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Remarkable Role of Grain Boundaries in the Thermal Transport Properties of Phosphorene

[Image: see text] In this work, we study the effect of grain boundary (GB) on the thermal transport of phosphorene by using molecular dynamics simulations. By exploring a total of 19 GBs with different GB defect types and densities, we find that there is a relatively high Kapitza thermal boundary re...

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Bibliographic Details
Published in:ACS Omega
Main Authors: Liu, Xiangjun, Gao, Junfeng, Zhang, Gang, Zhao, Jijun, Zhang, Yong-Wei
Format: Artigo
Language:Inglês
Published: American Chemical Society 2020
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC7377073/
https://ncbi.nlm.nih.gov/pubmed/32715226
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.0c01806
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