Configuration mixing in the s-hole states of metal ions

Chandra Singh, U. ; Sarma, D. D. ; Rao, C. N. R. (1982) Configuration mixing in the s-hole states of metal ions Chemical Physics Letters, 85 (3). pp. 278-282. ISSN 0009-2614

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Official URL: http://linkinghub.elsevier.com/retrieve/pii/000926...

Related URL: http://dx.doi.org/10.1016/0009-2614(82)80293-5

Abstract

Configuration interaction calculation have been carried out on the s-hole states of Mn2+ Fe2+ (both high- and low-spin configurations). Co2+, Ca2+, K+ and Na+ including configurations involving virtual orbitals. The results show good agreement with the multiplet structures found in X-ray photoelectron spectra of these ions.

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Deposited On:02 Jun 2011 12:59
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