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Magnetic Behavior in TiS(3) Nanoribbon
The electronic structure, magnetic properties and strain response of N-a-TiS(3) nanoribbons are investigated by first-principles calculations. We find that the magnetic ground state is strongly dependent on width of a-TiS(3). When N equals an odd number the ground state is a ferromagnetic (FM) metal...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6862672/ https://www.ncbi.nlm.nih.gov/pubmed/31731449 http://dx.doi.org/10.3390/ma12213501 |
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author | Lai, Shengqiang Du, Yongping |
author_facet | Lai, Shengqiang Du, Yongping |
author_sort | Lai, Shengqiang |
collection | PubMed |
description | The electronic structure, magnetic properties and strain response of N-a-TiS(3) nanoribbons are investigated by first-principles calculations. We find that the magnetic ground state is strongly dependent on width of a-TiS(3). When N equals an odd number the ground state is a ferromagnetic (FM) metal, meanwhile, when N equals an even number the ground state is an anti-ferromagnetic (AFM) metal. More interestingly, a tensile strain as large as 6% can tune the 9-a-TiS(3) nanoribbon from a FM metal to a half metal. A 4% tensile strain also causes a phase transition from AFM to FM ground state for 10-a-TiS(3) nanoribbon. Our findings show that N-a-TiS(3) is a promising candidate for spintronic and electronic applications. |
format | Online Article Text |
id | pubmed-6862672 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | MDPI |
record_format | MEDLINE/PubMed |
spelling | pubmed-68626722019-12-05 Magnetic Behavior in TiS(3) Nanoribbon Lai, Shengqiang Du, Yongping Materials (Basel) Article The electronic structure, magnetic properties and strain response of N-a-TiS(3) nanoribbons are investigated by first-principles calculations. We find that the magnetic ground state is strongly dependent on width of a-TiS(3). When N equals an odd number the ground state is a ferromagnetic (FM) metal, meanwhile, when N equals an even number the ground state is an anti-ferromagnetic (AFM) metal. More interestingly, a tensile strain as large as 6% can tune the 9-a-TiS(3) nanoribbon from a FM metal to a half metal. A 4% tensile strain also causes a phase transition from AFM to FM ground state for 10-a-TiS(3) nanoribbon. Our findings show that N-a-TiS(3) is a promising candidate for spintronic and electronic applications. MDPI 2019-10-25 /pmc/articles/PMC6862672/ /pubmed/31731449 http://dx.doi.org/10.3390/ma12213501 Text en © 2019 by the authors. Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (http://creativecommons.org/licenses/by/4.0/). |
spellingShingle | Article Lai, Shengqiang Du, Yongping Magnetic Behavior in TiS(3) Nanoribbon |
title | Magnetic Behavior in TiS(3) Nanoribbon |
title_full | Magnetic Behavior in TiS(3) Nanoribbon |
title_fullStr | Magnetic Behavior in TiS(3) Nanoribbon |
title_full_unstemmed | Magnetic Behavior in TiS(3) Nanoribbon |
title_short | Magnetic Behavior in TiS(3) Nanoribbon |
title_sort | magnetic behavior in tis(3) nanoribbon |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6862672/ https://www.ncbi.nlm.nih.gov/pubmed/31731449 http://dx.doi.org/10.3390/ma12213501 |
work_keys_str_mv | AT laishengqiang magneticbehaviorintis3nanoribbon AT duyongping magneticbehaviorintis3nanoribbon |