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首页> 外文期刊>Physical review >Giant proximity exchange and valley splitting in transition metal dichalcogenide/hBN/(Co, Ni) heterostructures
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Giant proximity exchange and valley splitting in transition metal dichalcogenide/hBN/(Co, Ni) heterostructures

机译:过渡金属二硫化氢/ hBN /(Co,Ni)异质结构中的巨大邻近交换和峰谷分裂

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We investigate the proximity-induced exchange coupling in transition-metal dichalcogenides (TMDCs). originating from spin injector geometries composed of hexagonal boron-nitride (hBN) and ferromagnetic (FM) cobalt (Co) or nickel (Ni), from first principles. We employ a minimal tight-binding Hamiltonian that captures the low energy bands of the TMDCs around K and K' valleys, to extract orbital, spin-orbit, and exchange parameters. The TMDC/hBN/FM heterostructure calculations show that due to the hBN buffer layer, the band structure of the TMDC is preserved, with an additional proximity-induced exchange splitting in the bands. We extract proximity exchange parameters in the 1-10 meV range, depending on the FM. The combination of proximity-induced exchange and intrinsic spin-orbit coupling (SOC) of the TMDCs. leads to a valley polarization, translating into magnetic exchange fields of tens of Tesla. The extracted parameters are useful for subsequent exciton calculations of TMDCs in the presence of a /hBN/FM spin injector. Our calculated absorption spectra show large splittings for the exciton peaks; in the case of MoS_2/hBN/Co we find a value of about 8 meV, corresponding to about 50 T external magnetic field in bare TMDCs. The reason lies in the band structure, where a hybridization with Co d orbitals causes a giant valence band exchange splitting of more than 10 meV. Structures with Ni do not show any d level hybridization features, but still sizable proximity exchange and exciton peak splittings of around 2 meV are present in the TMDCs.
机译:我们调查过渡金属二卤化物(TMDCs)中的邻近感应交换耦合。源自第一个原理的旋转喷射器几何形状,该几何形状由六方氮化硼(hBN)和铁磁(FM)钴(Co)或镍(Ni)组成。我们采用最小紧束缚哈密顿量,该量捕获K和K'谷周围TMDC的低能带,以提取轨道,自旋轨道和交换参数。 TMDC / hBN / FM异质结构计算表明,由于hBN缓冲层,保留了TMDC的能带结构,并在该能带中进行了额外的邻近感应交换。我们根据FM提取1-10 meV范围内的邻近交换参数。 TMDC的邻近感应交换和固有自旋轨道耦合(SOC)的组合。导致谷极极化,转化为数十特斯拉的磁场。在存在/ hBN / FM自旋注入器的情况下,提取的参数可用于TMDC的后续激子计算。我们计算出的吸收光谱显示出激子峰的大分裂;对于MoS_2 / hBN / Co,我们发现大约为8 meV,相当于裸露的TMDC中大约50 T的外部磁场。原因在于能带结构,其中与Co d轨道的杂交导致超过10 meV的巨大价带交换分裂。具有Ni的结构未显示任何d级杂交特征,但TMDC中仍存在相当大的邻近交换和2 meV左右的激子峰分裂。

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