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Contact effects in spin transport along double-helical molecules

机译:沿双螺旋分子自旋传输的接触效应

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摘要

We report on spin transport along double-helical molecular systems by considering various contact configurations and asymmetries between the two helical strands in the regime of completely coherent charge transport. Our results reveal that no spin polarization appears in two-terminal molecular devices when coupled to one-dimensional electrodes. The same holds in the case of finite-width electrodes if there is a bottleneck of one single site in the system electrode-molecule-electrode. Then, additional dephasing is necessary to induce spin-filtering effects. In contrast, nonzero spin polarization is found in molecular devices with multiple terminals or with two finite-width electrodes, each of them connected to more than one site of the molecule. The magnitude of spin polarization can be enhanced by increasing the asymmetry between the two strands. We point out that the spin-filtering effects could emerge in double-helical molecular devices at low temperature without dephasing by a proper choice of the electrode number and the connection between the molecule and the electrodes.
机译:我们通过考虑各种接触构型和在完全相干电荷传输体制中的两个螺旋链之间的不对称性,报道了沿着双螺旋分子系统的自旋传输。我们的结果表明,与一维电极耦合时,在两个末端分子器件中没有自旋极化出现。如果在系统电极-分子-电极中存在一个单一位置的瓶颈,则对于有限宽度电极也是如此。然后,必须进行额外的移相来引起自旋滤波效果。相反,在具有多个末端或两个有限宽度电极的分子装置中发现非零自旋极化,每个电极都连接到分子的一个以上位点。自旋极化的幅度可以通过增加两条链之间的不对称性来增强。我们指出,在低温下,双螺旋分子器件中可能会出现自旋过滤效应,而不会因正确选择电极数量和分子与电极之间的连接而引起相移。

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