Barium Titanate BaTiO3 Raman Spectra and their deconvolution with q-BWF functions

02 August 2024, Version 1
This content is a preprint and has not undergone peer review at the time of posting.

Abstract

Here we study the Raman spectra of Barium Titanate, BaTiO3, given in the RRUFF and ROD databases. Being the Raman bands strongly asymmetric, we are deconvoluting them by means of the q-BWF functions. These functions are generalizing the Breit-Wigner-Fano line shape in the framework of the q-exponential function of Tsallis statistics. Besides the deconvolution of Raman spectra, we consider the literature on BaTiO3 Raman spectroscopy, particularly the assignment of the bands. Being the wavenumbers of some A1 and E modes very close, the observed modes are mixed. Moreover, dips in the spectra have suggested as due to the presence of anharmonicity, interference and Fano resonance.

Comments

Comments are not moderated before they are posted, but they can be removed by the site moderators if they are found to be in contravention of our Commenting Policy [opens in a new tab] - please read this policy before you post. Comments should be used for scholarly discussion of the content in question. You can find more information about how to use the commenting feature here [opens in a new tab] .
This site is protected by reCAPTCHA and the Google Privacy Policy [opens in a new tab] and Terms of Service [opens in a new tab] apply.