Irrsrrrure o/P~~vsrcs, L@psafa (Inn emly. 9 7.51 21 Uppsala. Sweden Recewed 11 hfarch 1980. tn final form 1 AprtlL980 The CO Auser electron spectrum has been re-mvestigated by means of ab untie MO LCAO cakulatlons usmg a combmed SCT CI procedure. The CI comprises mternal and scmr-Internal contnbutto
Semi-internal correlation in the auger electron spectrum of H2O
✍ Scribed by Hans Ågren; Hans Siegbahn
- Publisher
- Elsevier Science
- Year
- 1980
- Tongue
- English
- Weight
- 474 KB
- Volume
- 69
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
The IiLL Auger electron spectrum oi the Hz0 molecule has been studed with respect to the transmons of lowest bmetic energy Calculations were performed to deduce the role of senu-mternal correlation m decidmg energies and mtensmes of the transmons. Previous studies of photoelectron specua of mner valence hole states mdxate that such effects arc of Importance for H20. The relevant loruc state m the Auger spectrum of Hz0 is the (Z~I)-~ hole state, for which final lomc sfate correlation uould be expected to be of Importance The present calculations, mcludmg a semi-internal Ct. mdlcate that this IS Indeed the cast. The smgle particle (1~)~~ -(2al)-* Auger transItIon rate IS spht among a number of double Ionic states of uhlch at least three have zgmfrcant mtenslty. Thus leads to a satisfactory account of thus prevrous-Iy unassigned energ) regron of the t120 Auger spectrum TransItron energes mvolvmg mrtral and final state shake-up, shake-off were also calculated
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