Phonon scattering and vibrational localization in 2D embedded nanoparticle composites

TL;DR

This study uses a Landauer approach with FDPML to analyze phonon transport and vibrational localization in 2D nanoparticle composites, revealing how particle loading and material properties influence phonon mean free paths and mode confinement.

Contribution

It introduces a novel application of the Landauer approach with FDPML to study phonon scattering and localization in 2D nanoparticle composites, highlighting the effects of particle loading and material contrast.

Findings

Independent scattering approximation valid above 10% volume fraction

Localization observed at >30% volume fraction for heavy particles in light matrix

Localization primarily due to energetic confinement, not Anderson localization

Abstract

In this work, a Landauer approach enabled by the Frequency Domain Perfectly Matched Layer Method (FDPML) is used to study phonon transport in a series of large 2D domains with randomly embedded nanoparticles over a wide range of nanoparticle loadings and wavelengths. The effect of nanoparticle packing density on the mean free path and localization length is characterized. We observe that in the Mie scattering regime, the independent scattering approximation is valid up to volume fractions exceeding 10% and often higher depending on scattering parameter, indicating the mean free path can usually be calculated much less expensively using the number density and the scattering cross-section of a single scatterer. We also study localization lengths and their dependence on particle loading. In the case of heavy particles in a lighter matrix, we have been able to observe localization only at volume fractions >30% using the Landauer approach and only for high frequency modes, exceeding the vibration frequencies of the embedded nanoparticles. Using modal analysis we show that localization in nanoparticle laden materials is primarily due to energetic confinement rather than Anderson localization. Subsequently, we show that by using light particles in a heavy matrix the fraction of confined modes can be substantially increased.