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-...
Main Authors: | , , |
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Format: | Article |
Language: | English |
Published: |
Academy of Sciences of Moldova, Institute of Chemistry
2023-12-01
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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
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