Ro-Vibrational and Pure Vibrational Partition Functions and Thermodynamic Properties in an Eckart-like Potential Model
Clement Atachegbe Onate, Matthew Olanrewaju Oluwayemi, Olumide Oyewale AjaniThis study obtained the energy levels and examined the partition function (Z) of a quantum system described by an Eckart-like potential model. By adopting the Greene–Aldrich approximation scheme for the centrifugal term, the radial Schrödinger equation (SE) is solved and the analytic expression of the energy eigenvalues is obtained. The ro-vibrational Z is computed by explicitly incorporating the rotational quantum number, a feature often neglected or misapplied in many studies. This result is used to evaluate the key thermodynamic properties (TP), including the Gibbs free energy (G), entropy (S), and enthalpy (H). Numerical analysis reveals that the Z increases monotonically with temperature, while the G decreases in accordance with statistical thermodynamics. The S exhibits saturation-like behaviour at higher temperatures, while the H displays convex growth with increasing thermal energy. Parametric studies demonstrate that the Eckart-like potential allows for the controlled tuning of TP, with variations in the potential parameters, including the screening parameter, having distinct effects. The results generalise existing models, reproduce the Hulthén potential under specific conditions, show the effect of the rotational quantum number of TP, and provide new insights into the ro-vibrational statistical mechanics of exponential-type potentials.