Materials Data on La3Ni3Bi4 by Materials Project

La3Ni3Bi4 crystallizes in the cubic I-43d space group. The structure is three-dimensional. La is bonded in a 12-coordinate geometry to four equivalent Ni and eight equivalent Bi atoms. All La–Ni bond lengths are 3.05 Å. There are four shorter (3.39 Å) and four longer (3.51 Å) La–Bi bond lengths. Ni is bonded in a 8-coordinate geometry to four equivalent La and four equivalent Bi atoms. All Ni–Bi bond lengths are 2.76 Å. Bi is bonded in a 9-coordinate geometry to six equivalent La and three equivalent Ni atoms.