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Double perovskite compounds crystallize in a cubic geometry. The larger cation A (Ca, Ba) with 12-fold coordination resides at the centre. The B (Sr) and B′ (Fe) atoms are inside octahedral cages surrounded by the neighbouring X (O) atoms at corner positions.

Analysing cation-modified magnetic perovskites A2SnFeO6(A = Ca, Ba): a DFT study

Analysing cation-modified magnetic perovskites A₂SnFeO₆(A = Ca, Ba): a DFT study