Dynamical effects on the photo-detachment spectra of Li 4

It is shown that the observed sharp peaks in the photodetachment spectra of Li 4 − can be understood by including the effect of cluster dynamics. Theoretical electronic structure studies show that Li 4 − is marked by doublet rhombus and quartet distorted tetrahedral isomers. By including dynamical e...

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Veröffentlicht in:Chemical physics letters 2002-01, Vol.351 (3), p.289-294
Hauptverfasser: Ashman, C, Khanna, S.N, Pederson, M.R
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Khanna, S.N
Pederson, M.R
description It is shown that the observed sharp peaks in the photodetachment spectra of Li 4 − can be understood by including the effect of cluster dynamics. Theoretical electronic structure studies show that Li 4 − is marked by doublet rhombus and quartet distorted tetrahedral isomers. By including dynamical effects within a classical picture, it is shown that the observed spectrum can be explained in terms of transitions from rhombus ground state to the singlet neutral configurations. A vibrational analysis is used to identify the modes leading to the observed peaks. Our studies underscore the importance of dynamical effects on the photodetachment spectra.
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subjects Atomic and molecular clusters
Atomic and molecular physics
Autoionization, photoionization, and photodetachment
Exact sciences and technology
Molecular properties and interactions with photons
Photon interactions with molecules
Physics
Stability and fragmentation of clusters
Studies of special atoms, molecules and their ions
clusters
title Dynamical effects on the photo-detachment spectra of Li 4
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