Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5385180 | Chemical Physics Letters | 2010 | 4 Pages |
Abstract
⺠In this manuscript the electronic and magnetic properties of the ferromagnetic and antiferromagnetic Fe-doped chalcopyrite are analyzed. ⺠LDA, GGA, LDA + U and GGA + U first principles GGA/LDA and GGA/LDA + U are reported and compared. ⺠The results agree very well with the experimental results.
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Authors
C. Tablero,