Multiscale space-time ansatz for correlation functions of quantum systems based on quantics tensor trains

H Shinaoka, M Wallerberger, Y Murakami, K Nogaki… - Physical Review X, 2023 - APS
The correlation functions of quantum systems—central objects in quantum field theories—
are defined in high-dimensional space-time domains. Their numerical treatment thus suffers …

No superconductivity in PbCu(PO)O found in orbital and spin fluctuation exchange calculations

N Witt, L Si, JM Tomczak, K Held, TO Wehling - SciPost Physics, 2023 - scipost.org
Finding a material that turns superconducting under ambient conditions has been the goal of
over a century of research, and recently Pb $ _ {10-x} $ Cu $ _x $(PO $ _4 $) $ _6 $ O aka …

Discrete Lehmann representation of imaginary time Green's functions

J Kaye, K Chen, O Parcollet - Physical Review B, 2022 - APS
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 …

Hybrid quantum-classical algorithm for computing imaginary-time correlation functions

R Sakurai, W Mizukami, H Shinaoka - Physical Review Research, 2022 - APS
Quantitative descriptions of strongly correlated materials pose a considerable challenge in
condensed matter physics and chemistry. A promising approach to address this problem is …

Decomposing imaginary-time Feynman diagrams using separable basis functions: Anderson impurity model strong-coupling expansion

J Kaye, Z Huang, HUR Strand, D Golež - Physical Review X, 2024 - APS
We present a deterministic algorithm for the efficient evaluation of imaginary-time diagrams
based on the recently introduced discrete Lehmann representation (DLR) of imaginary-time …

Efficient anisotropic Migdal-Eliashberg calculations with an intermediate representation basis and Wannier interpolation

H Mori, T Nomoto, R Arita, ER Margine - Physical Review B, 2024 - APS
In this study, we combine the ab initio Migdal-Eliashberg approach with the intermediate
representation of the Green's function, enabling accurate and efficient calculations of the …

Challenges with relativistic GW calculations in solids and molecules

G Harsha, V Abraham, D Zgid - Faraday Discussions, 2024 - pubs.rsc.org
For molecules and solids containing heavy elements, accurate electronic-structure
calculations require accounting not only for electronic correlations but also for relativistic …

Solving the Bethe-Salpeter equation with exponential convergence

M Wallerberger, H Shinaoka, A Kauch - Physical Review Research, 2021 - APS
The Bethe-Salpeter equation plays a crucial role in understanding the physics of correlated
fermions, relating to optical excitations in solids as well as resonances in high-energy …

sparse-ir: Optimal compression and sparse sampling of many-body propagators

M Wallerberger, S Badr, S Hoshino, S Huber… - SoftwareX, 2023 - Elsevier
We introduce sparse-ir, a collection of libraries to efficiently handle imaginary-time
propagators, a central object in finite-temperature quantum many-body calculations. We …

Feynman diagrammatics based on discrete pole representations: A path to renormalized perturbation theories

D Gazizova, L Zhang, E Gull, JPF LeBlanc - Physical Review B, 2024 - APS
By merging algorithmic Matsubara integration with discrete pole representations we present
a procedure to generate fully analytic closed form results for impurity problems at fixed …