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Pregled bibliografske jedinice broj: 540814

On Topological Modeling of 5/7 Structural Defects Drifting in Graphene


Ori, Ottorino; Cataldo, Franco; Graovac, Ante
On Topological Modeling of 5/7 Structural Defects Drifting in Graphene // Carbon Bonding and Structures: Advances in Physics and Chemistry / Putz, Mihai V. (ur.).
Dodrecht: Springer, 2011. str. 43-55 doi:10.1007/978-94-007-1733-6_3


Naslov
On Topological Modeling of 5/7 Structural Defects Drifting in Graphene

Autori
Ori, Ottorino ; Cataldo, Franco ; Graovac, Ante

Vrsta, podvrsta i kategorija rada
Poglavlja u knjigama, znanstveni

Knjiga
Carbon Bonding and Structures: Advances in Physics and Chemistry

Urednik/ci
Putz, Mihai V.

Izdavač
Springer

Grad
Dodrecht

Godina
2011

Raspon stranica
43-55

ISBN
978-94-007-1732-9

Ključne riječi
Graphene ; pentagon-heptagon defects ; migration of ; Wiener index

Sažetak
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.

Izvorni jezik
Engleski

Znanstvena područja
Matematika, Fizika, Kemija



POVEZANOST RADA


Projekt / tema
098-0982929-2940 - Modeliranje molekula i materijala metodama matematičke i računarske kemije (Ante Graovac, )
177-0000000-0884 - Diskretni matematički modeli u kemiji (Damir Vukičević, )
177-0982929-2940 - Modeliranje molekula i materijala metodama matematičke i računarske kemije (Ante Graovac, )

Ustanove
Institut "Ruđer Bošković", Zagreb,
Prirodoslovno-matematički fakultet, Split,
Sveučilište u Dubrovniku

Autor s matičnim brojem:
Ante Graovac, (14191)

Citati