2004, Vol.7, No.4, pp.405-409
Linear Augmented Slater-type Orbital Method formalism
within LDA+U approach is described. All necessary equations are
derived for implementation and some material calculations of
MeB6{Me=La,Gd} type are performed. Calculation results
could be used for experimental data analysis.
Key words:
band structure, hexaborides, spin polarization
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