arXiv subjects

Yangyu Guo

Publications and source records attributed to Yangyu Guo.

22 records · Page 2Linked to original sources

arXiv2020

Lattice Boltzmann scheme for hydrodynamic equation of phonon transport

In this work, a lattice Boltzmann scheme is developed for numerical solution of the phonon Boltzmann equation under Callaway's dual relaxation model in the hydrodynamic limit. Through a Chapman-Enskog expansion to the lattice Boltzmann equation with the resistive scattering term as an equivalent source term, we recover a phonon hydrodynamic equation which is reduced to the Guyer-Krumhansl heat transport equation and the Fourier's law in the limit of dominant normal scattering and dominant resistive scattering respectively. Several cases of heat transport from diffusive regime to hydrodynamic regime are modeled extensively by the present numerical scheme, which produces results in good agreement with the benchmark solutions. Two well-known phonon hydrodynamic phenomena including the phonon Poiseuille flow and second sound propagation are well captured by the lattice Boltzmann scheme. This work will promote the numerical modeling and deeper understanding of the non-Fourier heat transport induced by phonon normal scattering.

physics.comp-ph↗

arXiv2020

Quantum mechanical modeling of anharmonic phonon-phonon scattering in nanostructures

The coherent quantum effect becomes increasingly important in the heat dissipation bottleneck of semiconductor nanoelectronics with the characteristic size shrinking down to few nano-meters scale nowadays. However, the quantum mechanical model remains elusive for anharmonic phonon-phonon scattering in extremely small nanostructures with broken translational symmetry. It is a long-term challenging task to correctly simulate quantum heat transport including anharmonic scattering at a scale relevant to practical applications. In this article, we present a clarified theoretical formulation of anharmonic phonon non-equilibrium Green function (NEGF) formalism for both 1D and 3D nanostructures, through a diagrammatic perturbation expansion and an introduction of Fourier representation to both harmonic and anharmonic terms. A parallelized computational framework with first-principle force constants input is developed for large-scale quantum heat transport simulation. Some crucial approximations in numerical implementation are investigated to ensure the balance between numerical accuracy and efficiency. A quantitative validation is demonstrated for the anharmonic phonon NEGF formalism and computational framework by modeling cross-plane heat transport through silicon thin film. The phonon-phonon scattering is shown to be appreciable and to introduce about 20% reduction of thermal conductivity at room temperature even for a film thickness around 10 nm. The present methodology provides a robust platform for the device quantum thermal modeling, as well as the study on the transition from coherent to incoherent heat transport in nano-phononic crystals. This work thus paves the way to understand and to manipulate heat conduction via the wave nature of phonons.

cond-mat.mes-hall↗

arXiv2020

Self-synchronization of thermal phonons at equilibrium

Self-synchronization is a ubiquitous phenomenon in nature, in which oscillators are collectively locked in frequency and phase through mutual interactions. While self-synchronization requires the forced excitation of at least one of the oscillators, we demonstrate that this mechanism spontaneously appears due to the activation from thermal fluctuations. By performing molecular dynamic simulations, we demonstrate the self-synchronization of thermal phonons in a platform supporting doped silicon resonators. We find that thermal phonons are spontaneously converging to the same frequency and phase. In addition, the dependencies to intrinsic frequency difference and coupling strength agree well with the Kuramoto model predictions. More interestingly, we find that a balance between energy dissipation resulting from phonon-phonon scattering and potential energy between oscillators is required to maintain synchronization. Finally, a wavelet transform approach corroborates the generation of coherent thermal phonons in the collective state of oscillators. Our study provides a new perspective on self-synchronization and on the relationship between fluctuations and coherence.

cond-mat.mes-hall↗

arXiv2020

A generalized decay law for particle- and wave-like thermal phonons

Our direct atomic simulations reveal that a thermally activated phonon mode involves a large population of elastic wavepackets. These excitations are characterized by a wide distribution of lifetimes and coherence times expressing particle- and wave-like natures. In agreement with direct simulations, our theoretical derivation yields a generalized law for the decay of the phonon number taking into account coherent effects. Before the conventional exponential decay due to phonon-phonon scattering, this law introduces a delay proportional to the square of the coherence time. This additional regime leads to a moderate increase in relaxation times and thermal conductivity. This work opens new horizons in the understanding of the origin and the treatment of thermal phonons.

cond-mat.mes-hall↗