On Van Molecular Topological Modelling of Fullerenes’ Chemical Properties

In addition to graphite, diamond, and nanotubes, fullerenes are a fundamental allotrope ofcarbon that has received significant attention in the fields of nanoscience, nanotechnology, condensedmatter physics and chemistry, biological physics, materials science and technology, mechanical andelectrical sciences, biomedical engineering, and most recently, medical nanotechnology and nanoneuroscience. Molecular topological indices are essential tools to relate the theoretical and physicalproperties of chemical substances. Investigation of the chemical and physical properties of fullerenes'topological indices has been started in recent years. This study presents topological modelling offullerenes’ binding energies, the heat of formation, shape resonances, and Ramsauer-Townsend minimausing the Van molecular topological index. 

Authors

Publication Details

Journal
Van Yüzüncü Yıl University Academic Data Management System
Published
2025-09-01
DOI
https://doi.org/10.33263/lianbs143.118
Primary Topic
Graph theory and applications
Type
article
Field-Weighted Citation Impact
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article

On Van Molecular Topological Modelling of Fullerenes’ Chemical Properties

Süleyman Ediz, İdris Çiftçi, Kerem Yamaç, Mehmet Şerif Aldemir
Van Yüzüncü Yıl University Academic Data Management System
Graph theory and applications
article

On Van Molecular Topological Modelling of Fullerenes’ Chemical Properties

Süleyman Ediz, İdris Çiftçi, Kerem Yamaç, Mehmet Şerif Aldemir
article en

Abstract

In addition to graphite, diamond, and nanotubes, fullerenes are a fundamental allotrope ofcarbon that has received significant attention in the fields of nanoscience, nanotechnology, condensedmatter physics and chemistry, biological physics, materials science and technology, mechanical andelectrical sciences, biomedical engineering, and most recently, medical nanotechnology and nanoneuroscience. Molecular topological indices are essential tools to relate the theoretical and physicalproperties of chemical substances. Investigation of the chemical and physical properties of fullerenes'topological indices has been started in recent years. This study presents topological modelling offullerenes’ binding energies, the heat of formation, shape resonances, and Ramsauer-Townsend minimausing the Van molecular topological index. 

Van Yüzüncü Yıl University Academic Data Management System
Openalex Percentile: Top 15%
Graph theory and applications
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