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Journal of Structural Chemistry

2008 year, number 5

Electronic structure and magnetic properties of double perovskites Sr2FeMO6 (M = Sc, Ti, …, Ni, Cu) according to the data of FLAPW-GGA band structure calculations

V. V. Bannikov, I. R. Shein, V. L. Kozhevnikov, A. L. Ivanovskii
Keywords: double perovskites Sr2FeMO6, band structure, magnetism, modeling
Pages: 815-820


Changes in the electronic structure and magnetic characteristics of Sr2FeMO6 double perovskites were studied by the FLAPW-GGA ab initio band structure method in relation to the type of the cation M = Sc, Ti, …, Ni, Cu.