Extreme structure and spontaneous lift of spin degeneracy in doped perforated bilayer graphenes

Extreme structure and spin states of doped and undoped perforated bigraphenes was studied using DFT simulations. It was found that folded nanopores possess extremely high curvature of 0.34 Å−1. Dramatic structural deformation causes severe changes of the chemical properties of carbon atoms localize...

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Bibliographic Details
Published in:Carbon Vol. 192. P. 61-70
Other Authors: Melchakova, Iuliia A, Tenev, T. G., Vitanov, N. V., Tchaikovskaya, Olga N., Chernozatonskii, L. A., Yakobson, B. I., Avramov, Pavel V.
Format: Article
Language:English
Subjects:
Online Access:http://vital.lib.tsu.ru/vital/access/manager/Repository/koha:000927662
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