Publikation: Photoelectron spectra and geometric structures of small Niobium cluster anions
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1996
Autor:innen
Kietzmann, Hardy
Morenzin, Jan
Bechthold, Paul S.
Eberhardt, Wolfgang
Yang, Dong-Sheng
Hackett, Peter A.
Fournier, René
Pang, Tao
Chen, Changfeng
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Physical Review Letters. 1996, 77(22), pp. 4528-4531. Available under: doi: 10.1103/PhysRevLett.77.4528
Zusammenfassung
Photoelectron spectroscopy measurements and density functional theory calculations are combined to determine structures of Nbn- (n = 3 8) clusters. A detailed comparison between observed and calculated electronic binding energies shows that the clusters have low-symmetry compact 3D structures and the lowest possible total spin, except for the three- and five-atom clusters which are in triplet states. We find evidence for the coexistence of two isomers of Nb8- under some experimental conditions. This approach shows great promise for structural characterization of small clusters.
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KIETZMANN, Hardy, Jan MORENZIN, Paul S. BECHTHOLD, Gerd GANTEFÖR, Wolfgang EBERHARDT, Dong-Sheng YANG, Peter A. HACKETT, René FOURNIER, Tao PANG, Changfeng CHEN, 1996. Photoelectron spectra and geometric structures of small Niobium cluster anions. In: Physical Review Letters. 1996, 77(22), pp. 4528-4531. Available under: doi: 10.1103/PhysRevLett.77.4528BibTex
@article{Kietzmann1996Photo-9137,
year={1996},
doi={10.1103/PhysRevLett.77.4528},
title={Photoelectron spectra and geometric structures of small Niobium cluster anions},
number={22},
volume={77},
journal={Physical Review Letters},
pages={4528--4531},
author={Kietzmann, Hardy and Morenzin, Jan and Bechthold, Paul S. and Ganteför, Gerd and Eberhardt, Wolfgang and Yang, Dong-Sheng and Hackett, Peter A. and Fournier, René and Pang, Tao and Chen, Changfeng}
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<dcterms:abstract xml:lang="eng">Photoelectron spectroscopy measurements and density functional theory calculations are combined to determine structures of Nbn- (n = 3 8) clusters. A detailed comparison between observed and calculated electronic binding energies shows that the clusters have low-symmetry compact 3D structures and the lowest possible total spin, except for the three- and five-atom clusters which are in triplet states. We find evidence for the coexistence of two isomers of Nb8- under some experimental conditions. This approach shows great promise for structural characterization of small clusters.</dcterms:abstract>
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