Published October 2003
| Version v1
Journal article
Nonrelativistic variationally optimized exchange potentials for Ne-like atomic ions having large atomic number
Creators
- 1. Department of Physics, University of Antwerp, Groenenborgerlaan 171, Antwerp (Belgium)
- 2. Oxford University, Oxford (United Kingdom)
- 3. Department of Applied Mathematics, University of Western Ontario, London, Ontario (Canada)
Description
In an earlier study, the exchange energy density εx(r) has been calculated analytically for Ne-like atomic ions in the nonrelativistic limit of large atomic number Z. Here, though now by numerical methods based on the optimized exchange potential approximation, corresponding results are obtained for Vx(r) for such ten-electron ions at large Z. The approach to the bare Coulomb limiting form of the 1/Z expansion is considered in some detail, as are corrections to the Slater potential VxSl(r), given in terms of the exchange energy density and ground-state density ρ(r) by 2εx(r)/ρ(r)
Additional details
Identifiers
Publishing Information
- Journal Title
- Physical Review. A
- Journal Volume
- 68
- Journal Issue
- 4
- Journal Page Range
- p. 044502-044502.4
- ISSN
- 1050-2947
- CODEN
- PLRAAN
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 36082372
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- ATOMIC IONS; ATOMIC NUMBER; CORRECTIONS; DENSITY FUNCTIONAL METHOD; ELECTRONS; ENERGY DENSITY; GROUND STATES; MULTICHARGED IONS; OPTIMIZATION; POTENTIAL ENERGY; POTENTIALS
- Descriptors DEC
- CALCULATION METHODS; CHARGED PARTICLES; ELEMENTARY PARTICLES; ENERGY; ENERGY LEVELS; FERMIONS; IONS; LEPTONS; VARIATIONAL METHODS
Optional Information
- Notes
- (c) 2003 The American Physical Society