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Electronic Structure of the Ce Systems I. General Theory

 

作者: F. López‐Aguilar,   J. Costa‐Quintana,  

 

期刊: physica status solidi (b)  (WILEY Available online 1986)
卷期: Volume 137, issue 2  

页码: 533-539

 

ISSN:0370-1972

 

年代: 1986

 

DOI:10.1002/pssb.2221370214

 

出版商: WILEY‐VCH Verlag

 

数据来源: WILEY

 

摘要:

AbstractA model is deduced for the electronic structure of the Ce systems. It includes a pseudopotential which considers the strong correlation effects due to the fluctuation of the number of f‐electrons in the Ce atoms. The pseudopotential affects the f‐symmetries according to their own occupations and is different from zero when the f‐states are spd/f hybridized. The APW method is modified in order to introduce the pseudopotential within the band structure Hamiltonian. Finally, the so‐called „three‐peak”︁ 4f structure which appears in the Ce systems is analyzed

 

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