论文标题

在$ p $ - 轨道螺旋原子链中进行旋转过滤

Spin-filtering in a $p$-orbital helical atomic chain

论文作者

Utsumi, Yasuhiro, Kato, Takemitsu, Entin-Wohlman, Ora, Aharony, Amnon

论文摘要

我们从理论上分析了由自旋轨道相互作用(SOI)诱导的两端系统中的自旋滤波,作为``手性诱导的旋转选择性''(CISS)效应的可能起源,在手性分子(例如DNA)中观察到了实验。由于Bardarson的定理,无法在包含一个轨道通道的分子中实现自旋滤波。但是,当涉及两个轨道时,SOI可以诱导与两个末端的分子中的自旋滤波,而无需制动时间转换对称性。特别是,我们提供了一个$ 4 \ times 4 $反射矩阵的示例,用于通过包含两个轨道通道的分子的跨性电子,该分子符合Bardarson的定理并产生有限的自旋电导。作为一种微观玩具模型,我们考虑了一条DNA,我们考虑了一个$ p $ - 轨道螺旋原子原子链,带有原子内SOI和沿螺旋的结晶场。该模型表现出两轨道自旋滤波:对于保留螺旋对称性的各种参数,该模型托有旋转的不对称状态,载有上下旋转的旋转对,并以相反的方向传播。螺旋状态的典型能量尺度是原子内SOI和曲率的产物。这种能量的巨大价值将我们的模型确定为解释有机分子中CISS的可能候选者。

We theoretically analyze spin filtering in two-terminal systems, induced by the spin-orbit interaction (SOI), as a possible origin of the ``chirality-induced spin selectivity'' (CISS) effect observed experimentally in chiral molecules, such as DNA. Due to Bardarson's theorem, spin filtering cannot be realized in a molecule containing one orbital-channel. However, when two orbitals are involved, SOI can induce spin filtering in a molecule coupled to two terminals without braking time-reversal symmetry. In particular, we provide an example of a $4 \times 4$ reflection matrix for a spinful electron passing through a molecule containing two orbital-channels, which complies with Bardarson's theorem and produces a finite spin conductance. As a microscopic toy model realizing a single strand of DNA, we consider a $p$-orbital helical atomic chain with intra-atomic SOI's and a strong crystalline field along the helix. This model exhibits two-orbital spin filtering: For various parameters preserving the helical symmetry, the model hosts spin asymmetric states carrying pairs of up and down spins propagating in opposite directions. The typical energy scale of the helical states is the product of the intra-atomic SOI and the curvature. The large value of this energy identifies our model as a likely candidate to explain the CISS in organic molecules.

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