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Heat Transfer at the Interface of Graphene Nanoribbons with Different Relative Orientations and Gaps

Shahin Mohammad Nejad, Masoud Bozorg Bigdeli, Rajat Srivastava and Matteo Fasano
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Shahin Mohammad Nejad: Department of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Torino, Italy
Masoud Bozorg Bigdeli: Department of Mechanical Engineering, University of Alberta, Edmonton, AB T6G 2G8, Canada
Rajat Srivastava: Department of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Torino, Italy
Matteo Fasano: Department of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Torino, Italy

Energies, 2019, vol. 12, issue 5, 1-11

Abstract: Because of their high thermal conductivity, graphene nanoribbons (GNRs) can be employed as fillers to enhance the thermal transfer properties of composite materials, such as polymer-based ones. However, when the filler loading is higher than the geometric percolation threshold, the interfacial thermal resistance between adjacent GNRs may significantly limit the overall thermal transfer through a network of fillers. In this article, reverse non-equilibrium molecular dynamics is used to investigate the impact of the relative orientation (i.e., horizontal and vertical overlap, interplanar spacing and angular displacement) of couples of GNRs on their interfacial thermal resistance. Based on the simulation results, we propose an empirical correlation between the thermal resistance at the interface of adjacent GNRs and their main geometrical parameters, namely the normalized projected overlap and average interplanar spacing. The reported correlation can be beneficial for speeding up bottom-up approaches to the multiscale analysis of the thermal properties of composite materials, particularly when thermally conductive fillers create percolating pathways.

Keywords: heat transfer enhancement; Kapitza resistance; graphene; polymer nanocomposites; nanoribbon; molecular dynamics (search for similar items in EconPapers)
JEL-codes: Q Q0 Q4 Q40 Q41 Q42 Q43 Q47 Q48 Q49 (search for similar items in EconPapers)
Date: 2019
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