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Dynamically Corrected Bethe-Salpeter Equation Solver for Self-consistent $GW$ Reference on the Matsubara Frequency Axis

Chemical Physics 2026-05-06 v2 Strongly Correlated Electrons

Abstract

We present a Bethe-Salpeter equation (BSE) solver based on a self-consistent GWGW reference evaluated on the Matsubara frequency axis, referred to as BSE@scGWGW. The self-consistent GWGW starting point provides a robust quasiparticle description and reduces sensitivity to the initial mean-field reference compared to one-shot GWGW-based approaches. We further introduce a dynamical correction to the static Casida formulation via a plasmon-pole model. This scheme incorporates simple dynamical screening effects while retaining the efficiency of an effective eigenvalue problem. The resulting dynamically corrected BSE@scGWGW yields excitation energies in close agreement with high-level wavefunction-based benchmarks for both singlet and triplet excitations of small molecules. Overall, the accuracy of the dynamic BSE@scGWGW approach arises from the combination of a well-converged single-particle reference and the inclusion of frequency-dependent screening effects.

Cite

@article{arxiv.2604.22187,
  title  = {Dynamically Corrected Bethe-Salpeter Equation Solver for Self-consistent $GW$ Reference on the Matsubara Frequency Axis},
  author = {Ming Wen and Gaurav Harsha and Dominika Zgid},
  journal= {arXiv preprint arXiv:2604.22187},
  year   = {2026}
}

Comments

19 pages, 6 figures

R2 v1 2026-07-01T12:33:17.566Z