journal article·2004-01Open access

Formation and atomic structure of B12N12nanocage clusters studied by mass spectrometry and cluster calculation

Takeo Oku, Atsushi Nishiwaki, Ichihito Narita

Abstract

Boron nitride (BN) nanocage clusters of B12N12 were synthesized, and detected by laser desorption time-of-flight mass spectrometry. The B12N12 clusters consisted of 4- and 6-membered BN rings satisfying the isolated tetragonal rule, which was optimized by molecular orbital calculations. The electronic structure showed a bandgap energy of 5.1 eV, which is a little smaller than that of B36N36 cluster.
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Research context

OpenAlex topics: Boron and Carbon Nanomaterials Research · Diamond and Carbon-based Materials Research · Fullerene Chemistry and Applications

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