Publikation: Electronic shells or molecular orbitals : photoelectron spectra of Agn- clusters
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1995
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Journal of Chemical Physics. 1995, 102(16), pp. 6406-6422. Available under: doi: 10.1063/1.469356
Zusammenfassung
Photoelectron spectra of Ag - n clusters with n=1–21 recorded at different photon energies (hnu=4.025, 4.66, 5.0, and 6.424 eV) are presented. Various features in the spectra of Ag - 2–Ag - 9 can be assigned to electronic transitions predicted from quantum chemical ab initio calculations. While this comparison with the quantum chemical calculations yields a detailed and quantitative understanding of the electronic structure of each individual cluster, a discussion in terms of the shell model is able to explain trends and dominant patterns in the entire series of spectra up to Ag - 21.
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Fachgebiet (DDC)
530 Physik
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Photoelectron spectroscopy, silver ions, ion pairs, energy range, electronic strucure, shell models, ab initio calculations
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HANDSCHUH, Haiko, Chia-Yen CHA, Paul S. BECHTHOLD, Gerd GANTEFÖR, Wolfgang EBERHARDT, 1995. Electronic shells or molecular orbitals : photoelectron spectra of Agn- clusters. In: Journal of Chemical Physics. 1995, 102(16), pp. 6406-6422. Available under: doi: 10.1063/1.469356BibTex
@article{Handschuh1995Elect-9497,
year={1995},
doi={10.1063/1.469356},
title={Electronic shells or molecular orbitals : photoelectron spectra of Agn- clusters},
number={16},
volume={102},
journal={Journal of Chemical Physics},
pages={6406--6422},
author={Handschuh, Haiko and Cha, Chia-Yen and Bechthold, Paul S. and Ganteför, Gerd and Eberhardt, Wolfgang}
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<dcterms:abstract xml:lang="eng">Photoelectron spectra of Ag<sup> - </sup><sub>n</sub> clusters with n=1–21 recorded at different photon energies (hnu=4.025, 4.66, 5.0, and 6.424 eV) are presented. Various features in the spectra of Ag<sup> - </sup><sub>2</sub>–Ag<sup> - </sup><sub>9</sub> can be assigned to electronic transitions predicted from quantum chemical ab initio calculations. While this comparison with the quantum chemical calculations yields a detailed and quantitative understanding of the electronic structure of each individual cluster, a discussion in terms of the shell model is able to explain trends and dominant patterns in the entire series of spectra up to Ag<sup> - </sup><sub>21</sub>.</dcterms:abstract>
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