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Abstract: Nanostructured ferroelectrics display exotic multidomain configurations resulting from the electrostatic and elastic boundary conditions they are subject to. While the ferroelectric domains appear frozen in experimental images, atomistic second-principles studies suggest that they may become spontaneously mobile upon heating, with the polar order melting in a liquidlike fashion. Here, we run molecular dynamics simulations of model systems (PbTiO3/SrTiO3 superlattices) to study the unique features of this transformation. Most notably, we find that the multidomain state loses its translational and orientational orders at different temperatures, resembling the behavior of liquid crystals and yielding an intermediate hexaticlike phase. Our simulations reveal the mechanism responsible for the melting and allow us to characterize the stochastic dynamics in the hexaticlike phase: we find evidence that it is thermally activated, with domain reorientation rates that grow from tens of gigahertzs to terahertzs in a narrow temperature window.
Fuente: Physical Review Letters, 2024, 133(6), 066801
Publisher: American Physical Society
Publication date: 01/08/2024
No. of pages: 7
Publication type: Article
DOI: 10.1103/PhysRevLett.133.066801
ISSN: 0031-9007,1079-7114
Spanish project: PID2022-139776NB-C63
Publication Url: https://doi.org/10.1103/PhysRevLett.133.066801
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FERNANDO GOMEZ ORTIZ
GRAF, MÓNICA
FRANCISCO JAVIER JUNQUERA QUINTANA
ÍÑIGUEZ-GONZÁLEZ, JORGE
ARAMBERRI, HUGO
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