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The van der Waals force versus interatomic distance and displacement curve.

The van der Waals force versus interatomic distance and displacement curve.

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: In this study, the mechanical behavior of epoxy/carbon nanotubes (CNTs) nanocomposite is predicated by a two-scale modeling approach. At the nanoscale, a CNT, the interface between the CNT and the matrix and a layer of the matrix around the CNT are modeled and the elastic behavior of the equivalent fiber (EF) has been identified. The CNT/epoxy in...

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... Firstly, referring to the experimental results of Javadinejad et al. [44], the average length and diameter of untreated CNTs were 15 µm and 7.5 nm, respectively, with an aspect ratio of 2000, axial Young's modulus of 1 TPa, and radial Young's modulus of 30 GPa. The Young's modulus of a pure epoxy matrix was 2.6 GPa. ...
... Physical values used in the calculation for comparison with Javadinejad et al.[44]. The effect of the aspect ratio of CNT fillers on the interfacial Young's modulus and overall Young's modulus of CNTs-reinforced nanocomposites. ...
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The mechanical/thermal/electrical properties on-demand design of CNTs-reinforced nanocomposites is a key scientific issue that limits the development of new-generation smart nanomaterials, and the establishment of a corresponding unified theoretical prediction model for the mechanical/thermal/electrical properties is the foundation of nanocomposites. Based on the equivalent medium theory (EMT) obtained by Maxwell far-field matching, a unified mechanical/thermal/electrical modified EMT model is established by introducing Young’s modulus, thermal conductivity, and electrical conductivity to the thin filler–matrix’s interlayer. According to literature, the proposed model was employed to theoretically calculate the variations in the overall Young’s modulus, thermal conductivity, and electrical conductivity of CNTs-reinforced nanocomposites with respect to the volume concentration of CNT fillers. Then, the applicability of the proposed theoretical model was validated in comparison with the experimental measurements. Numerical calculations showed that the interface is a key factor affecting the mechanical/thermal/electrical properties of CNTs-reinforced nanocomposites, and strengthening the interfacial effect is an effective way to enhance the overall properties of nanocomposites. In addition, the aspect ratio of CNT fillers also significantly affects the material properties of the CNT fillers interface phase and the CNTs-reinforced nanocomposites. By fitting the experimental data, the calculation expressions of the aspect ratios of CNT fillers on the Young’s modulus, thermal conductivity, and electrical conductivity of the CNT fillers interfacial phase are quantitatively given, respectively.
... The other is to incorporate more complicated features, such as waviness and/or agglomerations in the study. For the latter, some approaches have been proposed to address the specific issues on waviness and agglomeration, [34][35][36] but not for a comprehensive understanding of a practical material system which involves different types of filler, interface, and distribution besides waviness and agglomeration. For either case, the current work has laid out a foundation for these possible future studies. ...
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Many studies, experimental, theoretical, and numerical, have been done on polymer nanocomposites, but nearly all of them have focused on a particular type of material system or some specific material properties. A comprehensive understanding of this complicated material system is still quite lacking. The objective of this study is to use mesoscale finite element simulation to gain insights on the reinforcing efficiencies of different types of carbon nanofillers as distinguished by their geometries and interfacial strengths. It is demonstrated that CNT (carbon nanotube) and CNF (carbon nanofiber) have larger load carrying capacity and potentially higher reinforcing efficiency than GNP (graphite nanoplatelet) due to their larger aspect ratio and physical length. However, the higher load carrying capacity is also associated with higher interfacial stress which can lead to earlier debonding, particularly for CNT. GNP, on the other hand, has lower load carrying capacity, and is thus less sensitive to the bonding condition and less susceptible to debonding. The overall reinforcing efficiency is a manifestation of the interplay between the load carrying capacity of the filler, which is limited by filler’s geometry, and the load transfer capability at the interface, which is limited by the filler/matrix interfacial strength. This interplay is also reflected in the effects of filler orientation on reinforcing efficiency. The insights gained from this study can be used to devise a strategy for developing advanced nanocomposites, such as hybrid composites.
... This can be justified by the SEM image is shown in Figure 13. Javadinejad et al. [95] applied numerical FEM to demonstrate the clustering effect of CNTs in the composite as shown in Figure 14. Figure 14 shows a 3D view of four colonies in different volume fractions of CNTs. The colonization/agglomeration effect increases with the increase of vol% of CNTs in epoxy resin is shown in Figure 15. ...
... 3D view of the RVE with clustering of CNTs in four colonies in epoxy resin: (a) 0.18 wt%, (b) 0.36 wt%, (c) 0.9 wt%, and (d) 1.8 wt%[95]. (a) Variation of YS of CNT/epoxy nanocomposite with respect to MWCNT volume fraction, and (b) Effect of CNTs agglomeration on YS of CNT/epoxy nanocomposite for four colonies model and 1 vol% CNT loading[95]. ...
... 3D view of the RVE with clustering of CNTs in four colonies in epoxy resin: (a) 0.18 wt%, (b) 0.36 wt%, (c) 0.9 wt%, and (d) 1.8 wt%[95]. (a) Variation of YS of CNT/epoxy nanocomposite with respect to MWCNT volume fraction, and (b) Effect of CNTs agglomeration on YS of CNT/epoxy nanocomposite for four colonies model and 1 vol% CNT loading[95]. ...
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... This can be justified by the SEM image is shown in Figure 13. Javadinejad et al. [95] applied numerical FEM to demonstrate the clustering effect of CNTs in the composite as shown in Figure 14. Figure 14 shows a 3D view of four colonies in different volume fractions of CNTs. The colonization/agglomeration effect increases with the increase of vol% of CNTs in epoxy resin is shown in Figure 15. ...
... 3D view of the RVE with clustering of CNTs in four colonies in epoxy resin: (a) 0.18 wt%, (b) 0.36 wt%, (c) 0.9 wt%, and (d) 1.8 wt%[95]. (a) Variation of YS of CNT/epoxy nanocomposite with respect to MWCNT volume fraction, and (b) Effect of CNTs agglomeration on YS of CNT/epoxy nanocomposite for four colonies model and 1 vol% CNT loading[95]. ...
... 3D view of the RVE with clustering of CNTs in four colonies in epoxy resin: (a) 0.18 wt%, (b) 0.36 wt%, (c) 0.9 wt%, and (d) 1.8 wt%[95]. (a) Variation of YS of CNT/epoxy nanocomposite with respect to MWCNT volume fraction, and (b) Effect of CNTs agglomeration on YS of CNT/epoxy nanocomposite for four colonies model and 1 vol% CNT loading[95]. ...
... Different RVE shapes like circular [38], square [21] and hexagonal [25] have been chosen. RVE with one aligned CNT [19], one inclined CNT [24], equal length of CNT and RVE [23,31], CNT length less than RVE [19,26], many aligned CNTs [45][46][47][48], many CNTs at different angles [48][49][50][51][52] have been modeled by various researchers. But in all the above approaches of RVE analyses for nanocomposites, the boundary conditions as mentioned in [17] have not been applied, resulting in the estimation of the elastic properties of nanocomposites, which are not validated. ...
... But in all the above approaches of RVE analyses for nanocomposites, the boundary conditions as mentioned in [17] have not been applied, resulting in the estimation of the elastic properties of nanocomposites, which are not validated. With the exception of Bhuiyan et al. [46,47], in all the above RVE analyses [48][49][50][51][52], experimental comparison of estimated values is not provided. ...
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This work is aimed at studying the stiffness evolution of clustered composites and nanocomposites by FEM analysis. In fully dispersed composites and nanocomposites, proper modeling requires accounting for nanoparticle aspect ratio, volume fraction, and angle of orientation. In addition to these, the FEM model proposed in this work accounts for number of nanoparticles and volume fraction of nanoparticles in the cluster. The proposed approach allowed to calculate the longitudinal modulus and the other elastic constants of clustered composites, showing significant differences with the modulus of fully disperse composites.