Abstract
The local magnetic moments and the valence contribution to the crystal-field parameter at the rare-earth sites are calculated for B with scrR=Gd, Tb, Dy, Ho, and Er within the framework of the linear-muffin-tin-orbital theory and the local-spin-density approximation. Thereby, the 4f moments of scrR are calculated by the Russel-Saunders scheme, but the radial 4f spin density was part of the self-consistent density-functional calculation. The local moments as well as averaged over the two crystallographically inequivalent scrR sites remain remarkably constant across the series.
- Received 25 October 1991
DOI:https://doi.org/10.1103/PhysRevB.45.3161
©1992 American Physical Society