Abstract
The interaction of an electron with a local static charge distribution (e.g., an atom or molecule) is dominated by the radial 1/r Coulomb potential at large distances. The second-order effect is generated by the non-central electric dipole contribution cosθ/r2. The third-order effect is attributed to the electric quadrupole potential (3cos2θ-1)/2r3. In this study, we used the tridiagonal representation approach to produce a reasonably accurate account for the combined effects of every contribution to the binding energy of the electron with an effective quadrupole interaction. As a result, we obtained the bound states of a valence electron in an atom with both electric dipole and quadrupole moments.
| Original language | English |
|---|---|
| Article number | 114058 |
| Journal | Computational and Theoretical Chemistry |
| Volume | 1222 |
| DOIs | |
| State | Published - Apr 2023 |
Bibliographical note
Publisher Copyright:© 2023 Elsevier B.V.
Keywords
- Bessel polynomial
- Electric dipole
- Electric quadrupole
- Electron binding
- Orthogonal polynomials
- Tridiagonal representations
ASJC Scopus subject areas
- Biochemistry
- Condensed Matter Physics
- Physical and Theoretical Chemistry