Abstract

Abstracts The computational procedure and the recent applications of the relativistic discrete variational multielectron (DVME) method are reviewed. The analysis of first-principles calculations of the multiplet energy levels and 4f n – 4f n– 1 5d transition spectra of rare-earth ions in LiYF 4 crystal, and the analysis of MCD of Cr L 2,3 -edge XANES of CrO 2 are shown as applications to optical and magnetic materials, respectively. Some future plans on the extension of the relativistic DVME calculation program are also mentioned.

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