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cond-mat.mes-hall2023
Energy barriers of Be and B in passing through the C60 fullerene cage
A. V. Bibikov, A. V. Nikolaev, P. V. Borisyuk +1
We have studied the potential barriers for the penetration of atomic beryllium or boron inside the C60 fullerene by performing ab initio density functional theory (DFT) calculation…
cond-mat.mes-hall2008★ 9 cited
Electronic and transport properties of rectangular graphene macromolecules and zigzag carbon nanotubes of finite length
A. V. Nikolaev, A. V. Bibikov, A. V. Avdeenkov +2
We study one dimensional (1D) carbon ribbons with the armchair edges and the zigzag carbon nanotubes and their counterparts with finite length (0D) in the framework of the Hückel m…