Yu Hong, Shang Yan, Hu Yangyang, Pei Lei, Zhang Guiling
School of Materials Science and Chemical Engineering, Harbin University of Science and Technology, Harbin 150080, China.
Nanomaterials (Basel). 2023 Aug 7;13(15):2270. doi: 10.3390/nano13152270.
A series of four-terminal V(Bz)-WGNR devices were established with wrinkled graphene nanoribbon (WGNR) and vanadium-benzene nanowire (V(Bz)). The spin-polarized V(Bz) as the gate channel was placed crossing the plane, the concave (endo-positioned) and the convex (endo-positioned) surface of WGNR with different curvatures via Van der Waals interaction. The density functional theory (DFT) and nonequilibrium Green's function (NEGF) methods were adopted to calculate the transport properties of these devices at various bias voltages () and gate voltages (), such as the conductance, spin-polarized currents, transmission spectra (TS), local density of states (LDOS), and scattering states. The results indicate that the position of V(Bz) and the bending curvature of WGNR play important roles in tuning the transport properties of these four-terminal devices. A spin-polarized transport property is induced for these four-terminal devices by the spin-polarized nature of V(Bz). Particularly, the down-spin channel disturbs strongly on the source-to-drain conductance of WGNR when V(Bz) is endo-positioned crossing the WGNR. Our findings on the novel property of four-terminal V(Bz)-WGNR devices provide useful guidelines for achieving flexible graphene-based electronic nanodevices by attaching other similar multidecker metal-arene nanowires.
利用褶皱石墨烯纳米带(WGNR)和钒苯纳米线(V(Bz))构建了一系列四端V(Bz)-WGNR器件。自旋极化的V(Bz)作为栅极通道,通过范德华相互作用穿过具有不同曲率的WGNR的平面、凹面(内位置)和凸面(外位置)表面。采用密度泛函理论(DFT)和非平衡格林函数(NEGF)方法计算这些器件在各种偏置电压()和栅极电压()下的输运性质,如电导、自旋极化电流、透射谱(TS)、局域态密度(LDOS)和散射态。结果表明,V(Bz)的位置和WGNR的弯曲曲率在调节这些四端器件的输运性质方面起着重要作用。由于V(Bz)的自旋极化性质,这些四端器件具有自旋极化输运特性。特别是,当V(Bz)内位置穿过WGNR时,向下自旋通道对WGNR的源漏电导有强烈干扰。我们对四端V(Bz)-WGNR器件新特性的研究结果为通过连接其他类似的多层金属芳烃纳米线实现柔性石墨烯基电子纳米器件提供了有用的指导。