Abstract

In the present work, an alternative family of analytical potential energy curves (PECs) has been developed for diatomic systems. These kinds of functions, that are based on q-exponential, are used here to generalize the usual Bond Order (BO) and Rydberg analytical PECs of diatomic molecular systems. The diatomic systems H 2 + and Li 2 have been examined by means of this alternative approach. In particular, the computed vibrational spectra and spectroscopic constants were found to be in good agreement with the available experimental data.

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call

Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.