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Information Entropy of Molecular Structure Modification

Anatoly V. Stepanov1 , Maxim A. Stepanov2

1 Belarusian State University, National Ozone Monitoring Research and Educational Centre, 7-816 Kurchatov Street, 220045 Minsk, Republic of Belarus
2 Belarusian National Technical University, Department of Technical Physics, Information Technologies and Robotics Faculty,
B. Khmelnitsky str. 9, Building 11, 220013 Minsk, Republic of Belarus

Calculation of information entropy for molecular structure modification has been made in [1, 2]. First article has been dedicated a high-temperature modification (Arrhenius dependence), second – molecular tunneling (low-temperature plateau). For both modifications probabilities of occurrence of the reactions under considerations, their efficiency and mean-square fluctuations of the distribution function parameters have been determined. Thus, a development of Perrin’s radiation hypothesis gives us a new picture of the elementary activation act for unimolecular chemical reaction.

 

[1] Stepanov A.V., Int. J. Mod. Phys. B, 29 (2015) 1550016-1-18.
[2] Stepanov A.V. & Stepanov M.A., Proceedings, 2 (2018) 151-162.