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Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study
First-principles calculations were used to investigate the electronic properties of the SiC/GeC nanosheet (the thickness was about 8 Å). With no electric field (E-field), the SiC/GeC nanosheet was shown to have a direct bandgap of 1.90 eV. In the band structure, the valence band of the SiC/GeC nanos...
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/PMC6562555/ https://www.ncbi.nlm.nih.gov/pubmed/31071940 http://dx.doi.org/10.3390/mi10050309 |
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author | Luo, Min Yu, Bin Xu, Yu-e |
author_facet | Luo, Min Yu, Bin Xu, Yu-e |
author_sort | Luo, Min |
collection | PubMed |
description | First-principles calculations were used to investigate the electronic properties of the SiC/GeC nanosheet (the thickness was about 8 Å). With no electric field (E-field), the SiC/GeC nanosheet was shown to have a direct bandgap of 1.90 eV. In the band structure, the valence band of the SiC/GeC nanosheet was mainly made up of C-p, while the conduction band was mainly made up of C-p, Si-p, and Ge-p, respectively. Application of the E-field to the SiC/GeC nanosheet was found to facilitate modulation of the bandgap, regularly reducing it to zero, which was linked to the direction and strength of the E-field. The major bandgap modulation was attributed to the migration of C-p, Si-p, and Ge-p orbitals around the Fermi level. Our conclusions might give some theoretical guidance for the development and application of the SiC/GeC nanosheet. |
format | Online Article Text |
id | pubmed-6562555 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | MDPI |
record_format | MEDLINE/PubMed |
spelling | pubmed-65625552019-06-17 Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study Luo, Min Yu, Bin Xu, Yu-e Micromachines (Basel) Article First-principles calculations were used to investigate the electronic properties of the SiC/GeC nanosheet (the thickness was about 8 Å). With no electric field (E-field), the SiC/GeC nanosheet was shown to have a direct bandgap of 1.90 eV. In the band structure, the valence band of the SiC/GeC nanosheet was mainly made up of C-p, while the conduction band was mainly made up of C-p, Si-p, and Ge-p, respectively. Application of the E-field to the SiC/GeC nanosheet was found to facilitate modulation of the bandgap, regularly reducing it to zero, which was linked to the direction and strength of the E-field. The major bandgap modulation was attributed to the migration of C-p, Si-p, and Ge-p orbitals around the Fermi level. Our conclusions might give some theoretical guidance for the development and application of the SiC/GeC nanosheet. MDPI 2019-05-08 /pmc/articles/PMC6562555/ /pubmed/31071940 http://dx.doi.org/10.3390/mi10050309 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 Luo, Min Yu, Bin Xu, Yu-e Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study |
title | Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study |
title_full | Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study |
title_fullStr | Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study |
title_full_unstemmed | Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study |
title_short | Tuning Electronic Properties of the SiC-GeC Bilayer by External Electric Field: A First-Principles Study |
title_sort | tuning electronic properties of the sic-gec bilayer by external electric field: a first-principles study |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6562555/ https://www.ncbi.nlm.nih.gov/pubmed/31071940 http://dx.doi.org/10.3390/mi10050309 |
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