UM  > INSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING
Residential Collegefalse
Status已發表Published
Computational Study of Strong Phonon Softening and Electron-Phonon Interaction in Doped Monolayer Tellurene: Implications for Neuromorphic Applications
Cui, Xiangyue; Cai, Yongqing
2023-09-15
Source PublicationACS Applied Nano Materials
ISSN2574-0970
Volume6Issue:19Pages:17457-17463
Abstract

Synthesized two-dimensional tellurene (2D-Te) has gained widespread attention due to its merits of air stability and high carrier mobility. However, the mechanism of intrinsic carrier-lattice scattering, governing the transport performance of 2D-Te is still unknown. Herein, the doped α phase of 2D-Te is explored with respect to its intrinsic electron-phonon (e-p) coupling mechanism via density functional theory and Wannier interpolation methods. We reveal that electron doping can strongly renormalize the phonon of 2D-Te, while hole doping leads to instability. Substantial softening in phonons occur with electron doping in pristine monolayer tellurene, and in particular, dipping initiates in dispersion around the zone center and midst of M-K high-symmetry points. Especially, when electron doping coexists with strains, the lattice suffers from undulation and exhibits poor stability behavior. The occurrence of enhanced softening of those phonons coincides with enhanced e-p scattering and is rooted in the pocket states generated by the upward-shifted Fermi level. The asymmetric dependence of doping polarity and the selectively enhanced softening behavior with tunable lattice-charge coupling make 2D-Te a unique system for reconfigurational operation and neuromorphic applications.

Keyword2d Tellurene Charge Doping Electron−phonon Interaction First-principles Calculation Lattice Vibration
DOI10.1021/acsanm.3c02559
URLView the original
Indexed BySCIE
Language英語English
WOS Research AreaScience & Technology - Other Topics ; Materials Science
WOS SubjectNanoscience & Nanotechnology ; Materials Science, Multidisciplinary
WOS IDWOS:001068508500001
PublisherAMER CHEMICAL SOC1155 16TH ST, NW, WASHINGTON, DC 20036
Scopus ID2-s2.0-85175085053
Fulltext Access
Citation statistics
Document TypeJournal article
CollectionINSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING
Corresponding AuthorCai, Yongqing
AffiliationJoint Key Laboratory of the Ministry of Education, Institute of Applied Physics and Materials Engineering, University of Macau, Taipa, 123456, Macao
First Author AffilicationINSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING
Corresponding Author AffilicationINSTITUTE OF APPLIED PHYSICS AND MATERIALS ENGINEERING
Recommended Citation
GB/T 7714
Cui, Xiangyue,Cai, Yongqing. Computational Study of Strong Phonon Softening and Electron-Phonon Interaction in Doped Monolayer Tellurene: Implications for Neuromorphic Applications[J]. ACS Applied Nano Materials, 2023, 6(19), 17457-17463.
APA Cui, Xiangyue., & Cai, Yongqing (2023). Computational Study of Strong Phonon Softening and Electron-Phonon Interaction in Doped Monolayer Tellurene: Implications for Neuromorphic Applications. ACS Applied Nano Materials, 6(19), 17457-17463.
MLA Cui, Xiangyue,et al."Computational Study of Strong Phonon Softening and Electron-Phonon Interaction in Doped Monolayer Tellurene: Implications for Neuromorphic Applications".ACS Applied Nano Materials 6.19(2023):17457-17463.
Files in This Item:
There are no files associated with this item.
Related Services
Recommend this item
Bookmark
Usage statistics
Export to Endnote
Google Scholar
Similar articles in Google Scholar
[Cui, Xiangyue]'s Articles
[Cai, Yongqing]'s Articles
Baidu academic
Similar articles in Baidu academic
[Cui, Xiangyue]'s Articles
[Cai, Yongqing]'s Articles
Bing Scholar
Similar articles in Bing Scholar
[Cui, Xiangyue]'s Articles
[Cai, Yongqing]'s Articles
Terms of Use
No data!
Social Bookmark/Share
All comments (0)
No comment.
 

Items in the repository are protected by copyright, with all rights reserved, unless otherwise indicated.