Inorganic thermoelectric materials: A review
Thermoelectric generator, which converts heat into electrical energy, has great potential to
power portable devices. Nevertheless, the efficiency of a thermoelectric generator suffers …
power portable devices. Nevertheless, the efficiency of a thermoelectric generator suffers …
Thermal energy transport in oxide nuclear fuel
To efficiently capture the energy of the nuclear bond, advanced nuclear reactor concepts
seek solid fuels that must withstand unprecedented temperature and radiation extremes. In …
seek solid fuels that must withstand unprecedented temperature and radiation extremes. In …
Single-defect phonons imaged by electron microscopy
Crystal defects affect the thermal and heat-transport properties of materials by scattering
phonons and modifying phonon spectra,,,,,,–. To appreciate how imperfections in solids …
phonons and modifying phonon spectra,,,,,,–. To appreciate how imperfections in solids …
The hiphive package for the extraction of high‐order force constants by machine learning
The efficient extraction of force constants (FCs) is crucial for the analysis of many
thermodynamic materials properties. Approaches based on the systematic enumeration of …
thermodynamic materials properties. Approaches based on the systematic enumeration of …
High thermal conductivity in wafer-scale cubic silicon carbide crystals
High thermal conductivity electronic materials are critical components for high-performance
electronic and photonic devices as both active functional materials and thermal …
electronic and photonic devices as both active functional materials and thermal …
Modulating the thermal conductivity in hexagonal boron nitride via controlled boron isotope concentration
Hexagonal boron nitride (h-BN) has been predicted to exhibit an in-plane thermal
conductivity as high as~ 550 W m− 1 K− 1 at room temperature, making it a promising …
conductivity as high as~ 550 W m− 1 K− 1 at room temperature, making it a promising …
almaBTE: A solver of the space–time dependent Boltzmann transport equation for phonons in structured materials
Abstract almaBTE is a software package that solves the space-and time-dependent
Boltzmann transport equation for phonons, using only ab-initio calculated quantities as …
Boltzmann transport equation for phonons, using only ab-initio calculated quantities as …
Phonon properties and thermal conductivity from first principles, lattice dynamics, and the Boltzmann transport equation
AJH McGaughey, A Jain, HY Kim, B Fu - Journal of Applied Physics, 2019 - pubs.aip.org
ABSTRACT A computational framework for predicting phonon frequencies, group velocities,
scattering rates, and the resulting lattice thermal conductivity is described. The underlying …
scattering rates, and the resulting lattice thermal conductivity is described. The underlying …
Survey of ab initio phonon thermal transport
The coupling of lattice dynamics and phonon transport methodologies with density
functional theory has become a powerful tool for calculating lattice thermal conductivity (κ) …
functional theory has become a powerful tool for calculating lattice thermal conductivity (κ) …
Thermal conductivity of GaN, , and SiC from 150 K to 850 K
The thermal conductivity (Λ) of wide-band-gap semiconductors GaN and SiC is critical for
their application in power devices and optoelectronics. Here, we report time-domain …
their application in power devices and optoelectronics. Here, we report time-domain …