Materials Data on Fe2NiB by Materials Project
Fe2NiB is Cementite-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Fe is bonded in a 2-coordinate geometry to three equivalent B atoms. There are a spread of Fe–B bond distances ranging from 2.08–2.26 Å. Ni is bonded in a 2-coordinate geometry to two equivalent B atoms. Both Ni–B bond lengths are 2.03 Å. B is bonded in a 8-coordinate geometry to six equivalent Fe and two equivalent Ni atoms.