Computing the Energy and Estrada Index of Different Molecular Structures

Graph energy is an invariant that is derived from the spectrum of the adjacency matrix of a graph. Graph energy is actually the absolute sum of all the eigenvalues of the adjacency matrix of a graph i.e. E=∑i=1nλi, and the Estrada index of a graph G is elaborated as EEG=∑i=1neλi, where, λ1,λ2,…,λn a...

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Main Authors: Zeeshan Saleem Mufti, Rukhshanda Anjum, Qin Xin, Fairouz Tchier, Iram Anwar-ul-Haq, Yaé Ulrich Gaba
Format: Article
Language:English
Published: Wiley 2022-01-01
Series:Journal of Chemistry
Online Access:http://dx.doi.org/10.1155/2022/6227093
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author Zeeshan Saleem Mufti
Rukhshanda Anjum
Qin Xin
Fairouz Tchier
Iram Anwar-ul-Haq
Yaé Ulrich Gaba
author_facet Zeeshan Saleem Mufti
Rukhshanda Anjum
Qin Xin
Fairouz Tchier
Iram Anwar-ul-Haq
Yaé Ulrich Gaba
author_sort Zeeshan Saleem Mufti
collection DOAJ
description Graph energy is an invariant that is derived from the spectrum of the adjacency matrix of a graph. Graph energy is actually the absolute sum of all the eigenvalues of the adjacency matrix of a graph i.e. E=∑i=1nλi, and the Estrada index of a graph G is elaborated as EEG=∑i=1neλi, where, λ1,λ2,…,λn are the eigenvalues of the adjacency matrix of a graph. In this paper, energy EG and Estrada index EEG of different molecular structures are obtained and also established inequalities among the exact and estimated values of energies and Estrada index of TUC4C8 nanosheet and naphthalene.
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institution Kabale University
issn 2090-9071
language English
publishDate 2022-01-01
publisher Wiley
record_format Article
series Journal of Chemistry
spelling doaj-art-9c5c9e63cd334053ad7f6897d7e4beb12025-02-03T05:53:08ZengWileyJournal of Chemistry2090-90712022-01-01202210.1155/2022/6227093Computing the Energy and Estrada Index of Different Molecular StructuresZeeshan Saleem Mufti0Rukhshanda Anjum1Qin Xin2Fairouz Tchier3Iram Anwar-ul-Haq4Yaé Ulrich Gaba5Department of Mathematics and StatisticsDepartment of Mathematics and StatisticsFaculty of Science and TechnologyDepartment of MathematicsDepartment of Mathematics and StatisticsQuantum Leap Africa (QLA)Graph energy is an invariant that is derived from the spectrum of the adjacency matrix of a graph. Graph energy is actually the absolute sum of all the eigenvalues of the adjacency matrix of a graph i.e. E=∑i=1nλi, and the Estrada index of a graph G is elaborated as EEG=∑i=1neλi, where, λ1,λ2,…,λn are the eigenvalues of the adjacency matrix of a graph. In this paper, energy EG and Estrada index EEG of different molecular structures are obtained and also established inequalities among the exact and estimated values of energies and Estrada index of TUC4C8 nanosheet and naphthalene.http://dx.doi.org/10.1155/2022/6227093
spellingShingle Zeeshan Saleem Mufti
Rukhshanda Anjum
Qin Xin
Fairouz Tchier
Iram Anwar-ul-Haq
Yaé Ulrich Gaba
Computing the Energy and Estrada Index of Different Molecular Structures
Journal of Chemistry
title Computing the Energy and Estrada Index of Different Molecular Structures
title_full Computing the Energy and Estrada Index of Different Molecular Structures
title_fullStr Computing the Energy and Estrada Index of Different Molecular Structures
title_full_unstemmed Computing the Energy and Estrada Index of Different Molecular Structures
title_short Computing the Energy and Estrada Index of Different Molecular Structures
title_sort computing the energy and estrada index of different molecular structures
url http://dx.doi.org/10.1155/2022/6227093
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AT fairouztchier computingtheenergyandestradaindexofdifferentmolecularstructures
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