Xenophyllite, Na4Fe7(PO4)6, an Exotic Meteoritic Phosphate: New Mineral Description, Na-ions Mobility and Electrochemical Implications.

Xenophyllite, ideally Na4Fe7(PO4)6, is a rare meteoritic phosphate found in phosphide-phosphate assemblages confined to troilite nodules of the Augustinovka iron meteorite (medium octahedrite, IIIAB). The mineral occurs as tiny lamella up to 0.15 mm long cross-cutting millimeter-sized grains of sarcopside, Fe3(PO4)2, associated with schreibersite, chromite and pentlandite. Xenophyllite is translucent, has a bluish-green to grey-green color and vitreous lustre. Moh's hardness is 3.5–4. Cleavage is perfect on {001}. Measured density is 3.58(5) g/cm3. The mineral is biaxial (−), 2V 10–20°, with refractive indexes: α 1.675(2), β 1.681(2), γ 1.681 (2). Chemical composition of the holotype specimen (electron microprobe, wt.%) is: Na2O 10.9, K2O 0.4, MnO 5.8, FeO 42.1, Cr2O3 0.8, P2O5 40.7, total 100.7, corresponding to the empirical formula (Na3.67K0.09)Σ3.76(Fe2+6.12Mn2+0.85Cr0.11)Σ7.08P5.99O24.00. Xenophyllite is triclinic, P1 or P-1, a 9.643(6), b 9.633(5), c 17.645(11) Å; α 88.26(5), β 88.16(5), γ 64.83(5)°, V 1482(2) Å3, Z = 3. The toichiome C-centered subcell has the following dimensions: a 16.257(9), b 10.318(8), c 6.257(9) Å, β = 112.77(9)°, V 968(2) Å3, Z = 2. Xenophyllite is structurally related to synthetic phosphate Kna3Fe7(PO4)6 having a channel-type structure, and galileiite, NaFe4(PO4)3. The variations of chemical composition of xenophyllite ranging from Na4Fe7(PO4)6 to almost Na2Fe8(PO4)6 are accounted for by Na-ions mobility. The latter property makes xenophyllite a promising prototype for cathode materials used in sodium-ion batteries. [ABSTRACT FROM AUTHOR]