DOI: 10.1063/1.4867515. Electronic structures and optical properties of two-dimensional ScN and YN nanosheets

Electronic structures and optical properties of two-dimensional ScN and YN nanosheets

10.1063/1.4867515

Crossref journal-article

AIP Publishing

Journal of Applied Physics (317)

Abstract

Two-dimensional (2D) materials exhibit different electronic properties than their bulk materials. Here, we present a systematic study of 2D tetragonal materials of ScN and YN using density functional theory calculations. Several thermodynamically stable 2D tetragonal structures were determined, and such novel tetragonal structures have good electronic and optical properties. Both bulk ScN and YN are indirect band gap semiconductors while the electronic structures of 2D ScN and YN are indirect gap semiconductors, with band gaps of 0.62–2.21 eV. The calculated optical spectra suggest that 2D tetragonal ScN and YN nanosheets have high visible light absorption efficiency. These electronic properties indicate that 2D ScN and YN have great potential for applications in photovoltaics and photocatalysis.

Bibliography

Liu, J., Li, X.-B., Zhang, H., Yin, W.-J., Zhang, H.-B., Peng, P., & Liu, L.-M. (2014). Electronic structures and optical properties of two-dimensional ScN and YN nanosheets. Journal of Applied Physics, 115(9).

Authors 7

Jian Liu (first)
Xi-Bo Li (additional)
Hui Zhang (additional)
Wen-Jin Yin (additional)
Hai-Bin Zhang (additional)
Ping Peng (additional)
Li-Min Liu (additional)

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Dates

Type	When
Created	11 years, 5 months ago (March 4, 2014, 8:30 p.m.)
Deposited	2 years, 1 month ago (July 3, 2023, 9:31 p.m.)
Indexed	3 weeks, 4 days ago (July 30, 2025, 7:03 a.m.)
Issued	11 years, 5 months ago (March 4, 2014)
Published	11 years, 5 months ago (March 4, 2014)
Published Online	11 years, 5 months ago (March 4, 2014)
Published Print	11 years, 5 months ago (March 7, 2014)

Funders 1

NNSFC 10.13039/501100001809 National Natural Science Foundation of China
Region: Asia
gov (National government)
Labels11
1. Chinese National Science Foundation
2. Natural Science Foundation of China
3. National Science Foundation of China
4. NNSF of China
5. NSF of China
6. 国家自然科学基金委员会
7. National Nature Science Foundation of China
8. Guójiā Zìrán Kēxué Jījīn Wěiyuánhuì
9. NSFC
10. NNSF
11. NNSFC
Awards1
1. 51222212

BibTeX

@article{Liu_2014, title={Electronic structures and optical properties of two-dimensional ScN and YN nanosheets}, volume={115}, ISSN={1089-7550}, url={http://dx.doi.org/10.1063/1.4867515}, DOI={10.1063/1.4867515}, number={9}, journal={Journal of Applied Physics}, publisher={AIP Publishing}, author={Liu, Jian and Li, Xi-Bo and Zhang, Hui and Yin, Wen-Jin and Zhang, Hai-Bin and Peng, Ping and Liu, Li-Min}, year={2014}, month=mar }

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