- Letter
Band gaps and phonons of quasi-bulk rocksalt ScN
Phys. Rev. Materials 8, L071601 – Published 17 July, 2024
DOI: https://doi.org/10.1103/PhysRevMaterials.8.L071601
Abstract
ScN is an emerging transition metal nitride with unique physical properties arising from the electrons of Sc. In this letter, we present the results of optical characterization techniques: spectroscopic ellipsometry, Raman spectroscopy, and photoluminescence measurements of a -thick fully relaxed, and only weakly -type doped () ScN film deposited by halide vapor phase epitaxy (HVPE) on r-sapphire substrate. Spectroscopic ellipsometry yields an indirect band gap of , while the lowest direct interband transition is observed at in the dielectric function. A broad luminescence feature at is observed, matching this transition. We derive an estimate for the exciton binding energy () as well as the Born effective charges . In the infrared spectral region, we observe a strong phonon and a weak plasmon absorption. We precisely determine the transverse optical (TO) phonon eigenfrequency (), the high frequency dielectric constant (), and the static dielectric constant (). Raman measurements using various excitation energies show resonant multiphonon scattering up to 6LO [sixth-order overtone for longitudinal optical (LO) phonons] for excitation above the optical band gap (), where the allowed scattering is the dominant scattering mechanism for all excitation energies. Their characteristic parameters determined from Lorentzian line shape fitting yield and an increased broadening for higher LO scattering order .