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Computing The Energy of Certain Graphs based on Vertex Status.
Asim Khurshid1, Muhammad Salman1
1Department of Mathematics, The Islamia University of Bahawalpur, Bahawalpur 63100, Pakistan.
Current Organic Synthesis
|August 15, 2023
Summary
This study introduces a new method to calculate graph energy using vertex status, extending Hückel molecular orbital theory. The research explores graph energy for various graph families, offering numerical and graphical comparisons.
Area of Science:
- Graph theory
- Mathematical chemistry
- Quantum chemistry
Background:
- Hückel molecular orbital theory provides a framework for computing graph energy.
- Vertex status is a key factor in determining graph energy.
- Existing methods for graph energy calculation can be enhanced.
Purpose of the Study:
- To explore graph energy using a novel approach based on vertex status.
- To investigate the status adjacency matrix and its Laplacian version.
- To analyze graph energy for diverse graph families.
Main Methods:
- Eigenvalue computation of adjacency and Laplacian matrices.
- Matrices are constructed based on vertex status.
- Numerical and graphical analysis of results.
Main Results:
- Exact status sum and Laplacian status sum energies were determined for complete graphs, complete bipartite graphs, star graphs, bistar graphs, barbell graphs, and thorny graphs.
- Numerical and graphical comparisons of calculated energies were performed.
Conclusions:
- Introduced the status sum adjacency matrix and its Laplacian version.
- Extended the study of graph spectrum and energy.
- Visualized and investigated these new concepts for various graph types.
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