Abstract

A new mixed-valence iron phosphate Na 1.25Mg 1.10Fe 1.90(PO 4) 3 has been synthesized as single crystals by a flux technique and its structure has been refined from X-ray data to a residual R 1 = 0.032. The compound crystallizes in the monoclinic space group C2/ c with the parameters: a = 11.7831(3) Å, b = 12.4740(3) Å, c = 6.3761(2) Å, β = 113.643(2)° and Z = 4. The structure belongs to the alluaudite structural type, and thus it obeys to the X(2)X(1)M(1)M(2) 2(PO 4) 3 general formula. The X(2) and X(1) sites are occupied by sodium while the M(1) and M(2) sites feature a statistical distribution of iron and magnesium. Additional information about the cation distribution has been extracted from a Mössbauer spectroscopy study which confirmed the mixed valency of the compound. A magnetic susceptibility study has also been undertaken and has shown the compound to be antiferromagnetic with a Neel temperature of about 35 K.

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