Monolayer TiAlTe3: A Perfect Room-Temperature Valleytronic Semiconductor.

IF 3.1 3区 材料科学 Q3 CHEMISTRY, PHYSICAL
Materials Pub Date : 2025-05-21 DOI:10.3390/ma18102396
Kang Jia, Chang-Wen Zhang, Zi-Ran Wang, Pei-Ji Wang
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引用次数: 0

Abstract

Investigating valley-related physics in rare intrinsic ferromagnetic materials with high-temperature stability and viable synthesis methods is of vital importance for advancing fundamental physics and information technology. Through first-principles calculations, we forecast that monolayer TiAlTe3 has superb structural stability, a ferromagnetic coupling mechanism deriving from direct-exchange and superexchange interactions, and a high magnetic transition temperature. We observed spontaneous valley polarization of 103 meV in the bottom conduction band when monolayer TiAlTe3 is magnetized toward an out-of-plane orientation. Additionally, because of its powerful valley-contrasting Berry curvature, the anomalous valley Hall effect emerges under an in-plane electric field. The cooperation of ferromagnetic coupling, a high magnetic transition temperature, and spontaneous valley polarization makes monolayer TiAlTe3 a promising room-temperature ferrovalley material for use in nanoscale spintronics and valleytronics.

单层TiAlTe3:一种完美的室温谷电子半导体。
研究具有高温稳定性和可行合成方法的稀有本征铁磁材料中的谷相关物理对于推进基础物理和信息技术的发展具有重要意义。通过第一性原理计算,我们预测单层TiAlTe3具有极好的结构稳定性、直接交换和超交换相互作用产生的铁磁耦合机制以及较高的磁转变温度。当单层TiAlTe3向面外方向磁化时,在底部导带中观察到103mev的自发谷极化。此外,由于其强大的山谷-对比贝里曲率,反常山谷霍尔效应在平面内电场下出现。铁磁耦合、高磁转变温度和自发谷极化的共同作用使单层TiAlTe3成为一种很有前途的室温铁谷材料,可用于纳米级自旋电子学和谷电子学。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
Materials
Materials MATERIALS SCIENCE, MULTIDISCIPLINARY-
CiteScore
5.80
自引率
14.70%
发文量
7753
审稿时长
1.2 months
期刊介绍: Materials (ISSN 1996-1944) is an open access journal of related scientific research and technology development. It publishes reviews, regular research papers (articles) and short communications. Our aim is to encourage scientists to publish their experimental and theoretical results in as much detail as possible. Therefore, there is no restriction on the length of the papers. The full experimental details must be provided so that the results can be reproduced. Materials provides a forum for publishing papers which advance the in-depth understanding of the relationship between the structure, the properties or the functions of all kinds of materials. Chemical syntheses, chemical structures and mechanical, chemical, electronic, magnetic and optical properties and various applications will be considered.
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