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In-plane ferroelectric monolayer TlNbX4O and its application in bulk photovoltaic effect
Shen, Shiying1; Ai, Haoqiang1; Ma, Yandong2; Bai, Haoyun1; Du, Xuejian3; Li, Feifei1; Pan, Hui1,4
2023-07-31
Source PublicationApplied Physics Letters
ISSN0003-6951
Volume123Issue:5Pages:052901
Abstract

A bulk photovoltaic effect (BPVE) in materials without inversion symmetry attracts increasing interest for high-efficiency solar cells beyond the p-n junction paradigm. Herein, we report the photovoltaic effect in an experimentally feasible TlNbXO monolayer (TlNbXO-ML, X = Cl, Br, I) with a large ferroelectric polarization. Using first-principles calculations, we demonstrate that TlNbXO-MLs are ferroelectric semiconductors with moderate switching barriers and higher spontaneous polarizations. Furthermore, we observe fairly giant shift current with the values of 109.6 μA/V for TlNbClO, 60 μA/V for TlNbBrO, and 56.1 μA/V for TlNbIO. These results unveil distinct features of the BPVE and the potential application of two-dimensional ferroelectric materials for next-generation photovoltaic devices.

DOI10.1063/5.0156495
URLView the original
Indexed BySCIE
Language英語English
WOS Research AreaPhysics
WOS SubjectPhysics, Applied
WOS IDWOS:001041573200002
Scopus ID2-s2.0-85166953085
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Citation statistics
Document TypeJournal article
CollectionINSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING
Corresponding AuthorPan, Hui
Affiliation1.Institute of Applied Physics and Materials Engineering, University of Macau, 999078, Macao
2.School of Physics, Shandong University, Jinan, Shandanan Street 27, 250100, China
3.School of Physics and Electronics, Shandong Normal University, Jinan, 250014, China
4.Department of Physics and Chemistry, Faculty of Science and Technology, University of Macau, 999078, Macao
First Author AffilicationINSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING
Corresponding Author AffilicationINSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING;  Faculty of Science and Technology
Recommended Citation
GB/T 7714
Shen, Shiying,Ai, Haoqiang,Ma, Yandong,et al. In-plane ferroelectric monolayer TlNbX4O and its application in bulk photovoltaic effect[J]. Applied Physics Letters, 2023, 123(5), 052901.
APA Shen, Shiying., Ai, Haoqiang., Ma, Yandong., Bai, Haoyun., Du, Xuejian., Li, Feifei., & Pan, Hui (2023). In-plane ferroelectric monolayer TlNbX4O and its application in bulk photovoltaic effect. Applied Physics Letters, 123(5), 052901.
MLA Shen, Shiying,et al."In-plane ferroelectric monolayer TlNbX4O and its application in bulk photovoltaic effect".Applied Physics Letters 123.5(2023):052901.
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