期刊
DALTON TRANSACTIONS
卷 -, 期 44, 页码 6083-6088出版社
ROYAL SOC CHEMISTRY
DOI: 10.1039/b803958e
关键词
-
资金
- National Science Foundation [CHE-0716718]
- CEEX-MOLMOD, Romania
The jellium sphere model of a volume of electrons, counterbalanced by a positive charge throughout the sphere, leads to an energy level sequence corresponding to special stabilities of bare post-transition element clusters with 20 valence electrons such as the known P-4 and clusters with 40 valence electrons such as the known Ge-9(4-), Ni@In-10(10-), and In-11(7-). In this model the otherwise external lone pairs on the vertex atoms participate at least indirectly in the skeletal bonding. Furthermore, this model predicts the most favorable polyhedra and electron counts in some cases to be quite different than those predicted by the Wade-Mingos rules of polyhedral borane chemistry.
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