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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 119, 2021 - Issue 23
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Molecular Physics

Energy spectra and expectation values of selected diatomic molecules through the solutions of Klein–Gordon equation with Eckart–Hellmann potential model

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Article: e1956615 | Received 21 May 2021, Accepted 13 Jul 2021, Published online: 26 Jul 2021
 

Abstract

We solved the Klein–Gordon equation using the Nikiforov–Uvarov (NU) method with Eckart–Hellmann potential (EHP) model with approximation to the centrifugal term. The analytical expression of the ro-vibrational energy spectra in relativistic, non-relativistic and the corresponding normalised wavefunction were obtained. The numerical bound states energy for various screening parameters at different quantum states and ro-vibrational energies of EHP for VH, TiH, NiC, TiC and CuLi diatomicmolecules were computed. We have also obtained the expectation values of r2, T and P2 using Hellmann–Feynman theorem for the selected diatomic molecules. Graphically, we have illustrated the variation of ro-vibrational energies and expectation values of r2, T and P2. Four special cases of EHP where obtained and the results were in excellent agreements with the existing literature.

GRAPHICAL ABSTRACT

Disclosure statement

No potential conflict of interest was reported by the author(s).

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