Materials Data on MnFe4B2P by Materials Project

Abstract

MnFe4B2P crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Mn is bonded in a 4-coordinate geometry to eight equivalent Fe, four equivalent B, and two equivalent P atoms. All Mn–Fe bond lengths are 2.49 Å. All Mn–B bond lengths are 2.20 Å. Both Mn–P bond lengths are 2.55 Å. Fe is bonded in a 5-coordinate geometry to two equivalent Mn, three equivalent B, and two equivalent P atoms. There are two shorter (2.15 Å) and one longer (2.18 Å) Fe–B bond lengths. Both Fe–P bond lengths are 2.34 Å. B is bonded in a 9-coordinate geometry to two equivalent Mn, six equivalent Fe, and one B atom. The B–B bond length is 1.84 Å. P is bonded in a 10-coordinate geometry to two equivalent Mn and eight equivalent Fe atoms.