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Phys. Rev. A 57, 3458 - 3461 (1998)

Total electron density from the s-electron density

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Á. Nagy and E. Bene
Institute of Theoretical Physics, Kossuth Lajos University, H–4010 Debrecen, Hungary

Received 14 July 1997; revised 30 October 1997

Based on a theorem of Theophilou [Philos. Mag. B 69, 771 (1994)], the total electron density in a central field atom is determined from the Kohn-Sham s-electron density. Exchange-only density-functional calculations for atoms are presented.


©1998 The American Physical Society

URL: http://link.aps.org/doi/10.1103/PhysRevA.57.3458
DOI: 10.1103/PhysRevA.57.3458
PACS: 31.15.-p

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