Using time-of-flight multiple electron and ion coincidence techniques in combination with a helium gas discharge lamp and synchrotron radiation, the double ionisation spectrum of disulfur (S-2) and the subsequent fragmentation dynamics of its dication are investigated. The S-2 sample was produced by heating mercury sulfide (HgS), whose vapour at a suitably chosen temperature consists primarily of two constituents: S-2 and atomic Hg. A multi-particle-coincidence technique is thus particularly useful for retrieving spectra of S-2 from ionisation of the mixed vapour. The results obtained are compared with detailed calculations of the electronic structure and potential energy curves of S-2(2+) which are also presented. These computations are carried out using configuration interaction methodology. The experimental results are interpreted with and strongly supported by the computational results.
An experimental and theoretical characterization of the electronic structure of doubly ionised disulfur / Olsson, Emelie; Ayari, Tarek; Ideböhn, Veronica; Wallner, Måns; Squibb, Richard J; Andersson, Jonas; Roos, Andreas Hult; Stranges, Stefano; Dyke, John M; Eland, John H D; Hochlaf, Majdi; Feifel, Raimund. - In: SCIENTIFIC REPORTS. - ISSN 2045-2322. - 12:12(2022). [10.1038/s41598-022-16327-8]
An experimental and theoretical characterization of the electronic structure of doubly ionised disulfur
Stranges, StefanoMembro del Collaboration Group
;
2022
Abstract
Using time-of-flight multiple electron and ion coincidence techniques in combination with a helium gas discharge lamp and synchrotron radiation, the double ionisation spectrum of disulfur (S-2) and the subsequent fragmentation dynamics of its dication are investigated. The S-2 sample was produced by heating mercury sulfide (HgS), whose vapour at a suitably chosen temperature consists primarily of two constituents: S-2 and atomic Hg. A multi-particle-coincidence technique is thus particularly useful for retrieving spectra of S-2 from ionisation of the mixed vapour. The results obtained are compared with detailed calculations of the electronic structure and potential energy curves of S-2(2+) which are also presented. These computations are carried out using configuration interaction methodology. The experimental results are interpreted with and strongly supported by the computational results.I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.