reachpercolation for shorter fibers, resulting in a reduction in the statistical variation. The electrical conductivity also showsthe threshold of fiber volume fraction for percolation in the vicinity of 10% in Fig. 6(b). Below this threshold, theconductivity is close to zero; above this threshold the result approximately follows a power-law form in a function ofthe fiber number/volume fraction. (The power-law relationship from the log–log plot in the same figure can clearly beseen.) These results are consistent with those found in the literature.

We compared the computed conductivity with the approximate homogenization theories including the Maxwellapproximation, self-consistent (SC) approximation, and the differential effective medium (DEM) approximation(Torquato, 2002). At higher volume fractions, good agreements were obtained. However, as the volume fractionapproaches the percolation threshold, none of these approximate solutions was even close to the computed result.For example, the SC asymptotic solution predicts a critical volume fraction of 33%, above which the conductivitybecomes nonzero (Tawerghi and Yi, 2009). It is much higher than the estimated value from the simulation in thisstudy. This is not surprising as it is well known that the homogenization theories are unable to determine the geomet-ric percolation threshold precisely. As a result, the conductivity at the vicinity of the percolation threshold estimatedfrom these theories is inaccurate in many circumstances.

3.2 Effect of Fiber Aspect Ratio

The effective conductivity as a function of the fiber number and volume fraction for various fiber aspect ratios isshown in Fig. 7. The range of the fiber number is set from 200 to 800, by varying the fiber diameter while maintainingthe same fiber length. Three different fiber aspect ratios have been under investigation: 7, 10, and 15. Assuming thesame fiber number used in different cases, the volume of the conductive material is proportional to the fiber diameter,and therefore it can be seen in Fig. 7(a) that the effective conductivity decreases with the fiber aspect ratio, due toa reduction in the total fiber volume. When the result is presented as a function of the volume fraction the effectiveconductivity increases with the aspect ratio for constant volume fractions, as shown in Fig. 7(b). This is because of thereduced percolation threshold at higher aspect ratios. The estimated threshold in terms of volume fraction is 7%, 5%,and 3% for the fiber aspect ratio 7, 10, and 15, respectively. These results are consistent with the conclusions fromthe fiber percolation model (FPM) developed by Piggot (1981), indicating that a fibrous composite with larger fiberaspect ratio and more random distribution of fibers becomes conductive at smaller volume fraction of fibers, resultingin a lower percolation threshold. These percolation threshold values also agree with those reported in the literature

(a) (b)

FIG. 7: Effective conductivityk (normalized by the conductivity of the fiber material) as a function of(a) the fibernumber and(b) the volume fraction for different fiber aspect ratios.

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related to percolation in elongated inclusions. For example, Garboczi et al. (1995) estimated the volume fractionthresholds of overlapping ellipsoids to be 13%, 8.7%, and 6.4% for aspect ratios of 7, 10, and 15, respectively. Thedeviations in the results of the current work from these values are due to the following reasons: (1) In the currentstudy the simulation cell has a finite size, as opposed to the calculation of actual percolation threshold that requires aninfinite domain. When the volume fraction is below the theoretical threshold of percolation, there is still a probabilityfor the fibers to form global clusters across a finite domain, leading to an underestimated threshold value from thesimulation; (2) The geometries being investigated are cylindrical fibers instead of ellipsoids of revolution. Cylindershave a greater probability of interconnection than ellipsoids due to the larger curvatures at the end portions, leadingto a higher percolation threshold. In this study, we did not have a chance to make a full comparison between thepredicted conductivity with experiments. However, the predicted critical volume fractions for conductivity of fibers ofvarious aspect ratios agree very well with those reported in the literature, as mentioned above. This has validated themethodology developed in the current study.

3.3 Effect of Fiber Orientation Angle

In the formation of a continuous network of conductive fillers throughout the insulating polymer matrix, the orientationof filler is an important factor affecting the bulk material properties, and practical applications may involve somecontrolling factors for fiber angles. In the limit, when the fillers are fully aligned, the material degenerates to a one-dimensional system. In the current study on the effects of fiber orientation, a constant orientation angleϕ was assumedfor all fibers. Figure 8 shows the effective conductivity as a function of the fiber orientation angleϕ. This angle isdefined as the angle between the fiber central axis and the direction of the gradient of the applied electric potential(along thez axis). We investigate the effective conductivity as a function ofϕ as it varies fromπ/18 (10◦) to 4π/9(80◦) with an increment ofπ/18 (10◦) each time. The angleθ formed by the projections of the fibers in thex–y planeremains to be randomly distributed. It is seen that the conductivity decreases with the orientation angleϕ. The littlebump at the beginning of the curve is mainly induced by the large variation in the result. It has also been noticedthat the standard deviation of the result varies with the fiber diameter. As the orientation angleϕ approaches 90◦, thefibers are directed in thex–y plane that is perpendicular to thez axis and the connections between the fibers in sucha plane do not contribute to the formation of conducting paths along thez axis; therefore the conductivity reachesits minimum value. Asϕ approaches zero, however, fibers are almost parallel to thez axis and thus aligned with thedirection of the electric potential. Therefore the chance of forming conducting paths is the greatest, leading to themaximum effective conductivity in the system.

FIG. 8: Effective conductivityk (normalized by the conductivity of the fiber material) as a function of the fiberorientation angleϕ, defined as the angle between the fiberz axis and the electric potential.

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3.4 Tunneling Effects

Conduction of fibers in an insulating polymer is a complicated phenomenon in reality. It has been found that twoconductors whose separation distance is large (≥100A) compared to atomic dimensions can see each other througha resistance controlled by the bulk resistivity of polymer itself. When the distance is sufficiently small (≤100 A),electrons may tunnel quantum-mechanically between conductive elements, leading to a lower resistance than would beexpected from the insulator alone (Sherman et al., 1983). The tunneling distance is a characteristic electrical propertyof the matrix polymer. Since the electrical transport process consists of several different mechanisms, determinationof the tunneling distance is usually difficult. In this study we tentatively investigated the case when the ratio of thetunneling distance was set to 1/4 of the fiber diameter, and Fig. 9 shows the tunneling effect as a function of the fibernumber compared to the scenario of no tunneling. The percolation threshold with tunneling is estimated via linearextrapolation of the curve and finding the intersection with the horizontal axis. The approximated threshold is 3%with tunneling and 7% without tunneling. The percolation threshold with tunneling is much lower than that withouttunneling, because there are more chances for fibers to form connected paths across the system in the former case. Thecomputational result is consistent with the theoretical study on the influence of the tunneling effect on the percolationthreshold when the fiber aspect ratio is set to 5 (Taya et al., 1998).

3.5 Effect of Fiber Length Distribution

It has been widely reported in the literature that some of the processing steps in the fabrication of short-fiber-reinforcedpolymeric composites can significantly reduce the fiber length through breakage, and the reduction of fiber lengthalters the properties of the composite (Piggot, 1981). For example, a substantial decrease in the fiber length in injectionmolding of short fiber thermoplastics was reported (Kamal et al., 1986; Zak et al., 2000; Taya and Ueda, 1987).Incorporation of statistical distribution functions such as the Weibull function for fiber length distribution can alsobe found in the literature (SadAbadi and Ghasemi, 2008). However, most of the discussions were related to themechanical properties such as elastic modulus and material strength. Some were related to the theoretical predictionsof percolation threshold of overlapping disks (Quintanilla and Ziff, 2007; Quintanilla, 2001). In the current study, abinary mixture of fibers of two different lengths, 0.3 and 0.4 (normalized by the simulation cell size), is assumed toinvestigate the effect of fiber length distribution on the electrical conductivity. The computed conductivity is presentedas a function of the fiber number in Fig. 10. In this binary system, the fiber numbers for the two different lengths arethe same and the cross-sectional areas are maintained uniform. The result is also compared with the corresponding

FIG. 9: Tunneling effect on the effective conductivity (normalized by the conductivity of the fiber material).

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FIG. 10: Effect of fiber length distribution on the effective conductivity (normalized by the conductivity of the fibermaterial).

monodisperse systems of constant fiber lengths. The figure shows the similar trend of conductivity as a function ofthe fiber number. For a monodisperse system with longer fibers, more interactions among fibers are expected, leadingto longer conducting chains and thus higher effective conductivities. Moreover, Fig. 10 has revealed that the effectiveconductivity of the binary system is approximately the average of the two composites with constant fiber lengths. Itimplies that for some transport properties such as electrical conductivity it is possible to approximate a polydispersesystem as a monodisperse one with a reasonably good accuracy by averaging the characteristic parameters in somespecial circumstances, e.g., when the parameters do not vary to a significant extent. In terms of percolation threshold,this result also implies that the percolation threshold of a binary system does not differ too much from a monodispersesystem. This conclusion is consistent with the findings in the literature (Rintoul, 2000) showing that the percolationthreshold of a binary-sized distribution of spheres is very close to that of spheres of equal radii. However, this resultis preliminary and a more comprehensive study on the effect of size distribution will be conducted in the future.

4. CONCLUSIONS

This research studied the effective conductivity of conductive fiber reinforced composite by employing a reducedcomputational model. Specifically, the fibers are modeled as randomly distributed resistors inside a nonconductivepolymer matrix, and the interactions among the conductive fibers are determined by the nearest distances and theirjoints, which are modeled as gap resistors of variable cross-sectional areas. The Monte Carlo simulation schemeand the finite-element method are employed to investigate the effective conductivity of the fibrous composite asa function of various geometrical parameters. The results show that the conductivity increases with the addition offibers following a power-law form, and that the threshold values of percolation agree with those found in the literature.The study on the effect of fiber aspect ratio indicates that the fibers with larger aspect ratios yield higher effectiveconductivities as the volume fraction stays the same. The tunneling effect is also incorporated into the model byadding a tunneling distance. The analysis reveals an increased conductivity and increased percolation threshold inthe presence of the tunneling effect. In addition, the fibrous network with a binary mixture of two different lengthsresults in a conductivity value averaged between the corresponding monodisperse systems of constant lengths. Theseconclusions are consistent with formerly reported experimental and theoretical results in the literature. The reducedmodel presented in the current work is computationally very efficient and has a potential in other applications such asthose involving wavy fibers and polydisperse systems.

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462 Guo,Yi, & Kumosa

ACKNOWLEDGMENT

The authors would like to acknowledge support from the National Science Foundation under contract number 1232520.

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