Nonvolatile magnetoelectric coupling in two-dimensional van der Waals sandwich heterostructure CuInP2S6/MnCl3/CuInP2S6†

IF 2.9 3区 化学 Q3 CHEMISTRY, PHYSICAL Physical Chemistry Chemical Physics Pub Date : 2023-10-10 DOI:10.1039/D3CP03798C
Zichun Wang, Honggang Pan and Baozeng Zhou
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Abstract

Electrical control of magnetism is of great interest for low-energy-consumption spintronic applications. Due to the recent experimental breakthrough in two-dimensional materials, with the absence of hanging bonds on the surface and strong tolerance for lattice mismatch, heterogeneous integration of different two-dimensional materials provides a new opportunity for coupling between different physical properties. Here, we report the realization of nonvolatile magnetoelectric coupling in vdW sandwich heterostructure CuInP2S6/MnCl3/CuInP2S6. Using first-principles calculations, we reveal that when interfacing with ferroelectric CuInP2S6, the Dirac half-metallic state of monolayer MnCl3 will be destroyed. Moreover, depending on the electrically polarized direction of CuInP2S6, MnCl3 can be a half-metal or a ferromagnetic semiconductor. We unveil that the obtained ferromagnetic semiconductor in MnCl3 can be attributed to the different gain and loss of electrons on the two adjacent Mn atoms due to the sublattice symmetry broken by interlayer coupling. The effects of interfacial magnetoelectric coupling on magnetic anisotropy and ferromagnetic Curie temperature of MnCl3 are also investigated, and a multiferroic memory based on this model is designed. Our work not only provides a promising way to design nonvolatile electrical control of magnetism but also renders monolayer MnCl3 an appealing platform for developing low-dimensional memory devices.

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二维范德华三明治异质结构CuInP2S6/MnCl3/CuInP2S6中的非挥发性磁电耦合。
磁性的电气控制对于低能耗的自旋电子应用非常感兴趣。由于最近在二维材料方面的实验突破,由于表面没有悬挂键,对晶格失配的容忍度很强,不同二维材料的非均匀集成为不同物理性质之间的耦合提供了新的机会。在这里,我们报道了在vdW三明治异质结构CuInP2S6/MnCl3/CuInP2S6中实现非易失性磁电耦合。利用第一性原理计算,我们发现当与铁电CuInP2S6接触时,单层MnCl3的Dirac半金属态将被破坏。此外,根据CuInP2S6的电极化方向,MnCl3可以是半金属或铁磁半导体。我们揭示了在MnCl3中获得的铁磁半导体可以归因于由于层间耦合破坏了亚晶格对称性而导致相邻两个Mn原子上电子的不同增益和损失。研究了界面磁电耦合对MnCl3的磁各向异性和铁磁居里温度的影响,并设计了基于该模型的多铁性存储器。我们的工作不仅为设计磁性的非易失性电气控制提供了一种很有前途的方法,而且使单层MnCl3成为开发低维存储器件的一个有吸引力的平台。
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来源期刊
Physical Chemistry Chemical Physics
Physical Chemistry Chemical Physics 化学-物理:原子、分子和化学物理
CiteScore
5.50
自引率
9.10%
发文量
2675
审稿时长
2.0 months
期刊介绍: Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.
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