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In this study, we combine the ab initio Migdal-Eliashberg approach with the intermediate representation for the Green's function, enabling accurate and efficient calculations of the momentum-dependent superconducting gap function while…

Superconductivity · Physics 2025-05-15 Hitoshi Mori , Takuya Nomoto , Ryotaro Arita , Elena R. Margine

We combine the fully anisotropic Migdal-Eliashberg theory with electron-phonon interpolation based on maximally-localized Wannier functions, in order to perform reliable and highly accurate calculations of the anisotropic…

Superconductivity · Physics 2015-06-12 E. R. Margine , F. Giustino

We propose the sparse modeling approach for quasiclassical theory of superconductivity, which reduces the computational cost of solving the gap equations. The recently proposed sparse modeling approach is based on the fact that the Green's…

Superconductivity · Physics 2023-03-01 Yuki Nagai , Hiroshi Shinaoka

The popular, stable, robust and computationally inexpensive cubic spline interpolation algorithm is adopted and used for finite temperature Green's function calculations of realistic systems. We demonstrate that with appropriate…

Chemical Physics · Physics 2016-11-15 Alexei A. Kananenka , Alicia Rae Welden , Tran Nguyen Lan , Emanuel Gull , Dominika Zgid

We present a study of the superconducting transition in MgB2 using the ab-initio pseudopotential density functional method and the fully anisotropic Eliashberg equation. Our study shows that the anisotropic Eliashberg equation, constructed…

Superconductivity · Physics 2009-02-05 Hyoung Joon Choi , David Roundy , Hong Sun , Marvin L. Cohen , Steven G. Louie

Experimentally relevant signatures of superconductivity require access to real-frequency quantities, such as the spectral functions, optical response, and transport properties, yet Migdal-Eliashberg calculations are commonly performed on…

In the theory of electron-phonon superconductivity both the magnitude of the electron-phonon coupling $\lambda$ as well as the Coulomb pseudopotential $\mu^*$ are important to determine the transition temperature $T_c$ and other properties.…

Superconductivity · Physics 2013-04-24 Johannes Bauer , Jong E. Han , Olle Gunnarsson

We propose an improved quantum algorithm to calculate the Green's function through real-time propagation, and use it to compute the retarded Green's function for the 2-, 3- and 4-site Hubbard models. This novel protocol significantly…

Quantum Physics · Physics 2022-10-21 Francesco Libbi , Jacopo Rizzo , Francesco Tacchino , Nicola Marzari , Ivano Tavernelli

This lecture note reviews recently proposed sparse-modeling approaches for efficient ab initio many-body calculations based on the data compression of Green's functions. The sparse-modeling techniques are based on a compact orthogonal…

High-doping induced Urbach tails and band gap narrowing play a significant role in determining the performance of tunneling devices and optoelectronic devices such as tunnel field-effect transistors (TFETs), Esaki diodes and light-emitting…

Mesoscale and Nanoscale Physics · Physics 2023-08-04 Prasad Sarangapani , Yuanchen Chu , James Charles , Tillmann Kubis

The ab initio anisotropic Migdal-Eliashberg formalism has been used to examine the pairing mechanism and the nature of the superconducting gap in the recently discovered lithium-decorated monolayer graphene superconductor. Our results…

Superconductivity · Physics 2017-03-10 Jing-Jing Zheng , E. R. Margine

We compute unbiased spectral functions of the two-dimensional Hubbard model by extrapolating Green functions, obtained from determinantal quantum Monte Carlo simulations, to the thermodynamic and continuous time limits. Our results clearly…

Strongly Correlated Electrons · Physics 2012-10-09 D. Rost , E. V. Gorelik , F. Assaad , N. Blümer

Migdal-Eliashberg theory describes the properties of the normal and superconducting states of electron-phonon mediated superconductors based on a perturbative treatment of the electron-phonon interactions. It is necessary to include both…

Superconductivity · Physics 2021-01-27 Benjamin Nosarzewski , Michael Schueler , Thomas P. Devereaux

We present an efficient basis for imaginary time Green's functions based on a low rank decomposition of the spectral Lehmann representation. The basis functions are simply a set of well-chosen exponentials, so the corresponding expansion…

Numerical Analysis · Mathematics 2023-07-31 Jason Kaye , Kun Chen , Olivier Parcollet

We use a diagrammatic hopping expansion to calculate finite-temperature Green functions of the Bose-Hubbard model which describes bosons in an optical lattice. This technique allows for a summation of subsets of diagrams, so the divergence…

Statistical Mechanics · Physics 2013-05-30 Matthias Ohliger , Axel Pelster

In this work, we present a method to reconstruct real-frequency properties from analytically continued causal Green's functions within the framework of Migdal-Eliashberg (ME) theory for superconductivity. ME theory involves solving a set of…

Superconductivity · Physics 2024-10-15 D. M. Khodachenko , R. Lucrezi , P. N. Ferreira , M. Aichhorn , C. Heil

The Eliashberg theory of superconductivity accounts for the fundamental physics of conventional electron-phonon superconductors, including the retardation of the interaction and the effect of the Coulomb pseudopotential, to predict the…

The temperature-dependent Matsubara Green's function that is used to describe temperature-dependent behavior is expressed on a numerical grid. While such a grid usually has a couple of hundred points for low-energy model systems, for…

Chemical Physics · Physics 2016-11-15 Alexei A. Kananenka , Jordan J. Phillips , Dominika Zgid

The electromagnetic Green's function is a crucial ingredient for the theoretical study of modern photonic quantum devices, but is often difficult or even impossible to calculate directly. We present a numerically efficient framework for…

Mesoscale and Nanoscale Physics · Physics 2026-04-15 Robert Meiners Fuchs , Juanjuan Ren , Stephen Hughes , Marten Richter

Including finite-temperature effects from the electronic degrees of freedom in electronic structure calculations of semiconductors and metals is desired; however, in practice it remains exceedingly difficult when using zero-temperature…

Chemical Physics · Physics 2016-11-24 Alicia Rae Welden , Alexander A. Rusakov , Dominika Zgid
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