自旋电子学
凝聚态物理
材料科学
巨磁阻
磁电阻
密度泛函理论
之字形的
钝化
铁磁性
悬空债券
光电子学
纳米技术
磁场
化学
计算化学
硅
物理
量子力学
数学
几何学
图层(电子)
作者
Saurabh Kharwar,Sangeeta Singh,Neeraj K. Jaiswal
标识
DOI:10.1109/tnano.2022.3174247
摘要
In the present work, the spin-polarized structural and electronic properties of fluorine (F) passivated zigzag boron nitride nanoribbons (ZBNNRs) at the selective boron (B) and nitrogen (N) edge atoms are investigated. This study is based on the density functional theory (DFT) along with non-equilibrium Green function (NEGF) formalism. Our study predicts that half-metallic property can be obtained in ZBNNRs via F passivation at selective edges. The F-passivated ZBNNRs are found to be structurally stable in both non-magnetic as well as magnetic ground states irrespective of their width. Hence, the transport properties of F-passivated ZBNNRs are also studied as fluorinated structures are reported to be more stable. The current-voltage characteristic of F-passivated ZBNNRs based devices exhibit the perfect spin-filter characteristics with magnificently high spin-filtering efficiency (SFE) even under a low bias. It is worth mentioning here that giant magnetoresistance resistance (GMR), and rectification ratio of the order of 108 and 105 have also been observed for F-BN-F devices. This is because dangling bonds break the edge states' symmetry and induce some localized states, which suppress the electron transmission and reduce the current. The observed perfect spin-filtering characteristics, GMR, and rectifying characteristics suggest that Fpassivated ZBNNRs have immense potentials to be deployed for nanoscale spintronic devices.
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