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Core hole screening and decay rates of double core ionized first row hydrides
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10.1063/1.4801660
/content/aip/journal/jcp/138/16/10.1063/1.4801660
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/16/10.1063/1.4801660

Figures

Image of FIG. 1.
FIG. 1.

(a)–(c) Decay rate per core hole as a function of the number of valence electron pairs n val(n val − 1)/2 on the atom at which the core hole is located, estimated from the respective core ionized state wave function via (a) Mulliken and (b) Löwdin population analysis, as well as via (c) the integrated electron density within a sphere of radius r = 1.9a 0) around the core hole. (d) Decay rate per core hole and per valence electron pair, where the number of valence electrons n val was estimated as in Fig. 1(c). For all different methods for estimating n val the decay rate ΓK and ΓKK is roughly proportional to n val(n val − 1)/2.

Tables

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Table I.

Calculated K-LL Auger decay rates Γ K in 10−3 a.u. a compared with literature values.

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Table II.

Calculated KK-KLL Auger decay rates Γ KK in 10−3 a.u. for neon compared with previous calculations.

Generic image for table
Table III.

Auger decay rates in 10−3 a.u. for single core ionized (Γ K ) and double core ionized (Γ KK ) molecules.

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/content/aip/journal/jcp/138/16/10.1063/1.4801660
2013-04-22
2014-04-21
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Core hole screening and decay rates of double core ionized first row hydrides
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/16/10.1063/1.4801660
10.1063/1.4801660
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