Monitoring Vibrational Evolution in Jahn-Teller Effect by Raman Imaging

Fuente: arXiv
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Main Authors: Yu, Hai-Zhen, Chu, Dingwei, Li, Yuanzhi, Wang, Li, Song, Yuzhi, Duan, Sai, Wang, Chuan-Kui, Xie, Zhen
Format: Preprint
Published: 2025
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author Yu, Hai-Zhen
Chu, Dingwei
Li, Yuanzhi
Wang, Li
Song, Yuzhi
Duan, Sai
Wang, Chuan-Kui
Xie, Zhen
author_facet Yu, Hai-Zhen
Chu, Dingwei
Li, Yuanzhi
Wang, Li
Song, Yuzhi
Duan, Sai
Wang, Chuan-Kui
Xie, Zhen
contents The Jahn-Teller effect (JTE) reduces the geometrical symmetry of a system with degenerate electronic states via vibronic coupling, playing a pivotal role in molecular and condensed systems. In this Letter, we propose that vibrational resolved tip-enhanced Raman scattering images can visualize the vibrational evolutions in JTE in real space. Taking an experimentally viable single zinc phthalocyanine (ZnPc) molecule as a proof-of-principle example, not only the degenerate vibrational splitting but also the overlooked vibration mixing caused by the JTE in its anionic form can be straightforwardly characterized by Raman images. Leveraging Raman images, the controllable configuration of JTE distortion with partial isotopic substitution could be further identified. These findings establish a practical protocol to monitor the detailed vibrational evolutions when a single molecule experiences JTE, opening a door for visualization of spontaneous symmetry breaking in molecular and solid-state systems.
format Preprint
id arxiv_https___arxiv_org_abs_2502_10017
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Monitoring Vibrational Evolution in Jahn-Teller Effect by Raman Imaging
Yu, Hai-Zhen
Chu, Dingwei
Li, Yuanzhi
Wang, Li
Song, Yuzhi
Duan, Sai
Wang, Chuan-Kui
Xie, Zhen
Mesoscale and Nanoscale Physics
The Jahn-Teller effect (JTE) reduces the geometrical symmetry of a system with degenerate electronic states via vibronic coupling, playing a pivotal role in molecular and condensed systems. In this Letter, we propose that vibrational resolved tip-enhanced Raman scattering images can visualize the vibrational evolutions in JTE in real space. Taking an experimentally viable single zinc phthalocyanine (ZnPc) molecule as a proof-of-principle example, not only the degenerate vibrational splitting but also the overlooked vibration mixing caused by the JTE in its anionic form can be straightforwardly characterized by Raman images. Leveraging Raman images, the controllable configuration of JTE distortion with partial isotopic substitution could be further identified. These findings establish a practical protocol to monitor the detailed vibrational evolutions when a single molecule experiences JTE, opening a door for visualization of spontaneous symmetry breaking in molecular and solid-state systems.
title Monitoring Vibrational Evolution in Jahn-Teller Effect by Raman Imaging
topic Mesoscale and Nanoscale Physics
url https://arxiv.org/abs/2502.10017