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DOE OSTI2020

Materials Data on LiBiPd2 by Materials Project

LiPd2Bi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Pd and six equivalent Bi atoms. All Li–Pd bond lengths are 2.84 Å. All Li–Bi bond lengths are 3.28 Å. Pd is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Bi atoms. All Pd–Bi bond lengths are 2.84 Å. Bi is bonded in a 8-coordinate geometry to six equivalent Li and eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on LiBi2Pd by Materials Project

LiPdBi2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two LiPdBi2 ribbons oriented in the (1, 0, 0) direction. Li is bonded in a linear geometry to two equivalent Bi atoms. Both Li–Bi bond lengths are 2.78 Å. Pd is bonded in a linear geometry to two equivalent Bi atoms. Both Pd–Bi bond lengths are 2.52 Å. Bi is bonded in a linear geometry to one Li and one Pd atom.

36 MATERIALS SCIENCE↗