Investigation into the Atomistic Scale Mechanisms Responsible for the Enhanced Dielectric Response in the Interfacial Region of Polymer Nanocomposites

2020 ◽  
Vol 124 (21) ◽  
pp. 11558-11563
Author(s):  
C. Ulises Gonzalez-Valle ◽  
Seung Ho Hahn ◽  
Murali Gopal Muraleedharan ◽  
Q.M. Zhang ◽  
Adri C.T. van Duin ◽  
...  
2019 ◽  
Vol 31 (21) ◽  
pp. 1807722 ◽  
Author(s):  
Simin Peng ◽  
Xiao Yang ◽  
Yang Yang ◽  
Shaojie Wang ◽  
Yao Zhou ◽  
...  

2006 ◽  
Vol 13 (7) ◽  
pp. 647-655 ◽  
Author(s):  
Yu. S. Lipatov ◽  
L. F. Kosyanchuk ◽  
N. V. Yarovaya

2017 ◽  
Vol 31 (23) ◽  
pp. 1730003 ◽  
Author(s):  
Weiwei Zhao ◽  
Yunlan Su ◽  
Dujin Wang

Dispersing three-dimensional (3D) nanoparticles as the filler into a polymeric component is known to significantly improve the physicochemical properties of the materials and makes them attractive for industrial applications. There are two main contributions to the underlying enhancement mechanism of polymer nanocomposites (PNCs). The first contribution is linked to the interfacial effect, originating from the interaction between polymer and nanoparticles. The packing density, conformation and orientation of adsorbed chains are significantly altered, which results in an interfacial region with different properties from the bulk. The second contribution is attributed to the spatial effect, introduced by confining polymer chains in a restricted space between/among nanoparticles. These two effects are often correlated. The characteristic behavior of polymer chains confined by nanoparticles has already shown to be quite complicated and hence interesting as compared with that of pure polymers. The broad range of influencing factors including the size, content and surface chemistry of nanoparticles as well as the molecular weight and chain ends of polymers were discussed in this review. The controversial issues such as the segmental dynamics at interface, interfacial architecture and the extent of its impact on the bulk phase were summarized, wishing to produce further understanding of PNCs.


2021 ◽  
Vol 07 (03) ◽  
pp. 34-39
Author(s):  
Arzu Süleymanova Arzu Süleymanova

On the basis of a micromechanical model of the tensile strength of a polymer composite, it is shown that, in contrast to the case of adhesion between two polymers, when there is a linear correlation between the thickness of the interfacial region and the level of interfacial adhesion, the strength of the interface in nanocomposites of the "polymer-high modulus filler" type decreases with growth. its thickness. The dependence of the tensile strength of polymer nano-composites on the properties of the material and the level of interfacial interaction has been established. Keywords: strength model, interfacial adhesion, nanocomposite, seal material, packer.


Nanomaterials ◽  
2021 ◽  
Vol 11 (7) ◽  
pp. 1709
Author(s):  
Francesco Maria Bellussi ◽  
Carlos Sáenz Ezquerro ◽  
Manuel Laspalas ◽  
Agustín Chiminelli

Interfacial characteristics of polymer nanocomposites represent a crucial aspect to understand their global properties and to evaluate the interaction between nanofillers and matrix. In this work we used a molecular dynamics (MD) approach to characterize the interfacial region at the atomistic scale of graphene-based polymer nanocomposites. Three different polymer matrixes were considered, polylactic acid (PLA), polypropylene (PP) and epoxy resin (EPO), which were reinforced with three types of graphene fillers: pristine graphene (G), graphene oxide (GO) and reduced graphene oxide (rGO). In particular, the compatibility of the nanofillers in polymer matrixes were evaluated in terms of the interaction energy, while the interfacial thermal resistance (Kapitza resistance) between matrices and fillers was calculated with a nonequilibrium molecular dynamics (NEMD) method. Results showed that the oxidation degree plays an important role on the studied properties of the interfacial region. In particular, it was observed that the Kapitza resistance is decreased in the oxidized graphene (GO and rGO), while interaction energy depended on the polarity of the polymer matrix molecules and the contribution of the Coulombic component.


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