Computational Principles and Experimental Investigation of Local Non-Regular Topological Indices of TUC4C8 [p, q] and GTUC [p, q] Nanostructures

Abstract

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Any molecular or nanostructure may have its topology described by a topological index. To forecast the physical properties
linked to bioactivities and chemical reactivity in certain networks, topological indices are used in QSAR and QSPR studies. A
wide variety of physical, mechanical, and chemical properties are shown by 2D nanostructured materials. These very thin
nanoparticles exhibit anisotropy and great chemical functionality. Because of their thin profile and large surface area, 2D
materials are the best option for applications that need strong surface interactions at a microscopic scale. In this work we obtain
closed form formulas for the neighbourhood irregular topological invariants of the nanostructures TUC4C8[p, q] and GTUC[p,
q]. Following the computation of these indices, a comparison analysis is carried out.