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手性分子中关联诱导电子交换驱动的电荷再分布与自旋极化

Charge Redistribution and Spin Polarization Driven by Correlation Induced Electron Exchange in Chiral Molecules.

作者信息

Fransson Jonas

机构信息

Department of Physics and Astronomy, Uppsala University, Box 516, 75121 Uppsala, Sweden.

出版信息

Nano Lett. 2021 Apr 14;21(7):3026-3032. doi: 10.1021/acs.nanolett.1c00183. Epub 2021 Mar 24.

DOI:10.1021/acs.nanolett.1c00183
PMID:33759530
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC8050826/
Abstract

Chiral induced spin selectivity is a phenomenon that has been attributed to chirality, spin-orbit interactions, and nonequilibrium conditions, while the role of electron exchange and correlations have been investigated only marginally until very recently. However, as recent experiments show that chiral molecules acquire a finite spin-polarization merely by being in contact with a metallic surface, these results suggest that electron correlations play a more crucial role for the emergence of the phenomenon than previously thought. Here, it is demonstrated that molecular vibrations give rise to molecular charge redistribution and accompany spin-polarization when coupling a chiral molecule to a nonmagnetic metal. The presented theory opens up new routes to construct a comprehensive picture of enantiomer separation.

摘要

手性诱导自旋选择性是一种归因于手性、自旋-轨道相互作用和非平衡条件的现象,而电子交换和关联的作用直到最近才受到很少的研究。然而,最近的实验表明,手性分子仅通过与金属表面接触就能获得有限的自旋极化,这些结果表明,电子关联对该现象出现所起的作用比之前认为的更为关键。本文证明,当将手性分子与非磁性金属耦合时,分子振动会导致分子电荷重新分布并伴随自旋极化。所提出的理论为构建对映体分离的全面图景开辟了新途径。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/648d4e7b92bc/nl1c00183_0004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/b5413e2f6629/nl1c00183_0001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/5310daf58261/nl1c00183_0002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/46694f13c83d/nl1c00183_0003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/648d4e7b92bc/nl1c00183_0004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/b5413e2f6629/nl1c00183_0001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/5310daf58261/nl1c00183_0002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/46694f13c83d/nl1c00183_0003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c5d0/8050826/648d4e7b92bc/nl1c00183_0004.jpg

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