Publikation: Delocalized electronic states in small clusters : comparison of Nan, Cun, Agn, and Aun clusters
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1994
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Chemical Physics Letters. 1994, 227(4-5), pp. 496-502. Available under: doi: 10.1016/0009-2614(94)00836-1
Zusammenfassung
Photoelectron spectra of Nan−, Cun−, Agn−, Aun− clusters reveal the electronic structure of these particles. The experimental results are compared to the predictions of quantum chemical calculations and of the shell model. The spectra of Agn− allow for a stringent test of both approaches, because most of the observed features are assigned to s-derived orbitals and they also display much sharper features than the alkali data. A qualitative equivalence of the electronic shell model with high-level quantum chemical calculations in terms of the symmetries of the involved single particle orbitals is found for the delocalized states derived from the atomic s-electrons.
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HANDSCHUH, Haiko, Chia-Yen CHA, Heiko M. MÖLLER, Paul S. BECHTHOLD, Gerd GANTEFÖR, Wolfgang EBERHARDT, 1994. Delocalized electronic states in small clusters : comparison of Nan, Cun, Agn, and Aun clusters. In: Chemical Physics Letters. 1994, 227(4-5), pp. 496-502. Available under: doi: 10.1016/0009-2614(94)00836-1BibTex
@article{Handschuh1994Deloc-4795,
year={1994},
doi={10.1016/0009-2614(94)00836-1},
title={Delocalized electronic states in small clusters : comparison of Nan, Cun, Agn, and Aun clusters},
number={4-5},
volume={227},
journal={Chemical Physics Letters},
pages={496--502},
author={Handschuh, Haiko and Cha, Chia-Yen and Möller, Heiko M. and Bechthold, Paul S. and Ganteför, Gerd and Eberhardt, Wolfgang}
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