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A close-up to the bond-breaking and bond-forming using information theory

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Abstract

In this work, we analyzed the chemical reaction, \(\textrm{CH}_{4} + \textrm{H}^- \longrightarrow \textrm{CH}_{4} + \textrm{H}^{-}\), using the concept of information channel, which consists in to quantify the amount of information that the system can transfer and receive, to carry out such measures, we used Shannon’s entropy defined in position and momentum spaces, the interpretation of the results obtained was also completed by the analysis of Fisher’s entropy in position and momentum spaces; our results, permitted to analyze with certain detail how are carried out the process of bond-forming and bond-breaking of the reaction \(\textrm{CH}_{4} + \textrm{H}^-\).

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Acknowledgements

The author wishes to thank the CONACyT, the PRODEP-SEP program for support.

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  1. Centro Universitario de los Valles, Universidad de Guadalajara, Carretera Guadalajara - Ameca Km. 45.5, C.P. 46600, Ameca, Jalisco, Mexico

    N. Flores-Gallegos

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Flores-Gallegos, N. A close-up to the bond-breaking and bond-forming using information theory. J Math Chem 61, 723–735 (2023). https://doi.org/10.1007/s10910-022-01436-6

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