On some counting polynomials and energy properties of superphenalene and supertriphenylene

In order to generate a wide range of meaningful topological indices, counting polynomials can be utilised in a number of different ways, including explicitly, after calculating derivatives. Certain polynomials, particularly Theta, Omega, Padmakar-Ivan, and Sadhana polynomials, are subservient to the equidistant and non-equidistant edges of graphs. Such polynomials have a wide range of applications, including the computation of the topological indices that correspond to them. Counting polynomials and corresponding indices in the context of super-polycyclic aromatic compounds with hexabenzocoronene as a base molecule, including superphenalene and supertriphenylene, refer to mathematical representations that encode structural information about the molecules. In addition, we have been able to acquire the spectral and energetic characteristics of these structures, which include the HOMO-LUMO gaps, bond delocalisation energies, and 13C NMR patterns.

Authors

Institutions

Publication Details

Journal
Scientific Reports
Published
2025-04-09
DOI
https://doi.org/10.1038/s41598-025-86329-9
Citations
1
Primary Topic
Graph theory and applications
Type
article
Field-Weighted Citation Impact
4.09
Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

On some counting polynomials and energy properties of superphenalene and supertriphenylene

S. Prabhu, M. Arulperumjothi, Muhammad Imran, Visalakshi Subramanian
1 citations
Scientific Reports
Graph theory and applications
4.09
article

On some counting polynomials and energy properties of superphenalene and supertriphenylene

S. Prabhu, M. Arulperumjothi, Muhammad Imran, Visalakshi Subramanian
article en
1 citations

Abstract

In order to generate a wide range of meaningful topological indices, counting polynomials can be utilised in a number of different ways, including explicitly, after calculating derivatives. Certain polynomials, particularly Theta, Omega, Padmakar-Ivan, and Sadhana polynomials, are subservient to the equidistant and non-equidistant edges of graphs. Such polynomials have a wide range of applications, including the computation of the topological indices that correspond to them. Counting polynomials and corresponding indices in the context of super-polycyclic aromatic compounds with hexabenzocoronene as a base molecule, including superphenalene and supertriphenylene, refer to mathematical representations that encode structural information about the molecules. In addition, we have been able to acquire the spectral and energetic characteristics of these structures, which include the HOMO-LUMO gaps, bond delocalisation energies, and 13C NMR patterns.

Scientific ReportsVol. 15(1)
Prince Mohammad bin Fahd University (SA), Sri Venkateswara University (IN), Rajalakshmi Engineering College
Affordable and clean energy
Openalex Percentile: Top 11%
Graph theory and applications
4.09
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.