Article ID Journal Published Year Pages File Type
5394496 Computational and Theoretical Chemistry 2012 13 Pages PDF
Abstract
► The lowest-energy structures (1a-6a) of planar BnN (n = 1-6) are obtained. ► BnN (n = 1-6) exhibit linear to polycyclic structure transition. ► BnN with n = 2 and 5 have relatively higher stability. ► The growth pattern and bonding nature of BnN (n = 1-6) are revealed. ► The thermodynamic and kinetic stability of BnN (n = 1-6) is examined.
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Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
On the structures, stabilities, and potential energy surfaces of planar BnN (n = 1-6) clusters
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