Department of Civil and Environmental Engineering, ‡Department of Material Science and NanoEngineering, and §Smalley Institute for Nanoscale Science and Technology, Rice University , Houston, Texas 77005, United States.
ACS Appl Mater Interfaces. 2017 Nov 15;9(45):39122-39126. doi: 10.1021/acsami.7b16162. Epub 2017 Nov 3.
Hybrid 3D nanoarchitectures by covalent connection of 1D and 2D nanomaterials are currently in high demands to overcome the intrinsic anisotropy of the parent materials. This letter reports the junction configuration-mediated thermal transport properties of Pillared Graphene (PGN) using reverse nonequilibrium molecular dynamics simulations. The asymmetric junctions can offer ∼20% improved in-plane thermal transport in PGN, unlike the intuition that their wrinkled graphene sheets cause phonon scattering. This asymmetric trait, which entails lower phonon scattering provides a new degree of freedom to boost thermal properties of PGN and potentially other hybrid nanostructures.
通过将一维和二维纳米材料共价连接来构建混合 3D 纳米结构,目前人们对其需求很高,以克服母体材料的固有各向异性。本函报道了使用反向非平衡分子动力学模拟的支柱化石墨烯 (PGN) 的连接结构介导的热输运性质。与褶皱的石墨烯片导致声子散射的直觉相反,不对称连接可以使 PGN 的面内热输运提高约 20%。这种不对称特性,即较低的声子散射,为提高 PGN 和潜在其他混合纳米结构的热性能提供了新的自由度。