ORCID: https://orcid.org/0000-0002-0696-0876 und Siedentop, Heinz
ORCID: https://orcid.org/0000-0003-1422-7882
(2025):
Bound on the excess charge of generalized Thomas-Fermi-Weizsäcker functionals.
In: Journal of Mathematical Physics, Vol. 66, No. 7, 072103
[PDF, 4MB]
Abstract
We bound the number of electrons Q that an atom can bind in excess of neutrality for density functionals generalizing the classical Thomas-Fermi-Weizsäcker functional: instead of the classical power 5/3 more general powers p are considered. For 3/2 < p < 2 we prove the excess charge conjecture, i.e., that Q is uniformly bounded in the atomic number Z. The case p = 3/2 is critical: the behavior changes from a uniform bound in Z to a linear bound at the critical coupling of the nonlinear term. We also improve the linear bound for all p ≥ 6/5.
| Item Type: | Journal article |
|---|---|
| Faculties: | Mathematics, Computer Science and Statistics > Mathematics |
| Subjects: | 500 Science > 510 Mathematics |
| URN: | urn:nbn:de:bvb:19-epub-129379-6 |
| ISSN: | 0022-2488 |
| Language: | English |
| Item ID: | 129379 |
| Date Deposited: | 06. Nov 2025 06:18 |
| Last Modified: | 06. Nov 2025 06:18 |
| DFG: | Gefördert durch die Deutsche Forschungsgemeinschaft (DFG) - 390814868 |
| DFG: | Gefördert durch die Deutsche Forschungsgemeinschaft (DFG) - 470903074 |
