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One-Dimensional Lieb-Oxford Bounds

Mathematical Physics 2020-07-15 v3 Materials Science math.MP Chemical Physics

Abstract

We investigate and prove Lieb-Oxford bounds in one dimension by studying convex potentials that approximate the ill-defined Coulomb potential. A Lieb-Oxford inequality establishes a bound of the indirect interaction energy for electrons in terms of the one-body particle density ρψ\rho_\psi of a wave function ψ\psi. Our results include modified soft Coulomb potential and regularized Coulomb potential. For these potentials, we establish Lieb-Oxford-type bounds utilizing logarithmic expressions of the particle density. Furthermore, a previous conjectured form Ixc(ψ)C1Rρψ(x)2dxI_\mathrm{xc}(\psi)\geq - C_1 \int_{\mathbb R} \rho_\psi(x)^{2} \mathrm{d}x is discussed for different convex potentials.

Keywords

Cite

@article{arxiv.1910.01925,
  title  = {One-Dimensional Lieb-Oxford Bounds},
  author = {Andre Laestadius and Fabian M Faulstich},
  journal= {arXiv preprint arXiv:1910.01925},
  year   = {2020}
}
R2 v1 2026-06-23T11:34:36.408Z