Electron-phonon coupling in correlated metals: A dynamical mean-field theory study

Understanding how phonons affect the properties of correlated quantum materials is a fundamental issue in materials theory. Here, the authors develop a method to calculate the interaction between electrons and lattice vibrations in such materials using computational methods capable of treating entangled electrons in real materials, and apply it to paradigmatic correlated systems SrVO${}_{3}$ and CaCuO${}_{2}$. The couplings are found to differ substantially from those predicted by standard density functional methods, with the differences reflecting the underlying physics of the materials. This work sets the stage for a comprehensive approach beyond density functional theory of electron-phonon interactions in quantum materials.

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Publication Details

Journal
Physical review. B./Physical review. B
Published
2025-07-18
DOI
https://doi.org/10.1103/467t-z5b2
Citations
9
Primary Topic
Thermodynamic and Structural Properties of Metals and Alloys
Type
article
Field-Weighted Citation Impact
6.42
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article

Electron-phonon coupling in correlated metals: A dynamical mean-field theory study

Karl J. Friston
9 citations
Physical review. B./Physical review. B
Thermodynamic and Structural Properties of Metals and Alloys
6.42
article

Electron-phonon coupling in correlated metals: A dynamical mean-field theory study

Karl J. Friston
article en
9 citations

Abstract

Understanding how phonons affect the properties of correlated quantum materials is a fundamental issue in materials theory. Here, the authors develop a method to calculate the interaction between electrons and lattice vibrations in such materials using computational methods capable of treating entangled electrons in real materials, and apply it to paradigmatic correlated systems SrVO${}_{3}$ and CaCuO${}_{2}$. The couplings are found to differ substantially from those predicted by standard density functional methods, with the differences reflecting the underlying physics of the materials. This work sets the stage for a comprehensive approach beyond density functional theory of electron-phonon interactions in quantum materials.

Physical review. B./Physical review. BVol. 112(7)
California Institute of Technology (US), TU Wien (AT), Flatiron Health (United States) (US), Flatiron Institute (US), Columbia University (US)
Openalex Percentile: Top 3%
Thermodynamic and Structural Properties of Metals and Alloys
6.42
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