Driven by the intensive efforts in the development of high‐performance GeTe
thermoelectrics for mass‐market application in power generation and refrigeration, GeTe …

Abstract Since penta-graphene (PG), a two-dimensional (2D) carbon allotrope exclusively
composed of five-membered rings, was proposed in 2015, a great deal of effort has been …

FourPhonon is a computational package that can calculate four-phonon scattering rates in
crystals. It is built within ShengBTE framework, which is a well-recognized lattice thermal …

In this Perspective, I present a concise account concerning the emergence of the research
field investigating the phononic and thermal properties of graphene and related materials …

Phonon anharmonicity is critical for accurately predicting the material's thermal conductivity
(κ). However, its calculation based on the perturbation theory is a difficult and time …

Significant progress has been made in the past two decades about the micro/nanoscale
heat conduction. Many computational methods have been developed to accommodate the …

Accurate evaluation of the thermal conductivity of a material can be a challenging task from
both experimental and theoretical points of view. In particular for the nanostructured …

A computational framework for predicting phonon frequencies, group velocities, scattering
rates, and the resulting lattice thermal conductivity is described. The underlying theory and …

Recently, emerging phonon phenomena have been discovered and rapidly developed,
which have become an active hot research topic. In this review article, we present state-of …

Lattice thermal conductivity κ L is one of the key parameters involved in the design of
microelectronics and energy-conversion devices. In determining the κ L, similar to the well …