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High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co

The dice lattice, containing a stack of three triangular lattices, has been proposed to exhibit nontrivial flat bands with nonzero Chern numbers, but unlike the honeycomb lattice it is much less studied. By employing density-functional theory (DFT) calculations with an on-site Coulomb repulsion term...

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Autores principales: Köksal, Okan, Li, L. L., Pentcheva, Rossitza
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10313702/
https://www.ncbi.nlm.nih.gov/pubmed/37391462
http://dx.doi.org/10.1038/s41598-023-36170-9
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author Köksal, Okan
Li, L. L.
Pentcheva, Rossitza
author_facet Köksal, Okan
Li, L. L.
Pentcheva, Rossitza
author_sort Köksal, Okan
collection PubMed
description The dice lattice, containing a stack of three triangular lattices, has been proposed to exhibit nontrivial flat bands with nonzero Chern numbers, but unlike the honeycomb lattice it is much less studied. By employing density-functional theory (DFT) calculations with an on-site Coulomb repulsion term, we explore systematically the electronic and topological properties of (LaXO(3))(3)/(LaAlO(3))(3)(111) superlattices with X = Ti, Mn and Co, where a LaAlO(3) trilayer spacer confines the LaXO(3) (LXO) dice lattice. In the absence of spin-orbit coupling (SOC) with symmetry constrained to P3, the ferromagnetic (FM) phase of the LXO(111) trilayers exhibits a half-metallic band structure with multiple Dirac crossings and coupled electron-hole pockets around the Fermi energy. Symmetry lowering induces a significant rearrangement of bands and triggers a metal-to-insulator transition. Inclusion of SOC leads to a substantial anomalous Hall conductivity (AHC) around the Fermi energy reaching values up to [Formula: see text] for X = Mn and Co in P3 symmetry and both in- and out-of-plane magnetization directions in the first case and along [001] in the latter. The dice lattice emerges as a promising playground to realise nontrivial topological phases with high Chern numbers.
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spelling pubmed-103137022023-07-02 High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co Köksal, Okan Li, L. L. Pentcheva, Rossitza Sci Rep Article The dice lattice, containing a stack of three triangular lattices, has been proposed to exhibit nontrivial flat bands with nonzero Chern numbers, but unlike the honeycomb lattice it is much less studied. By employing density-functional theory (DFT) calculations with an on-site Coulomb repulsion term, we explore systematically the electronic and topological properties of (LaXO(3))(3)/(LaAlO(3))(3)(111) superlattices with X = Ti, Mn and Co, where a LaAlO(3) trilayer spacer confines the LaXO(3) (LXO) dice lattice. In the absence of spin-orbit coupling (SOC) with symmetry constrained to P3, the ferromagnetic (FM) phase of the LXO(111) trilayers exhibits a half-metallic band structure with multiple Dirac crossings and coupled electron-hole pockets around the Fermi energy. Symmetry lowering induces a significant rearrangement of bands and triggers a metal-to-insulator transition. Inclusion of SOC leads to a substantial anomalous Hall conductivity (AHC) around the Fermi energy reaching values up to [Formula: see text] for X = Mn and Co in P3 symmetry and both in- and out-of-plane magnetization directions in the first case and along [001] in the latter. The dice lattice emerges as a promising playground to realise nontrivial topological phases with high Chern numbers. Nature Publishing Group UK 2023-06-30 /pmc/articles/PMC10313702/ /pubmed/37391462 http://dx.doi.org/10.1038/s41598-023-36170-9 Text en © The Author(s) 2023 https://creativecommons.org/licenses/by/4.0/Open AccessThis article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) .
spellingShingle Article
Köksal, Okan
Li, L. L.
Pentcheva, Rossitza
High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co
title High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co
title_full High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co
title_fullStr High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co
title_full_unstemmed High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co
title_short High Chern numbers in a perovskite-derived dice lattice (LaXO(3))(3)/(LaAlO(3))(3)(111) with X = Ti, Mn and Co
title_sort high chern numbers in a perovskite-derived dice lattice (laxo(3))(3)/(laalo(3))(3)(111) with x = ti, mn and co
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10313702/
https://www.ncbi.nlm.nih.gov/pubmed/37391462
http://dx.doi.org/10.1038/s41598-023-36170-9
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