Abstract

In recent years, the study of topological indices associated to different molecular tubes and structures gained a lot of attention of the researchers—working in Chemistry and Mathematics. These descriptors play an important role in describing different properties associated to the objects of study. Moreover, Shannon’s entropy concept—a slightly different but more effective approach—provides structural information related to the molecular graphs. In this article, we have computed and analyzed different entropy measures associated to different crystallographic structures. In particular, we have worked on the Zagreb entropies, hyper and augmented Zagreb entropies, and forgotten and Balaban entropies for the crystallographic structures of the cuprite Cu 2 O and titanium difluoride TiF 2 .

Highlights

  • Introduction e role ofGraph eory has been significantly improvised as applications in other areas of sciences, in the direction of Chemical Graph eory

  • Concoction graph hypothesis is a part of numerical science wherein devices of graph hypothesis are applied to demonstrate the compound wonder scientifically

  • Comparisons and Discussion for Cu2O[m, n, t] We develop Tables 5 and 6 for tiny estimations of m, n, t for the structure of Cu2O[m, n, t]. e graphical portrayals of registered outcomes area unit are described in Figures 4–6 for specific estimations of m, n, t

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Summary

Introduction

Introduction e role ofGraph eory has been significantly improvised as applications in other areas of sciences, in the direction of Chemical Graph eory. E study of topological indices plays an important role in identifying many physical and chemical properties of the molecular structures of study. In recent time, another approach which is a bit different—but more effective—has been introduced in the literature, namely, using the concept of Shannon’s entropy [1, 2]. Concoction graph hypothesis is a part of numerical science wherein devices of graph hypothesis are applied to demonstrate the compound wonder scientifically. It has been identified with the insignificant uses of graph postulate for subatomic disputes

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