Materials Data on Ca(FeP)2 by Materials Project
CaFe2P2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ca2+ is bonded in a body-centered cubic geometry to eight equivalent P3- atoms. All Ca–P bond lengths are 3.05 Å. Fe2+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing FeP4 tetrahedra. All Fe–P bond lengths are 2.20 Å. P3- is bonded in a 4-coordinate geometry to four equivalent Ca2+ and four equivalent Fe2+ atoms.
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