English

Fractionalized Kohn-Sham Scheme for Strongly Correlated Electrons

Computational Physics 2025-04-08 v2

Abstract

We propose to expand the territory of density functional theory to strongly correlated electrons by reformulating the Kohn-Sham scheme in the representation of fractionalized particles. We call it the ``KS* scheme.'' Using inhomogeneous tt-JJ chains as a test bed, we show that the KS* scheme with simple local density approximation is able to achieve accurate ground-state energy and density distribution comparable to the density matrix renormalization group method, while the computational complexity is much lower.

Keywords

Cite

@article{arxiv.2412.01061,
  title  = {Fractionalized Kohn-Sham Scheme for Strongly Correlated Electrons},
  author = {Bo Zhao and Jingyu Zhao and Zheng Zhu and Jian Wu and Zheng Liu},
  journal= {arXiv preprint arXiv:2412.01061},
  year   = {2025}
}

Comments

7 pages, 4 figures. Updated to match published version in Phys. Rev. Lett. 134, 136505 (2025)

R2 v1 2026-06-28T20:19:00.290Z