High-precision minmax solution of the two-center Dirac equation
We present a high-precision solution of the Dirac equation by numerically solving the minmax two-center Dirac equation with the finite-element method (FEM). The minmax FEM provide a highly accurate benchmark result for systems with light or heavy atomic nuclear charge $Z$. A result is shown for the molecular ion ${\mathrm{H}}_{2}{}^{+}$ and the heavy quasimolecular ion ${\mathrm{Th}}_{2}{}^{179+}$, with estimated fractional uncertainties of approximately ${10}^{\ensuremath{-}23}$ and approximately ${10}^{\ensuremath{-}21}$, respectively. The result of the minmax FEM's high precision of the solution of the two-center Dirac equation allows solid control over the required accuracy level and is promising for the application and extension of our method.
Authors
- Ossama Kullie (ORCID: https://orcid.org/0000-0003-3931-7235)
Institutions
- University of Kassel (DE)
Publication Details
- Journal
- Physical review. A/Physical review, A
- Published
- 2024-11-18
- DOI
- https://doi.org/10.1103/physreva.110.052808
- Citations
- 1
- Primary Topic
- Atomic and Molecular Physics
- Type
- article
- Field-Weighted Citation Impact
- 0.34
Funders
- Universität Kassel