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Convexity deficit of benzenoids

  • Nino Bašić
  • , Sarah J. Berkemer
  • , Jörg Fallmann
  • , Patrick W. Fowler
  • , Thomas Gatter
  • , Tomaž Pisanski
  • , Nancy Retzlaff
  • , Peter F. Stadler
  • , Sara Sabrina Zemljič
  • University of Primorska
  • Institute of Mathematics, Physics and Mechanics Ljubljana
  • University of Leipzig
  • Max Planck Institute for Mathematics in the Sciences
  • The University of Sheffield
  • University of Ljubljana
  • University of Vienna
  • Universidad National de Colombia
  • Santa Fe Institute
  • Comenius University

Résultats de recherche: Contribution à un journalArticleRevue par des pairs

Résumé

In 2012, a family of benzenoids was introduced by Cruz, Gutman, and Rada, which they called convex benzenoids. In this paper we introduce the convexity deficit, a new topological index intended for benzenoids and, more generally, fusenes. This index measures by how much a given fusene departs from convexity. It is defined in terms of the boundary-edges code. In particular, convex benzenoids are exactly the benzenoids having convexity deficit equal to 0. Quasi-convex benzenoids form the family of non-convex benzenoids that are closest to convex, i.e., they have convexity deficit equal to 1. Finally, we investigate convexity deficit of several important families of benzenoids.

langue originaleAnglais
Pages (de - à)457-466
Nombre de pages10
journalCroatica Chemica Acta
Volume92
Numéro de publication4
Les DOIs
étatPublié - 1 janv. 2020
Modification externeOui

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