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Abstract
Including the effect of lattice anharmonicity on electron-phonon interactions has recently garnered attention due to its role as a necessary and significant component in explaining various phenomena, including superconductivity, optical response, and temperature dependence of mobility. This study focuses on analytically treating the effects of anharmonic electron-phonon coupling on the polaron self-energy, combined with numerical Diagrammatic Monte Carlo (DiagMC) data. Specifically, we incorporate a quadratic interaction into the method of squeezed phonon states, which has proven effective for analytically calculating the polaron parameters. Additionally, we extend this method to nonparabolic finite-width conduction bands while maintaining the periodic translation symmetry of the system. Our results are compared with those obtained from Diagrammatic Monte Carlo, partially reported in a recent study [S. Ragni, Phys. Rev. B 107, L121109 (2023)2469-995010.1103/PhysRevB.107.L121109], covering a wide range of coupling strengths for the nonlinear interaction. Remarkably, our analytic method predicts the same features as the Diagrammatic Monte Carlo simulation.
Originalsprache | Englisch |
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Aufsatznummer | 075107 |
Seitenumfang | 13 |
Fachzeitschrift | Physical Review B |
Jahrgang | 110 |
Ausgabenummer | 7 |
DOIs | |
Publikationsstatus | Veröffentlicht - 15 Aug. 2024 |
ÖFOS 2012
- 103018 Materialphysik
- 103015 Kondensierte Materie
- 103043 Computational Physics
Projekte
- 1 Laufend
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Ab-initio Berechnungen für anharmonische Polarone in Hydride
1/10/20 → 31/01/25
Projekt: Forschungsförderung