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1.
J Chem Phys ; 137(22): 224306, 2012 Dec 14.
Article in English | MEDLINE | ID: mdl-23249002

ABSTRACT

Auger decay of the C(2)H(2) double core-hole (DCH) states, including the single-site DCH (C1s(-2)), two-site DCH (C1s(-1)C1s(-1)), and satellite (C1s(-2)π(-1)π∗(+1)) states, has been investigated experimentally using synchrotron radiation combined with multi-electron coincidence method, and theoretically with the assumption of the two-step sequential model for Auger decay of the DCH states. The theoretical calculations can reproduce the experimental two-dimensional Auger spectra of the C(2)H(2) single-site DCH and satellite decays, and allow to assign the peaks appearing in the spectra in terms of sequential two-electron vacancy creations in the occupied valence orbitals. In case of the one-dimensional Auger spectrum of the C(2)H(2) two-site DCH decay, the experimental and calculated results agree well, but assignment of peaks is difficult because the first and second Auger components overlap each other. The theoretical calculations on the Auger decay of the N(2) single-site DCH state, approximately considering the effect of nuclear motion, suggest that the nuclear motion, together with the highly repulsive potential energy curves of the final states, makes an important effect on the energy distribution of the Auger electrons emitted in the second Auger decay.

2.
Phys Chem Chem Phys ; 13(41): 18355-64, 2011 Nov 07.
Article in English | MEDLINE | ID: mdl-21779590

ABSTRACT

Auger decay of an inner shell hole is an efficient way to create multiply charged ions in the gas phase. We illustrate this with the example of the argon 2s decay, and show that multi-electron coincidence spectroscopy between the 2s photoelectron and all released Auger electrons leads to a complete reconstruction of the Ar 2s decay cascade. Spectra of the intermediate and final Ar(n+) states are obtained and are compared with a theoretical model.

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