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Physical Society of Japan, Journal of the Physical Society of Japan, 5(84), p. 054701, 2015

DOI: 10.7566/jpsj.84.054701

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Impact of Ferroelectric Distortion on Thermopower in BaTiO3

Journal article published in 2015 by Hiroaki Saijo, Kunihiko Yamauchi ORCID, Koun Shirai, Tamio Oguchi
This paper is available in a repository.
This paper is available in a repository.

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Abstract

We present a strategy for increasing thermoelectric performance by invoking ferroelectric distortion in a transition-metal oxide. By using an ab initio calculation approach with the Boltzmann transport equation, a large Seebeck coefficient is calculated in n-type BaTiO3. The polar structural distortion causes the peculiar dispersion of the lowest conduction band, which enhances the Seebeck coefficient along the polar direction. A microscopic mechanism of carrier concentration dependence of the Seebeck coefficient is discussed in terms of the band velocity distribution in the Brillouin zone. ; Comment: 6 pages, 6 figures, submitted to JPSJ