Photodissociation Spectrum Of

Nahvi, Nima-Noah

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https://hdl.handle.net/2142/116624 Copy

Description

Title

Photodissociation Spectrum Of

Author(s)

Nahvi, Nima-Noah

Contributor(s)

• Dopfer, Otto
• Studemund, Taarna
• Pollow, Kai
• Förstel, Marko

Issue Date

2022-06-21

Keyword(s)

Photodissociation and photochemistry

Abstract

\begin{wrapfigure}{r}{0pt} \includegraphics[scale=0.66]{abstract_fig.eps} \caption{Electronic spectrum of \ce{Au2+N2}.} \end{wrapfigure} The binding motif of nitrogen on transition metals is an interesting issue. Here we present the electronic spectrum of the $\tilde{A}^2\Sigma^+ \rightarrow \tilde{X}^2\Sigma^+$ transition of \ce{Au2+N2}, which was measured via photodissociation spectroscopy. The spectrum contains a long progression, caused by symmectric and asymmetric strech vibrations. We extract harmonic frequencies, anharmonicities and cross-anharmonicities of the excited state via a Dunham expansion and harmonic frequencies of the ground state via Franck-Condon simulations. In comparison to density functional theory calculations, the observed frequencies agree well with the theory. We also discuss the binding motif of \ce{Au2+N2} in the ground and excited state. \begin{itemize} \item[{[1]}] M. Förstel, K. Pollow, T. Studemund, O. Dopfer, Chem. Eur. J. 2021, 27, 15075-15080. \item[{[2]}] M. Förstel, K. M. Pollow, K. Saroukh, E. A. Najib, R. Mitric, O. Dopfer, Angew. Chem. Int. Ed. 2020, 123, 21587-21592. \end{itemize}

Publisher

International Symposium on Molecular Spectroscopy

Type of Resource

text

Language

eng

Handle URL

https://hdl.handle.net/2142/116624

DOI

https://doi.org/10.15278/isms.2022.TJ02

Copyright and License Information

Copyright 2022 held by the authors

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