Published January 11, 2006
| Version v1
Journal article
Self-consistent iterative solution of exchange-only optimized effective potential equations for simple metal clusters in the jellium model
Creators
- 1. Centre for Theoretical Physics and Mathematics, Atomic Energy Organization of Iran, PO Box 11365-8486, Tehran (Iran, Islamic Republic of)
- 2. Physics Department, Islamic Azad University, Branch of Sciences and Research, Tehran (Iran, Islamic Republic of)
Description
In this work, employing the exchange-only orbital-dependent functional, we have obtained an optimized effective potential using the simple iterative method proposed by Kuemmel and Perdew (2003 Phys. Rev. Lett. 90 43004). Using this method, we have solved the self-consistent Kohn-Sham equations for closed-shell simple metal clusters of Al, Li, Na, K, and Cs in the context of the jellium model. The results are in good agreement with those obtained by a different method by Engel and Vosko (1994 Phys. Rev. B 50 10498)
Availability note (English)
Available online at http://stacks.iop.org/0953-8984/18/75/cm6_1_005.pdf or at the Web site for the Journal of Physics. Condensed Matter (ISSN 1361-648X) http://www.iop.org/Additional details
Identifiers
- URL
- http://stacks.iop.org/0953-8984/18/75/cm6_1_005.pdf;
- DOI
- 10.1088/0953-8984/18/1/005;
- PII
- S0953-8984(06)08824-2;
Publishing Information
- Journal Title
- Journal of Physics. Condensed Matter
- Journal Volume
- 18
- Journal Issue
- 1
- Journal Page Range
- p. 75-85
- ISSN
- 0953-8984
- CODEN
- JCOMEL
INIS
- Country of Publication
- United Kingdom
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 37059183
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- ALUMINIUM; CESIUM; ITERATIVE METHODS; LITHIUM; MATHEMATICAL SOLUTIONS; POTENTIALS; SODIUM
- Descriptors DEC
- ALKALI METALS; CALCULATION METHODS; ELEMENTS; METALS