التفاصيل البيبلوغرافية
| العنوان: |
Analytical Expressions and Structural Characterization of Some Molecular Models Through Degree Based Topological Indices. |
| المؤلفون: |
Ismael, Mimoon, Zaman, Shahid, Elahi, Kashif, Koam, Ali N. A., Bashir, Ansa |
| المصدر: |
Mathematical Modelling of Engineering Problems; Jan2024, Vol. 11 Issue 1, p47-62, 16p |
| مصطلحات موضوعية: |
MOLECULAR connectivity index, TOPOLOGICAL degree, MOLECULAR models, MOLECULAR structure, MATERIALS science |
| مستخلص: |
This article explores a practical applications of chemical graph theory in the field of physical chemistry. Chemical graph theory is a branch of mathematics that uses mathematical techniques to correlate the structural characteristics of molecules. By applying these methods, scientists can better understand how different molecules behave and interact in the world of chemistry. Topological indices, which are two/three-dimensional descriptors of the internal atomic organization of compounds, provide valuable information about the size, shape, branching, presence of heteroatoms, and number of bonds in a given molecular structure. This article highlights the importance of topological indices in understanding the physical properties and behavior of molecules, and how they can be used in various applications such as drug design, material science, and catalysis. In this article, we computed irregularity topological indices for the Oxide network (𝑂𝑋𝑛), Silicate network (𝑆𝐿𝑛), Chain silicate (𝐶𝑆𝑛), and honeycomb network (𝐻𝐶𝑛). The 3D comparison graphs are also investigated. The article concludes with a discussion of the challenges and future directions in the field of chemical graph theory. [ABSTRACT FROM AUTHOR] |
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| قاعدة البيانات: |
Complementary Index |
