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arXiv:2001.08429 · Canadian Journal of Physics

Statistical analysis and information theory of screened Kratzer–Hellmann potential model

G.T. Osobonye, U. S. Okorie, P. O. Amadi, A.N. Ikot

Published Feb 12, 2021• 11 citations
arXivHTMLPDF

Abstract

In this research, the radial Schrödinger equation for a newly proposed screened Kratzer–Hellmann potential model was studied via the conventional Nikiforov–Uvarov method. The approximate bound state solution of the Schrödinger equation was obtained using the Greene–Aldrich approximation in addition to the normalized eigenfunction for the new potential model, both analytically and numerically. These results were employed to evaluate the rotational–vibrational partition function and other thermodynamic properties for the screened Kratzer–Hellmann potential. The results obtained have been graphically discussed. Also, the normalized eigenfunction has been used to calculate some information-theoretic measures including Shannon entropy and Fisher information for low-lying states in both position and momentum spaces numerically. The Shannon entropy results obtained agreed with the Bialynicki-Birula and Mycielski inequality, while the Fisher information results obtained agreed with the Stam, Cramér–Rao inequality. Also, alternating increasing and decreasing localization across the screening parameter for both eigenstates was observed.

DOI
10.1139/cjp-2020-0041

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In this work, we proposed a screened modified Krazer potential and use the newly proposed Nikiforov-Uvarov-Functional Analysis (NUFA) method to obtain the energy spectrum and the corresponding wave function. With the obtained energy spectrum, we studied the numerical results for some selected diatomic molecules and our results are in good agreement with other analytical method. We also evaluated the vibrational partition function for , and diatomic molecules via the Euler–Maclaurin approach and other thermodynamic functions such as free energy, entropy, mean energy and specific heat Capacity. The expectations values of and are also calculated numerically for different diatomic molecules using the normalized wave function for the two low lying states corresponding to the ground and first excited states. Our numerical results for the selected diatomic molecules validate the Heisenberg uncertainty relation, .