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Main Authors: Sheibani, Aida, Paillard, Charles, Pandit, Abhyian, Haleoot, Raad, Bellaiche, Laurent, Hamad, Bothina
Format: Preprint
Published: 2019
Subjects:
Online Access:https://arxiv.org/abs/1911.05301
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author Sheibani, Aida
Paillard, Charles
Pandit, Abhyian
Haleoot, Raad
Bellaiche, Laurent
Hamad, Bothina
author_facet Sheibani, Aida
Paillard, Charles
Pandit, Abhyian
Haleoot, Raad
Bellaiche, Laurent
Hamad, Bothina
contents First principle calculations are performed to investigate the effect of polar order strength on the thermoelectric (TE) properties of GeTe alloy in its rhombohedral structure. The variation in the polarization state using various ferroelectric distortions λ (λ=0,0.5,1.0,1.25,1.5) allows to change the thermoelectric properties to a large extent. The polar structure with a high polarization mode (λ=1.5) tends to show a higher TE efficiency than the cubic structure at high temperatures. Thus, polarization engineering may play a key role in designing efficient thermoelectric devices. In particular, high TE performances could be achieved by growing epitaxial GeTe films that bi-axially compress the directions perpendicular to the polar axis, which may help to tune the Curie temperature.
format Preprint
id arxiv_https___arxiv_org_abs_1911_05301
institution arXiv
publishDate 2019
record_format arxiv
spellingShingle Effect of the polar distortion on the thermoelectric properties of GeTe
Sheibani, Aida
Paillard, Charles
Pandit, Abhyian
Haleoot, Raad
Bellaiche, Laurent
Hamad, Bothina
Computational Physics
First principle calculations are performed to investigate the effect of polar order strength on the thermoelectric (TE) properties of GeTe alloy in its rhombohedral structure. The variation in the polarization state using various ferroelectric distortions λ (λ=0,0.5,1.0,1.25,1.5) allows to change the thermoelectric properties to a large extent. The polar structure with a high polarization mode (λ=1.5) tends to show a higher TE efficiency than the cubic structure at high temperatures. Thus, polarization engineering may play a key role in designing efficient thermoelectric devices. In particular, high TE performances could be achieved by growing epitaxial GeTe films that bi-axially compress the directions perpendicular to the polar axis, which may help to tune the Curie temperature.
title Effect of the polar distortion on the thermoelectric properties of GeTe
topic Computational Physics
url https://arxiv.org/abs/1911.05301