2014
DOI: 10.1021/am405317x
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Effect of Carbon Nanotube Functionalization on Mechanical and Thermal Properties of Cross-Linked Epoxy–Carbon Nanotube Nanocomposites: Role of Strengthening the Interfacial Interactions

Abstract: We have used amido-amine functionalized carbon nanotubes (CNTs) that form covalent bonds with cross-linked epoxy matrices to elucidate the role of the matrix-filler interphase in the enhancement of mechanical and thermal properties in these nanocomposites. For the base case of nanocomposites of cross-linked epoxy and pristine single-walled CNTs, our previous work (Khare, K. S.; Khare, R. J. Phys. Chem. B 2013, 117, 7444-7454) has shown that weak matrix-filler interactions cause the interphase region in the nan… Show more

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Cited by 175 publications
(144 citation statements)
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“…[48][49][50][51][52] Lorentz-Berthelot mixing rules were used to describe van der Waals interactions as required by the GAFF force field. 53 The topologies of the PLA and PHB monomer units were generated with the aid of the ACPYPE tool which is a wrapper for the antechamber module of Ambertools.…”
Section: Model and Simulation Methodsmentioning
confidence: 99%
“…[48][49][50][51][52] Lorentz-Berthelot mixing rules were used to describe van der Waals interactions as required by the GAFF force field. 53 The topologies of the PLA and PHB monomer units were generated with the aid of the ACPYPE tool which is a wrapper for the antechamber module of Ambertools.…”
Section: Model and Simulation Methodsmentioning
confidence: 99%
“…This phenomenon was explained by increasing the transmission coefficient of the phonons [263,278]. Modification of the end groups of the polymer chains [261] and surface modification of the fillers (either with [237,[280][281][282][283][284] or applying specific coatings [285][286][287]) are common methods for improving the adhesion at the interfaces with subsequent thermal conductivity enhancement. However, it should be considered that the functionalization of the filler may create defects and decrease the intrinsic thermal conductivity of them [288].…”
Section: Thermal Conductivitymentioning
confidence: 99%
“…The superior enhancement of thermal conductivity of polymers by using covalently functionalized fillers was also reported in both graphene and carbon nanotube systems. 39,42 Fracture toughness…”
Section: Thermal Properties Of Gnp-based Compositesmentioning
confidence: 99%