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Effects of nuclear dynamics in the low kinetic energy Auger spectra of CO and CO2 (Articolo in rivista)

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Effects of nuclear dynamics in the low kinetic energy Auger spectra of CO and CO2 (Articolo in rivista) (literal)

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1,2V. Feyer, P. Bolognesi1, M. Coreno1,4, K.C. Prince3,4, L. Avaldi1,4, L. Storchi5, F. Tarantelli5,6 (2005)
Effects of nuclear dynamics in the low kinetic energy Auger spectra of CO and CO2
in The Journal of chemical physics; American Institute of Physics, Melville [NY] (Stati Uniti d'America)
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1,2V. Feyer, P. Bolognesi1, M. Coreno1,4, K.C. Prince3,4, L. Avaldi1,4, L. Storchi5, F. Tarantelli5,6 (literal)

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1Consiglio Nazionale delle Ricerche-Istituto di Metodologie Inorganiche e dei Plasmi (CNR-IMIP),Area della Ricerca di Roma 1, C.P. 10, 00016 Monterotondo Scalo, Italy 2Institute of Electron Physics, National Academy of Sciences, Uzhgorod, Ukraine 3Sincrotone Trieste, Area Science Park, 34012 Basovizza, Trieste, Italy 4Istituto Nazionaleper la Fisica della Materia-Tecnologie Avanzate Superfici e Catalisi (INFM-TASC),Gas Phase beamline@Elettra, Area Science Park, 34012 Basovizza, Trieste, Italy 5Dipartimento di Chimica, Universita' di Perugia, via Elce di Sotto 8, 06123 Perugia PG, Italy 6Consiglio Nazionale delle Ricerche-Istituto di Scienze e Tecnologie Molecolari (CNR-ISTM),Perugia, Italy (literal)

Titolo

Effects of nuclear dynamics in the low kinetic energy Auger spectra of CO and CO2 (literal)

Abstract

The CO and CO2 carbon and oxygen Auger spectra have been measured by electron impact and compared with accurate theoretical calculations accounting for the effects of the dynamics of the nuclei on the energy and linewidth of the Auger bands. The calculations for CO were previously published (L. S. Cederbaum et al., J. Chem. Phys. 95, 6634 (1991)), while for CO2 they are new and presented here for the first time. For both molecules, particular attention has been paid to the low-kinetic-energy region of the spectra, which corresponds to doubly charged ion states with the two holes mainly localized in the inner valence region. New bands have been observed. It is shown that a proper consideration of the vibrational broadening and shift of the bands due to the dynamics of the nuclei is needed to assign these features. For CO, very large energy shifts between corresponding features in the C 1s and O 1s spectra have been observed, confirming the theoretical predictions of 1991. The new computed spectra of CO2 allow a very accurate analysis of the experiments over the whole energy range. (literal)

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