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Validation study of the ability of density functionals to predict the planar-to-three-dimensional structural transition in anionic gold clusters
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10.1063/1.3190492
/content/aip/journal/jcp/131/6/10.1063/1.3190492
http://aip.metastore.ingenta.com/content/aip/journal/jcp/131/6/10.1063/1.3190492
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Tables

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Table I.

Relative energies (eV) for various structures of .

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Table II.

Atomic excitation energies and first IP (, IP) for Au atoms (in eV) with the SDD relativistic effective core potential and the valence basis set.

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/content/aip/journal/jcp/131/6/10.1063/1.3190492
2009-08-13
2014-04-19
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Validation study of the ability of density functionals to predict the planar-to-three-dimensional structural transition in anionic gold clusters
http://aip.metastore.ingenta.com/content/aip/journal/jcp/131/6/10.1063/1.3190492
10.1063/1.3190492
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