On Some Extended Energy of Graphs and Their Applications

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Abstract

In this paper, we dealt with extended energy of graphs namely first and second Zagreb energy, Randić energy, reciprocal Randić energy, and the atom-bond connectivity energy. We studied their relationship with some thermodynamic properties of benzenoid hydrocarbons. We have seen that these indices are well correlated to the boiling point ( BP ), Kovats retention index ( RI ), entropy ( S ), enthalpy of formation ( ΔH f ), octanol-water partition coefficient ( log P ), and acentric factor ( ω ) of benzenoid hydrocarbons. Significantly, the correlation coefficients of Randić energy with the boiling point, enthalpy of formation, Kovats retention index, octanol-water partition coefficient, and acentric factor are greater than 0.97.

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europepmc
last seen: 2026-05-20T01:45:00.602351+00:00
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License: CC-BY-4.0