Effects of domains in phonon conduction through hybrid boron nitride and graphene sheets

H. Sevinçli, W. Li, N. Mingo, G. Cuniberti, S. Roche

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Abstract

We theoretically investigate the phonon propagation and thermal conductivity κ in hybrid boron nitride and graphene sheets. By using a real-space Kubo-computational transport scheme, large and disordered graphene structures are simulated, introducing disk-shaped domains with varying sizes of 2 to 8 nm and concentrations ranging from 0% to 100%. A strong influence of the domain size and concentration on the transport properties is obtained. The mean free paths are minimized at 50% domain concentration, and stronger suppression of κ is achieved with smaller domains. It is found to decrease by up to 65% at room temperature when the domain size is 2 nm. These results are beyond the scope of any effective medium approximation. © 2011 American Physical Society.
Original languageEnglish
Article number205444
JournalPhysical Review B - Condensed Matter and Materials Physics
Volume84
Issue number20
DOIs
Publication statusPublished - 21 Nov 2011

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    Sevinçli, H., Li, W., Mingo, N., Cuniberti, G., & Roche, S. (2011). Effects of domains in phonon conduction through hybrid boron nitride and graphene sheets. Physical Review B - Condensed Matter and Materials Physics, 84(20), [205444]. https://doi.org/10.1103/PhysRevB.84.205444