Ab initiocalculation of the contribution from anion dipole polarization and dynamic correlation to4f−5dexcitations ofCe3+in ionic compounds
Author:
Publisher
American Physical Society (APS)
Subject
Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.72.045129/fulltext
Reference27 articles.
1. A systematic analysis of the spectra of the lanthanides doped into single crystal LaF3
2. Spectroscopy and calculations for4fN→4fN−15dtransitions of lanthanide ions inLiYF4
3. Basis set limit extrapolation of ACPF and CCSD(T) results for the third and fourth lanthanide ionization potentials
4. Transferability of core potentials to f and d states of lanthanide and actinide ions
5. Energy differences between4fn+15d06s2and4fn5d16s2electron configurations for the lanthanide atoms
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