Skip to main content
Article
Electric-dipole 4fn–4fn transition intensity parametrizations for lanthanides: sensitivity analysis of multiple local minima
Journal of Alloys and Compounds (2002)
  • Gary W Burdick, Andrews University
  • E. S. LaBianca, Andrews University
  • D. L. Binus, Andrews University
Abstract

Parametrizations of one-photon electric-dipole transitions between crystal-field levels of the 4fn configuration of lanthanide ions often result in multiple local minima that fit the data nearly equally well. This is especially true for structurally complex systems containing lanthanide ions, such as the oxydiacetate single crystals Na3[Ln(oda)3]·2NaClO4·6H2O (commonly abbreviated as LnODA). Through a detailed reexamination of the previously well-studied EuODA system, we investigate the seriousness of the multiple local minima problem. Parameter robustness is determined by means of an analysis of the sensitivity of the local minima with respect to perturbation of the energy-level wavefunctions and intensity strengths. Inclusion of rotatory strengths is shown to greatly reduce the number of local minima that must be considered.

Disciplines
Publication Date
October 7, 2002
Citation Information
Gary W Burdick, E. S. LaBianca and D. L. Binus. "Electric-dipole 4fn–4fn transition intensity parametrizations for lanthanides: sensitivity analysis of multiple local minima" Journal of Alloys and Compounds Vol. 344 Iss. 1-2 (2002)
Available at: http://works.bepress.com/gary_burdick/16/