English

Crystal field of rare earth impurities in LaF$_3$

Strongly Correlated Electrons 2014-07-30 v1

Abstract

The crystal field parameters of 13 trivalent lanthanide ions substituted for La in LaF3_3 were calculated using the combination of the band structure and Wannier function calculations. Performing an atomic exact diagonalization with thus obtained crystal-field parameters we compute the crystal-field splitting of atomic multiplets. The calculation is compared with the available experimental results and a good agreement is found.

Keywords

Cite

@article{arxiv.1407.7669,
  title  = {Crystal field of rare earth impurities in LaF$_3$},
  author = {P. Novák and J. Kuneš and K. Knížek},
  journal= {arXiv preprint arXiv:1407.7669},
  year   = {2014}
}