Direct simulation of second sound in graphene by solving the phonon Boltzmann equation via a multiscale scheme

TL;DR

This paper develops a multiscale numerical scheme to simulate second sound in graphene by solving the phonon Boltzmann equation, revealing detailed phonon dynamics and influencing factors in a computationally efficient way.

Contribution

It introduces a novel multiscale scheme for solving the phonon Boltzmann equation in hydrodynamic regimes, improving accuracy and efficiency over traditional methods.

Findings

Second sound in graphene is mainly contributed by ZA phonon modes.

Ballistic pulses are mainly contributed by LA and TA phonon modes.

Second sound speed is up to 20% less than the hydrodynamic limit due to scattering.

Abstract

The direct simulation of the dynamics of second sound in graphitic materials remains a challenging task due to lack of methodology for solving the phonon Boltzmann equation in such a stiff hydrodynamic regime. In this work, we aim to tackle this challenge by developing a multiscale numerical scheme for the transient phonon Boltzmann equation under Callaway's dual relaxation model which captures well the collective phonon kinetics. Comparing to traditional numerical methods, the present multiscale scheme is efficient, accurate and stable in all transport regimes attributed to avoiding the use of time and spatial steps smaller than the relaxation time and mean free path of phonons. The formation, propagation and composition of ballistic pulses and second sound in graphene ribbon in two classical paradigms for experimental detection are investigated via the multiscale scheme. The second sound is declared to be mainly contributed by ZA phonon modes, whereas the ballistic pulses are mainly contributed by LA and TA phonon modes. The influence of temperature, isotope abundance and ribbon size on the second sound propagation is also explored. The speed of second sound in the observation window is found to be at most 20 percentages smaller than the theoretical value in hydrodynamic limit due to the finite umklapp, isotope and edge resistive scattering. The present study will contribute to not only the solution methodology of phonon Boltzmann equation, but also the physics of transient hydrodynamic phonon transport as guidance for future experimental detection.