Giant Kohn anomaly and chiral phonons in the charge density wave phase of 1H-NbSe$_2$

Fuente: arXiv
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Main Authors: Exists, Susy, Mardanya, Sougata, Markiewicz, Robert, Hakioglu, Tugrul, Nieminen, Jouko, Härkönen, Ville J., Sanga, Cem, Bansil, Arun, Chowdhury, Sugata
Format: Preprint
Published: 2025
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author Exists, Susy
Mardanya, Sougata
Markiewicz, Robert
Hakioglu, Tugrul
Nieminen, Jouko
Härkönen, Ville J.
Sanga, Cem
Bansil, Arun
Chowdhury, Sugata
author_facet Exists, Susy
Mardanya, Sougata
Markiewicz, Robert
Hakioglu, Tugrul
Nieminen, Jouko
Härkönen, Ville J.
Sanga, Cem
Bansil, Arun
Chowdhury, Sugata
contents Despite extensive investigations, many aspects of charge density waves (CDWs) remain elusive, especially the relative roles of electron-phonon coupling and Fermi surface nesting as the underlying driving mechanisms responsible for the emergence of the CDW vector $Q_{CDW}$. It is puzzling that even though electrons interact strongly with optical phonons in many correlated systems, the actual mode softening is of an acoustic mode. Here we consider monolayer 1H-NbSe$_2$ as an exemplar system, and through an accurate computation of the phonon self-energy, including its off-diagonal components, we provide compelling evidence that the relevant mode is a longitudinal optical phonon that softens by anti-crossing several intervening phonon bands, i.e. a Kohn ladder which has been only observed previously in high temperature superconductors. We also show that $Q_{CDW}$ is fixed by the convolution of the susceptibility and electron-phonon coupling, and that the softened phonons are circularly polarized.
format Preprint
id arxiv_https___arxiv_org_abs_2501_04821
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Giant Kohn anomaly and chiral phonons in the charge density wave phase of 1H-NbSe$_2$
Exists, Susy
Mardanya, Sougata
Markiewicz, Robert
Hakioglu, Tugrul
Nieminen, Jouko
Härkönen, Ville J.
Sanga, Cem
Bansil, Arun
Chowdhury, Sugata
Strongly Correlated Electrons
Materials Science
Despite extensive investigations, many aspects of charge density waves (CDWs) remain elusive, especially the relative roles of electron-phonon coupling and Fermi surface nesting as the underlying driving mechanisms responsible for the emergence of the CDW vector $Q_{CDW}$. It is puzzling that even though electrons interact strongly with optical phonons in many correlated systems, the actual mode softening is of an acoustic mode. Here we consider monolayer 1H-NbSe$_2$ as an exemplar system, and through an accurate computation of the phonon self-energy, including its off-diagonal components, we provide compelling evidence that the relevant mode is a longitudinal optical phonon that softens by anti-crossing several intervening phonon bands, i.e. a Kohn ladder which has been only observed previously in high temperature superconductors. We also show that $Q_{CDW}$ is fixed by the convolution of the susceptibility and electron-phonon coupling, and that the softened phonons are circularly polarized.
title Giant Kohn anomaly and chiral phonons in the charge density wave phase of 1H-NbSe$_2$
topic Strongly Correlated Electrons
Materials Science
url https://arxiv.org/abs/2501.04821