Exploring new exchange-correlation kernels in the Bethe-Salpeter equation: a study of the asymmetric Hubbard dimer
Abstract
The Bethe-Salpeter equation (BSE) is the key equation in many-body perturbation theory based on Green's functions to access response properties. Within the approximation to the exchange-correlation kernel, the BSE has been successfully applied to several finite and infinite systems. However, it also shows some failures, such as underestimated triplet excitation energies, lack of double excitations, ground-state energy instabilities in the dissociation limit, etc. In this work, we study the performance of the BSE within the approximation as well as the -matrix approximation for the excitation energies of the exactly solvable asymmetric Hubbard dimer. This model allows one to study various correlation regimes by varying the on-site Coulomb interaction as well as the degree of the asymmetry of the system by varying the difference of potential between the two sites. We show that, overall, the approximation gives more accurate excitation energies than over a wide range of and . However, the strongly-correlated (i.e., large ) regime still remains a challenge.
Keywords
Cite
@article{arxiv.2302.06679,
title = {Exploring new exchange-correlation kernels in the Bethe-Salpeter equation: a study of the asymmetric Hubbard dimer},
author = {Roberto Orlando and Pina Romaniello and Pierre-François Loos},
journal= {arXiv preprint arXiv:2302.06679},
year = {2023}
}
Comments
11 pages, 9 figures