On Topological Modeling of 5/7 Structural Defects Drifting in Graphene (CROSBI ID 44344)
Prilog u knjizi | izvorni znanstveni rad
Podaci o odgovornosti
Ori, Ottorino ; Cataldo, Franco ; Graovac, Ante
engleski
On Topological Modeling of 5/7 Structural Defects Drifting in Graphene
Rearrangements of graphene layer under iterated Stone-Wales transformations are studied from a pure topological point of view. The analysis provides indications about relative chemical stabilities of different isomeric distributions of pentagon-heptagon pairs, i.e. of the 5/7 structural defects, migrating in graphene layer. Our computations are performed in dual topological space with the Wiener index being taken as a topological potential of the system that rules migration of defects in graphene layer.
graphene ; pentagon-heptagon defects ; migration of ; Wiener index
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Podaci o prilogu
43-55.
objavljeno
10.1007/978-94-007-1733-6_3
Podaci o knjizi
Carbon Bonding and Structures: Advances in Physics and Chemistry
Putz, Mihai V.
Dordrecht: Springer
2011.
978-94-007-1732-9