Nanotubes Based on 2D SMoSiN2 Materials of Janus Type for Applications in Nanoelectronics

2D XMoSiN2 materials of Janus type (X = S, Se or Te) are characterized by high binding energies and a strong built-in electric field, which allows the generated electron–hole pairs to be separated within a single layer. These 2D materials show promise for photovoltaic applications. In this paper, the modeling process is used to examine the grown and optimized small diameter nanotubes based on SMoSiN2 2D materials of Janus type. Using calculations within the framework of density functional theory, band structures and optical absorption spectra of such nanotubes with different arrangements of chalcogen were obtained. For the structures under consideration, a wide absorption region of short-wave radiation is observed with a tube deformation of ε = 12.46%. Nanotubes of XMoSiN2 Janus-type semiconductors behave like semiconductors, whose electronic and optical properties can be controlled by deformation.

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Publication Details

Journal
Semiconductors
Published
2025-12-01
DOI
https://doi.org/10.1134/s1063782625700071
Primary Topic
2D Materials and Applications
Type
article
Field-Weighted Citation Impact
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article

Nanotubes Based on 2D SMoSiN2 Materials of Janus Type for Applications in Nanoelectronics

D. A. Timkaeva, E. V. Morozova
Semiconductors
2D Materials and Applications
article

Nanotubes Based on 2D SMoSiN2 Materials of Janus Type for Applications in Nanoelectronics

D. A. Timkaeva, E. V. Morozova
article en

Abstract

2D XMoSiN2 materials of Janus type (X = S, Se or Te) are characterized by high binding energies and a strong built-in electric field, which allows the generated electron–hole pairs to be separated within a single layer. These 2D materials show promise for photovoltaic applications. In this paper, the modeling process is used to examine the grown and optimized small diameter nanotubes based on SMoSiN2 2D materials of Janus type. Using calculations within the framework of density functional theory, band structures and optical absorption spectra of such nanotubes with different arrangements of chalcogen were obtained. For the structures under consideration, a wide absorption region of short-wave radiation is observed with a tube deformation of ε = 12.46%. Nanotubes of XMoSiN2 Janus-type semiconductors behave like semiconductors, whose electronic and optical properties can be controlled by deformation.

SemiconductorsVol. 59(13)
Moscow Technological Institute (RU), Ulyanovsk State University (RU)
Affordable and clean energy
Openalex Percentile: Top 46%
2D Materials and Applications
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Nanotubes Based on 2D SMoSiN2 Materials of Janus Type for Applications in Nanoelectronics — D. A. Timkaeva, E. V. Morozova · Semiconductors (2025) | TGRS Research Map | TGRS