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Optical and Piezoelectric Properties of Strained Orthorhombic PdS2

Shuo Deng, Menglun Tao, Jie Mei, Min Li, Yan Zhang, Lijie Li Orcid Logo

IEEE Transactions on Nanotechnology, Volume: 18, Pages: 358 - 364

Swansea University Author: Lijie Li Orcid Logo

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DOI (Published version): 10.1109/TNANO.2019.2908221

Abstract

We investigate optical and piezoelectric properties of the orthorhombic PdS 2 under symmetrical biaxial tensile strains with various magnitudes. The ab initio simulation results found that the peaks of the refractive index, extinction coefficient, absorption coefficient, and reflectivity of the orth...

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Published in: IEEE Transactions on Nanotechnology
ISSN: 1536-125X 1941-0085
Published: 2019
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URI: https://cronfa.swan.ac.uk/Record/cronfa49770
first_indexed 2019-03-29T11:16:12Z
last_indexed 2019-05-13T10:24:50Z
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spelling 2019-05-09T15:38:51.8774208 v2 49770 2019-03-27 Optical and Piezoelectric Properties of Strained Orthorhombic PdS2 ed2c658b77679a28e4c1dcf95af06bd6 0000-0003-4630-7692 Lijie Li Lijie Li true false 2019-03-27 ACEM We investigate optical and piezoelectric properties of the orthorhombic PdS 2 under symmetrical biaxial tensile strains with various magnitudes. The ab initio simulation results found that the peaks of the refractive index, extinction coefficient, absorption coefficient, and reflectivity of the orthorhombic PdS 2 red-shift with the tensile strains. Specifically, we discover that the absorption coefficient of the strained orthorhombic PdS 2 (4.01 × 10 5 /cm −5.52 × 10 5 /cm) is much higher than traditional optoelectronics, piezoelectric, and piezophototronic materials such as Si, Ge, GaInAs, ZnO, and monolayer MoS 2 demonstrating much wider absorption spectrum (670–1033 nm). Moreover, the piezoelectric constant of the orthorhombic PdS 2 is calculated from 0% to 8% tensile strains. Simulation results show the orthorhombic PdS 2 with 4% tensile strain has a strong piezoelectric effect (1.33 C/m 2 ), which is 100–5000 times higher than other deformation magnitudes. The results indicate that the orthorhombic PdS 2 will have potential application in piezophotonic and piezoelectric devices. Journal Article IEEE Transactions on Nanotechnology 18 358 364 1536-125X 1941-0085 31 12 2019 2019-12-31 10.1109/TNANO.2019.2908221 COLLEGE NANME Aerospace, Civil, Electrical, and Mechanical Engineering COLLEGE CODE ACEM Swansea University 2019-05-09T15:38:51.8774208 2019-03-27T11:12:39.9584237 Faculty of Science and Engineering School of Aerospace, Civil, Electrical, General and Mechanical Engineering - Electronic and Electrical Engineering Shuo Deng 1 Menglun Tao 2 Jie Mei 3 Min Li 4 Yan Zhang 5 Lijie Li 0000-0003-4630-7692 6 0049770-27032019111358.pdf TNANO-00070-2019R1.pdf 2019-03-27T11:13:58.4870000 Output 766649 application/pdf Accepted Manuscript true 2019-03-27T00:00:00.0000000 true eng
title Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
spellingShingle Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
Lijie Li
title_short Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
title_full Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
title_fullStr Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
title_full_unstemmed Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
title_sort Optical and Piezoelectric Properties of Strained Orthorhombic PdS2
author_id_str_mv ed2c658b77679a28e4c1dcf95af06bd6
author_id_fullname_str_mv ed2c658b77679a28e4c1dcf95af06bd6_***_Lijie Li
author Lijie Li
author2 Shuo Deng
Menglun Tao
Jie Mei
Min Li
Yan Zhang
Lijie Li
format Journal article
container_title IEEE Transactions on Nanotechnology
container_volume 18
container_start_page 358
publishDate 2019
institution Swansea University
issn 1536-125X
1941-0085
doi_str_mv 10.1109/TNANO.2019.2908221
college_str Faculty of Science and Engineering
hierarchytype
hierarchy_top_id facultyofscienceandengineering
hierarchy_top_title Faculty of Science and Engineering
hierarchy_parent_id facultyofscienceandengineering
hierarchy_parent_title Faculty of Science and Engineering
department_str School of Aerospace, Civil, Electrical, General and Mechanical Engineering - Electronic and Electrical Engineering{{{_:::_}}}Faculty of Science and Engineering{{{_:::_}}}School of Aerospace, Civil, Electrical, General and Mechanical Engineering - Electronic and Electrical Engineering
document_store_str 1
active_str 0
description We investigate optical and piezoelectric properties of the orthorhombic PdS 2 under symmetrical biaxial tensile strains with various magnitudes. The ab initio simulation results found that the peaks of the refractive index, extinction coefficient, absorption coefficient, and reflectivity of the orthorhombic PdS 2 red-shift with the tensile strains. Specifically, we discover that the absorption coefficient of the strained orthorhombic PdS 2 (4.01 × 10 5 /cm −5.52 × 10 5 /cm) is much higher than traditional optoelectronics, piezoelectric, and piezophototronic materials such as Si, Ge, GaInAs, ZnO, and monolayer MoS 2 demonstrating much wider absorption spectrum (670–1033 nm). Moreover, the piezoelectric constant of the orthorhombic PdS 2 is calculated from 0% to 8% tensile strains. Simulation results show the orthorhombic PdS 2 with 4% tensile strain has a strong piezoelectric effect (1.33 C/m 2 ), which is 100–5000 times higher than other deformation magnitudes. The results indicate that the orthorhombic PdS 2 will have potential application in piezophotonic and piezoelectric devices.
published_date 2019-12-31T19:42:36Z
_version_ 1821345218427879424
score 11.04748

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