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首页> 外文期刊>Journal of Materials Chemistry, C. materials for optical and electronic devices >Non-magnetic doping induced a high spin-filter efficiency and large spin Seebeck effect in zigzag graphene nanoribbons
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Non-magnetic doping induced a high spin-filter efficiency and large spin Seebeck effect in zigzag graphene nanoribbons

机译:非磁性掺杂在曲折形石墨烯纳米带中引起高自旋过滤效率和大自旋塞贝克效应

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摘要

Based on nonequilibrium Green's functions (NGF) and density-functional theory (DFT), we investigate the magnetotransport properties and magnetothermoelectric effects in zigzag graphene nanoribbons (ZGNRs) with non-magnetic doping on the double ribbon edges. One of the carbon atoms without hydrogen saturation in each ribbon edge is replaced by one boron (B) or one nitrogen (N) atom. Compared with boron-boron (BB) and nitrogen-nitrogen (NN) double-edge doping, the boron-nitrogen (BN) double-edge doping induces a perfect spin-filter effect with 100% negative spin polarization at the Fermi level. Moreover, we find that the thermoelectric effect can be enhanced by the double-edge doping. Interestingly, the spin Seebeck effect in NN- and BN-doped ZGNRs becomes comparable with the charge Seebeck effect and even larger than it. These results originate from the spin-dependent transmission node near the Fermi level induced by the non-magnetic doping. These findings strongly suggest that the double-edge-doped ZGNRs are promising materials for spintronics and thermo-spintronics.
机译:基于非平衡格林函数(NGF)和密度泛函理论(DFT),我们研究了在双带状边缘上进行非磁性掺杂的之字形石墨烯纳米带(ZGNR)中的磁输运性质和磁热效应。在每个碳带边缘没有氢饱和的碳原子之一被一个硼(B)或一个氮(N)原子取代。与硼-硼(BB)和氮-氮(NN)双边缘掺杂相比,硼-氮(BN)双边缘掺杂在费米能级下具有100%负自旋极化的理想自旋滤光效果。此外,我们发现通过双边缘掺杂可以增强热电效应。有趣的是,NN和BN掺杂ZGNR中的自旋塞贝克效应变得与电荷塞贝克效应相当,甚至更大。这些结果源自非磁性掺杂引起的费米能级附近的自旋相关传输节点。这些发现强烈表明,双边缘掺杂的ZGNR是自旋电子学和热自旋电子学的有前途的材料。

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