Electronic structure and effectively unpaired electron density topology in closo -Boranes: Nonclassical three-center two-electron bonding

This article provides a detailed study of the structure and bonding in closo-borane cluster compounds X 2 B 3 H 3 (X = BH - , P, SiH, CH, N), with particular emphasis on the description of the electron distribution using the topology of the quantum many-body effectively unpaired density. The close r...

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Autores principales: Lobayan, R.M., Bochicchio, R.C., Torre, A., Lain, L.
Formato: JOUR
Acceso en línea:http://hdl.handle.net/20.500.12110/paper_15499618_v7_n4_p979_Lobayan
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