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Chemical Peeling and Branching of Boron Nitride Nanotubes in Dimethyl Sulfoxide

✍ Scribed by Qing Huang; Yoshio Bando; Chunyi Zhi; Dmitri Golberg; Keiji Kurashima; Fangfang Xu; Lian Gao


Publisher
John Wiley and Sons
Year
2006
Tongue
English
Weight
281 KB
Volume
45
Category
Article
ISSN
0044-8249

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Hydrogen-saturated cut-outs of hexagonal boron nitride have been used to model the solid state. Model compounds have been geometry optimized by means of density functional theory, whereas chemical shift calculations have been carried out at the coupled-perturbed Hartree᎐Fock level Ž . of theory empl