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Skeletonization-based beam finite element models for stochastic bicontinuous materials: Application to simulations of nanoporous gold

Published online by Cambridge University Press:  27 July 2018

Celal Soyarslan*
Affiliation:
Chair of Solid Mechanics, School of Mechanical Engineering and Safety Engineering, University of Wuppertal, Wuppertal 42119, Germany
Hakan Argeso
Affiliation:
Department of Manufacturing Engineering, Atılım University, Ankara 06830, Turkey
Swantje Bargmann
Affiliation:
Chair of Solid Mechanics, School of Mechanical Engineering and Safety Engineering, University of Wuppertal, Wuppertal 42119, Germany
*
a)Address all correspondence to this author. e-mail: soyarslan@uni-wuppertal.de

Abstract

An efficient representative volume element generation strategy is developed in modeling nanoporous materials. It uses periodic 3D beam finite element (FE) models derived from skeletonization of spinodal-like stochastic microstructures produced by a leveled random field. To mimic stiffening with agglomeration of the mass at junctions, an increased Young’s modulus is assigned to the elements within the junction zone. The effective Young’s modulus, Poisson’s ratio, and universal anisotropy index are computed. A good agreement of the Young’s modulus predictions with those obtained from experimental results for phase volume fractions $0.20 \lt {\phi _{\cal B}} \lt 0.50$ is observed. Moreover, the elastic anisotropy index of the generated beam networks shows sufficient proximity to isotropy. Finally, it is demonstrated that, as compared to the simulation statistics of voxel-FE models, for the beam-FE models over 500-fold computational acceleration with 250-fold less memory requirement is provided.

Information

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Article
Creative Commons
Creative Common License - CCCreative Common License - BY
This is an Open Access article, distributed under the terms of the Creative Commons Attribution-NonCommercial-ShareAlike licence (http://creativecommons.org/licenses/by-nc-sa/4.0/), which permits non-commercial re-use, distribution, and reproduction in any medium, provided the same Creative Commons licence is included and the original work is properly cited. The written permission of Cambridge University Press must be obtained for commercial re-use.
Copyright
Copyright © Materials Research Society 2018
Figure 0

FIG. 1. Each material point $^{\rm{M}}{\bi{x}} \in {\;^{\rm{M}}}{\cal B}$ in macrocontinuum ${}^{\rm{M}}{\cal B}$ corresponds to a microstructure ${\cal B}$ of the representative volume ${\cal V}$ whose effective behavior is representative of that of the material as a whole. Here, ${}^{\rm{M}}{\cal L}$ denotes the characteristic size of the body at macroscale or the length scale associated with the fluctuations of the applied mechanical loading. ${}^{{\rm{RVE}}}{\cal L}$ is the RVE size. Computationally, different discretization strategies are possible in the representation of the domain, e.g., a voxel-FE or beam-FE model, as used in the current work.

Figure 1

FIG. 2. Periodicity of the generated beam-FE model is provided by making use of topology conserving medial axis skeletonization of the voxelization of the random periodic field over a 3a × 3a × 3a sized domain. Then, the one-voxel-thick skeleton of a × a × a central cubic cell is clipped out. The voxels making up the skeleton are then linked by ligaments to each of which a circular beam section is assigned (right-top). This makes each skeleton voxel a FE node. A node merging more than two ligaments is referred to as junction which is depicted by red spheres. Blue spheres denote periodically located nodes at the periodic volume element face of size a × a × a. In the simplified beam network models, the junctions connected by ligaments are merged by straight links composed of one or many beam elements (right-bottom). In this process, all junction and periodically located node positions are preserved.

Figure 2

FIG. 3. Generated (left) 3D periodic phase field, (b) one-to-one periodic skeleton based beam-FE model, and (c) simplified periodic beam network for the single level cut method for solid volume fractions of (a) 0.20, (b) 0.30, (c) 0.40, and (d) 0.50. The number of beam elements for corresponding discretizations are (a) 18,317 and 3674, (b) 26,786 and 8166, (c) 31,989 and 11,479, and (d) 34,351 and 12,716.

Figure 3

FIG. 4. Local thickness distribution of the generated beam-FE models for (a) 0.20, (b) 0.30, (c) 0.40, and (d) 0.50 phase volume fractions following the method provided in Ref. 39 in conjunction with Refs. 40 and 42. An increase in the ligament diameters with increasing phase volume fraction with junctions acquiring relatively higher thickness in each case is evident. Local thicknesses are given in terms of wave length λ = 2π/q0 of the random field.

Figure 4

FIG. 5. Local thickness distribution for the developed beam-FE models as a function of phase volume fraction computed using the method provided in Ref. 39 in conjunction with Refs. 40 and 42. Data are presented as averages of the means μ (dots) and averages of the standard deviations σ from ligament diameter distribution analysis over 5 random realizations. A comparison with the data from Ref. 13 is also provided in which computations over 3D images of 36 wave length size aperiodic microstructures with 512 × 512 × 512 voxel discretization are considered. The results are presented in terms of the wave length λ = 2π/q0 of the random field. Despite the differences in both domain size of computation and discretization resolution, a good agreement especially with increasing phase volume fraction is observed.

Figure 5

FIG. 6. Mechanical treatment of the stiffening around junctions with agglomeration of the mass is realized through increasing the Young’s modulus with a scaling factor ω(r). (a) An example junction of a nanoporous material. Here, the transparent gray region bounded by solid black lines represents the solid phase whereas the shaded 3D lines represent the corresponding skeleton. r denotes the radial distance from the junction, whereas R denotes the local thickness computed at the junction. The distribution can be assumed to be constant within the junction zone, i.e., for r < R, as depicted in (b). Another approach may be selection of a nonlinear distribution, e.g., depicted in (c). In this work, approach (b) is used.

Figure 6

FIG. 7. von Mises stress distributions for the models with 0.20 (top) and 0.50 (bottom) phase volume fractions under six strain-controlled loading conditions with the macroscopically imposed strains of (from left to right) Mε〈1〉 = αe1e1, Mε〈2〉 = αe2e2, Mε〈3〉 = αe3e3, Mε〈4〉 = [α/21/2][e2e3 + e3e2], Mε〈5〉 = [α/21/2][e1e3 + e3e1], and Mε〈6〉 = [α/21/2][e1e2 + e2e1] considering periodic boundary conditions where α controls the extent of loading. This set of simulation results allows determination of the macroscopic elastic moduli through computational homogenization. The local stress development over the elements in the 0.50 volume fraction case is considerably higher than those computed for 0.20 volume fraction case. Among the plane strain compression tests and among the simple shear tests conducted in different directions, the statistical distribution of the observed von Mises stress magnitudes over the ligaments are in complete agreement. This signals the isotropy in the macroscropic elastic response of the ligament network. These results correspond to a constant stiffness intensity factor of ω(r) = 40 for r < R, whereas no qualitative difference in the findings is observed once other intensity factors are analyzed. The Cartesian unit vectors e1, e2, and e3 are represented by the vectors colored with red, green and blue, respectively.

Figure 7

FIG. 8. Stereographic projections of the normalized effective elastic moduli demonstrating the directional dependence of normalized Young’s modulus for increasing volume element size for 0.20, 0.30, 0.40, and 0.50 solid volume fractions. Volume fraction is increasing from left to right. Elastic isotropy is represented by uniform color distribution over the circle. Each row represents one of the 5 realizations. The randomness of the directional dependence is evident. Moreover, while for 0.20 volume fraction, we observe a relatively higher average anisotropy index for increasing the volume fraction, and the material behavior is qualitatively isotropic. These results are in complete agreement with those reported in Ref. 13 in which a voxel-based FE approach was used. The mean and standard deviation of the anisotropy indices for 0.20 and 0.50 phase volume fractions are AU = 0.3218 ± 0.1455 and AU = 0.0194 ± 0.0074, respectively. These results correspond to a constant stiffness intensity factor of ω(r) = 40 for r < R, whereas no qualitative difference in the findings is observed once other intensity factors are analyzed.

Figure 8

TABLE I. Comparison of voxel-FE and beam-FE simulation statistics. The listed results are in terms of rounded averages corresponding to a number of simulations and realizations. Both the number of elements and the number of nodes are defined by the user.

Figure 9

FIG. 9. Beam-FE model prediction of the phase volume dependence in (a) macroscopic Young’s modulus and (b) Poisson’s ratio. For the Young’s modulus, junction stiffening by mass agglomeration with the selection of ω(r) = 40 for r < R results in perfect agreement with the results of periodic and aperiodic voxel-based FE solution results of Ref. 13 as well as experimental results of Refs. 12, 14, 39, and 57–59. For the Poisson’s ratio, however, this is the case only for ${\phi _{\cal B}} \lt 0.35$. Here, the experimental results are from Refs. 58 and 60. Data are presented as mean value μ (dots) and standard deviation σ from analysis of 5 random realizations.