Investigation of MoTe nanowires in honeycomb and kagome lattices: Dirac cones and flat bands

In this work, we focus on electronic properties of transition-metal monochalcogenide nanowires. Specifically, we apply first-principles calculations to investigate the emergence of Dirac states and flat bands when MoTe nanowires are used as building blocks in kagome and honeycomb lattices. We show that, in spite of being non-covalent, the in-plane interactions of the nanowires are able to reproduce the idiosyncracies associated with these lattices. We describe the contributions of Molybdenium<i>d</i>-orbitals and Tellurium<i>p</i>-orbitals to the electronic states, and we discuss the pivotal role of spin-orbit coupling and of the interwire distances to the phenomenology.

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Publication Details

Journal
Journal of Physics Condensed Matter
Published
2025-02-13
DOI
https://doi.org/10.1088/1361-648x/adb5e6
Primary Topic
Topological Materials and Phenomena
Type
article
Field-Weighted Citation Impact
0.00

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article

Investigation of MoTe nanowires in honeycomb and kagome lattices: Dirac cones and flat bands

Mário S. C. Mazzoni, Guilherme A. S. Ribeiro, Túlio V de Oliveira
Journal of Physics Condensed Matter
Topological Materials and Phenomena
article

Investigation of MoTe nanowires in honeycomb and kagome lattices: Dirac cones and flat bands

Mário S. C. Mazzoni, Guilherme A. S. Ribeiro, Túlio V de Oliveira
article en

Abstract

In this work, we focus on electronic properties of transition-metal monochalcogenide nanowires. Specifically, we apply first-principles calculations to investigate the emergence of Dirac states and flat bands when MoTe nanowires are used as building blocks in kagome and honeycomb lattices. We show that, in spite of being non-covalent, the in-plane interactions of the nanowires are able to reproduce the idiosyncracies associated with these lattices. We describe the contributions of Molybdenium<i>d</i>-orbitals and Tellurium<i>p</i>-orbitals to the electronic states, and we discuss the pivotal role of spin-orbit coupling and of the interwire distances to the phenomenology.

Journal of Physics Condensed MatterVol. 37(14)
Universidade Federal de Minas Gerais (BR)
Coordenação de Aperfeiçoamento de Pessoal de Nível Superior, Conselho Nacional de Desenvolvimento Científico e Tecnológico, Fundação de Amparo à Pesquisa do Estado de Minas Gerais, Instituto Nacional de Ciência e Tecnologia em Nanomateriais de Carbono
Openalex Percentile: Top 98%
Topological Materials and Phenomena
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