English

Orbital-Free Quasi-Density Functional Theory

Strongly Correlated Electrons 2024-01-18 v3 Quantum Physics

Abstract

Wigner functions are broadly used to probe non-classical effects in the macroscopic world. Here we develop an orbital-free functional framework to compute the 1-body Wigner quasi-probability for both fermionic and bosonic systems. Since the key variable is a quasi-density, this theory is particularly well suited to circumvent the problem of finding the Pauli potential or approximating the kinetic energy in orbital-free density functional theory. As proof of principle, we find that the universal functional for the building block of optical lattices results from a translation, a contraction, and a rotation of the corresponding functional of the 1-body reduced density matrix, indicating a strong connection between these functional theories. Furthermore, we relate the concepts of Wigner negativity and vv-representability, and find a manifold of ground states with negative Wigner functions.

Keywords

Cite

@article{arxiv.2304.09056,
  title  = {Orbital-Free Quasi-Density Functional Theory},
  author = {Carlos L. Benavides-Riveros},
  journal= {arXiv preprint arXiv:2304.09056},
  year   = {2024}
}

Comments

10 pages, 6 figures

R2 v1 2026-06-28T10:09:50.142Z