Interatomic spin-orbit interaction in a $p$-orbital helical atomic chain

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Hauptverfasser: Kato, Takemitsu, Utsumi, Yasuhiro, Entin-Wohlman, Ora, Aharony, Amnon
Format: Preprint
Veröffentlicht: 2025
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author Kato, Takemitsu
Utsumi, Yasuhiro
Entin-Wohlman, Ora
Aharony, Amnon
author_facet Kato, Takemitsu
Utsumi, Yasuhiro
Entin-Wohlman, Ora
Aharony, Amnon
contents We derive the interatomic spin-orbit interaction (SOI) from a helical atomic chain composed of $p$-orbitals with intra-atomic SOI, which exhibits a helical state--a potential origin of the chiral-induced spin selectivity (CISS) effect. In this model, a strong crystal field in the tangential direction of the helix leads to the formation of energetically separated $σ$- and $π$-bands. In the second-order process, a spin in the $σ$-orbital virtually hops to the $π$-orbital, flips its direction due to intra-atomic SOI, and then hops back to the $σ$-orbital in the neighboring atom due to the misalignment of $p$-orbitals along the helix. This process induces an interatomic SOI in the $σ$-band, which takes the form of a Rashba-type SOI generated by an electric field normal to the helical axis. The magnitude of the SOI is proportional to the curvature, the hopping energy, the intra-atomic SOI energy, and inversely proportional to the crystal field strength. The second-order process also induces long-range second-nearest-neighbor hoppings. We analytically derive the spin-split band structure in the zero-torsion limit.
format Preprint
id arxiv_https___arxiv_org_abs_2512_01504
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Interatomic spin-orbit interaction in a $p$-orbital helical atomic chain
Kato, Takemitsu
Utsumi, Yasuhiro
Entin-Wohlman, Ora
Aharony, Amnon
Mesoscale and Nanoscale Physics
We derive the interatomic spin-orbit interaction (SOI) from a helical atomic chain composed of $p$-orbitals with intra-atomic SOI, which exhibits a helical state--a potential origin of the chiral-induced spin selectivity (CISS) effect. In this model, a strong crystal field in the tangential direction of the helix leads to the formation of energetically separated $σ$- and $π$-bands. In the second-order process, a spin in the $σ$-orbital virtually hops to the $π$-orbital, flips its direction due to intra-atomic SOI, and then hops back to the $σ$-orbital in the neighboring atom due to the misalignment of $p$-orbitals along the helix. This process induces an interatomic SOI in the $σ$-band, which takes the form of a Rashba-type SOI generated by an electric field normal to the helical axis. The magnitude of the SOI is proportional to the curvature, the hopping energy, the intra-atomic SOI energy, and inversely proportional to the crystal field strength. The second-order process also induces long-range second-nearest-neighbor hoppings. We analytically derive the spin-split band structure in the zero-torsion limit.
title Interatomic spin-orbit interaction in a $p$-orbital helical atomic chain
topic Mesoscale and Nanoscale Physics
url https://arxiv.org/abs/2512.01504