English

Bound on the Excess Charge of Generalized Thomas-Fermi-Weizs\"acker Functionals

Mathematical Physics 2025-02-24 v1 Analysis of PDEs math.MP

Abstract

We bound the number of electrons QQ that an atom can bind in excess of neutrality for density functionals generalizing the classical Thomas-Fermi-Weizs\"acker functional: instead of the classical power 5/35/3 more general powers pp are considered. For 3/2<p<23/2<p<2 we prove the excess charge conjecture, i.e., that QQ is uniformly bounded in the atomic number ZZ. The case p=3/2p=3/2 is critical: the behavior changes from a uniform bound in ZZ to a linear bound at the critical coupling 4π4\sqrt\pi of the nonlinear term. We also improve the linear bound for all p6/5p\geq6/5.

Cite

@article{arxiv.2502.15444,
  title  = {Bound on the Excess Charge of Generalized Thomas-Fermi-Weizs\"acker Functionals},
  author = {Rafael D. Benguria and Heinz Siedentop},
  journal= {arXiv preprint arXiv:2502.15444},
  year   = {2025}
}
R2 v1 2026-06-28T21:52:43.735Z