Molecular Characterization of Three Classes of Bow-Tie-Shaped Graphene Nanoflakes by Polynomials as Alternative for Their Computed Energies and Spectral Patterns

Graphene has been recognized as one of the most promising materials for nanoelectronics in recent decades. Despite its excellent mechanical and electrical characteristics, its use in the fabrication of genuine nanoelectronic devices is frequently fraught with challenges. A graphene nanoflake is graphene with a finite size. It can be prepared in a bottom-up or top-down manner. While it has qualities similar to those of graphene, it may be manufactured in a variety of sizes and shapes. A topological index is a numerical value that shows some valuable information about molecular structure, shape, and investigation. It refers to a molecular graph's numerical invariants, which can correlate bioactivity and physio-chemical properties. Researchers have discovered topological indices to be an effective and valuable tool in describing molecular structure throughout time. In this study, we compute such topological indices of bow-tie-shaped graphene nanoflakes.

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Publication Details

Journal
ACS Omega
Published
2025-08-22
DOI
https://doi.org/10.1021/acsomega.5c05517
Citations
3
Primary Topic
Graphene research and applications
Type
article
Field-Weighted Citation Impact
1.55

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article

Molecular Characterization of Three Classes of Bow-Tie-Shaped Graphene Nanoflakes by Polynomials as Alternative for Their Computed Energies and Spectral Patterns

Lorentz Jäntschi, S. Prabhu, R.L. Madhusudhan, V Manimozhi et al.
3 citations
ACS Omega
Graphene research and applications
1.55
article

Molecular Characterization of Three Classes of Bow-Tie-Shaped Graphene Nanoflakes by Polynomials as Alternative for Their Computed Energies and Spectral Patterns

Lorentz Jäntschi, S. Prabhu, R.L. Madhusudhan, V Manimozhi, M. Arulperumjothi
article en
3 citations

Abstract

Graphene has been recognized as one of the most promising materials for nanoelectronics in recent decades. Despite its excellent mechanical and electrical characteristics, its use in the fabrication of genuine nanoelectronic devices is frequently fraught with challenges. A graphene nanoflake is graphene with a finite size. It can be prepared in a bottom-up or top-down manner. While it has qualities similar to those of graphene, it may be manufactured in a variety of sizes and shapes. A topological index is a numerical value that shows some valuable information about molecular structure, shape, and investigation. It refers to a molecular graph's numerical invariants, which can correlate bioactivity and physio-chemical properties. Researchers have discovered topological indices to be an effective and valuable tool in describing molecular structure throughout time. In this study, we compute such topological indices of bow-tie-shaped graphene nanoflakes.

ACS OmegaVol. 10(35)
Technical University of Cluj-Napoca (RO), Sri Venkateswara University (IN), Saint Joseph's College (US), St. Joseph's Institute of Technology (IN), St. Joseph’s College of Engineering (IN), Rajalakshmi Engineering College, Toronto Metropolitan University (CA)
Universitatea Tehnică din Cluj-Napoca
Affordable and clean energy
Openalex Percentile: Top 16%
Graphene research and applications
1.55
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