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Results in Physics

Information entropies for the Morse potential using the J-matrix method

Mohamed S. Abdelmonem, Afaf Abdel‐Hady, Ibraheem M. Nasser

Published Jan 1, 2017• 18 citations
Publisher

Abstract

Information entropies, such as Shannon, Fisher and Rényi entropies, with their associated quantities, are calculated and discussed for the Morse potential in the position ( r ) and momentum ( p ) spaces using the J-matrix method. The entropies, for the s-wave, are numerically obtained for the diatomic molecules H 2 and LiH. It is the first information entropy calculation for real diatomic molecules using the Morse potential. Interesting characteristic features of the entropy densities are shown, where the position and momentum space information entropies satisfy the uncertainty relations.

DOI
10.1016/j.rinp.2017.04.038

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Information entropies, such as Shannon, Fisher and Rényi entropies, with their associated quantities, are calculated and discussed for the Morse potential in the position ( r ) and momentum ( p ) spaces using the J-matrix method. The entropies, for the s-wave, are numerically obtained for the diatomic molecules H 2 and LiH. It is the first information entropy calculation for real diatomic molecules using the Morse potential. Interesting characteristic features of the entropy densities are shown, where the position and momentum space information entropies satisfy the uncertainty relations.
In this study, the Shannon entropy and the Fisher information is investigated with molecular Deng-Fan-Eckart potential for the diatomic molecules and ScF in position and momentum spaces in three dimensions for the ground and the excited states. The results were numerically obtained for diatomic molecules. Localization is observed for Shannon entropy and delocalization for Fisher information for both molecules in the position and momentum spaces. The uncertainty relations for the selected diatomic molecules were satisfied accordingly.
In this study, the information‐theoretic measures in both the position and momentum spaces for the pseudoharmonic potential using Fisher information, Shannon entropy, Renyi entropy, Tsallis entropy, and Onicescu information energy are investigated analytically and numerically. The results obtained are applied to some diatomic molecules. The Renyi and Tsallis entropies are analytically obtained in position space using Srivastava–Niukkanen linearization formula in terms of the Lauricella hypergeometric function. Also, they are obtained in the momentum space in terms of the multivariate Bell polynomials of Combinatorics. We observed that the Fisher information increases with n in both the position and momentum spaces, but decreases with for all the diatomic molecules considered. The Shannon entropy also increases with increasing n in the position space and decreases with increasing . The variations of the Renyi and Tsallis entropies with are also discussed. The exact and numerical values of the Onicescu information energy are also obtained, after which the ratio of information‐theoretic impetuses to lengths for Fisher, Shannon, and Renyi are obtained. © 2015 Wiley Periodicals, Inc.
We calculate information theoretic spreading measures of the position and momentum wave functions of the symmetric trigonometric Rose–Morse potential for the states . The position space Renyi entropy, Fisher entropy and their corresponding entropic lengths are presented analytically for . The momentum space Renyi entropy and the Renyi lengths are calculated analytically for n = 0,1 and are calculated numerically for . We also calculated the Fisher entropy and the Fisher lengths in the momentum space numerically for .
Abstract Shannon entropy for the position and momentum eigenstates of an asymmetric trigonometric Rosen–Morse potential for the ground and first excited states is evaluated. The position and momentum information entropies and are calculated numerically. Also, it is found that is obtained analytically and increases with the potential depth and width. Some interesting features of the information entropy densities and are demonstrated graphically. The Bialynicki‐Birula–Mycielski inequality is also tested and found to hold good.