On the calculation of lanthanide systems. The spectral parameters of praseodymium trivalent ion

In this work, taking the Pr(III) ion as a suitable case study, the authors test the capacity of a series of Gaussian Type Orbitals (GTOs) basis sets to account for the atomic spectra of lanthanide ions. An extended relevance of this assessment can be found in modeling the luminescence of lanthanide-...

Full description

Bibliographic Details
Main Authors: Ana Maria Toader, Maria Cristina Buta, Fanica Cimpoesu
Format: Article
Language:English
Published: Academy of Sciences of Moldova, Institute of Chemistry 2023-12-01
Series:Chemistry Journal of Moldova: General, Industrial and Ecological Chemistry
Subjects:
Online Access: http://cjm.ichem.md/on-the-calculation-of-lanthanide-systems-the-spectral-parameters-of-praseodymium-trivalent-ion