TMB (TM = Cr, Fe)单层:一种新型室温反铁磁拓扑结线半金属。

IF 8 2区 材料科学 Q1 CHEMISTRY, PHYSICAL
Chenqian Yan, Yuqing Mao, Jie Li, Zijin Wang, Ailei He, Yuanyuan Duan, Xiuyun Zhang
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引用次数: 0

摘要

结合磁性和拓扑结构的二维材料在自旋电子学和量子计算领域具有独特的优势。然而,同时集成这两种特性的二维(2D)材料的设计仍然是一个重大挑战。通过系统第一性原理计算,我们预测了两种高度稳定的二维过渡金属硼化物(TMBs)。我们的结果表明,这两种结构都是反铁磁(AFM)狄拉克节点线半金属(NLSMs),在费米能级附近具有多个带交叉。在双轴应变下,FeB在2%的拉伸应变下可转变为铁磁态,进一步验证了其具有Weyl节点环(Weyl NLs)。这一发现为磁性拓扑材料的调控提供了新的见解,并在低功耗自旋电子器件的应用中具有很大的潜力。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
TMB (TM = Cr, Fe) monolayers: a new type of room temperature antiferromagnetic topological nodal line semimetal.

Two-dimensional materials that combine magnetism and topology offer unique advantages in the fields of spintronics and quantum computing. However, the design of two-dimensional (2D) materials simultaneously integrating both properties remains a significant challenge. Through systematic first-principles calculations, we predict two highly stable two-dimensional transition metal borides (TMBs). Our results reveal that both structures are antiferromagnetic (AFM) Dirac nodal line semimetals (NLSMs) with multiple band crossings near the Fermi level. Under biaxial strain, FeB can be transformed into a ferromagnetic state under 2% tensile strain, which is further verified to possess Weyl nodal loops (Weyl NLs). This discovery provides novel insights for the regulation of magnetic topological materials and holds promising potential for applications in low-power-consumption spintronic devices.

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来源期刊
Nanoscale Horizons
Nanoscale Horizons Materials Science-General Materials Science
CiteScore
16.30
自引率
1.00%
发文量
141
期刊介绍: Nanoscale Horizons stands out as a premier journal for publishing exceptionally high-quality and innovative nanoscience and nanotechnology. The emphasis lies on original research that introduces a new concept or a novel perspective (a conceptual advance), prioritizing this over reporting technological improvements. Nevertheless, outstanding articles showcasing truly groundbreaking developments, including record-breaking performance, may also find a place in the journal. Published work must be of substantial general interest to our broad and diverse readership across the nanoscience and nanotechnology community.
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