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Materials Data on UCu4Pd by Materials Project

UCu4Pd is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to four equivalent Pd and twelve equivalent Cu atoms. All U–Pd bond lengths are 3.05 Å. All U–Cu bond lengths are 2.92 Å. Pd is bonded in a 4-coordinate geometry to four equivalent U and twelve equivalent Cu atoms. All Pd–Cu bond lengths are 2.92 Å. Cu is bonded to three equivalent U, three equivalent Pd, and six equivalent Cu atoms to form a mixture of face, edge, and corner-sharing CuU3Cu6Pd3 cuboctahedra. There are three shorter (2.48 Å) and three longer (2.51 Å) Cu–Cu bond lengths.

36 MATERIALS SCIENCE↗

Materials Data on UCu3Pd2 by Materials Project

UPd2Cu3 crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. U is bonded in a 6-coordinate geometry to six equivalent Pd and ten Cu atoms. There are four shorter (2.96 Å) and two longer (2.99 Å) U–Pd bond lengths. There are a spread of U–Cu bond distances ranging from 3.01–3.22 Å. Pd is bonded to three equivalent U, two equivalent Pd, and seven Cu atoms to form a mixture of distorted face, edge, and corner-sharing PdU3Cu7Pd2 cuboctahedra. There are one shorter (2.68 Å) and one longer (2.70 Å) Pd–Pd bond lengths. There are a spread of Pd–Cu bond distances ranging from 2.55–3.06 Å. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent U, four equivalent Pd, and five Cu atoms. There are a spread of Cu–Cu bond distances ranging from 2.46–3.11 Å. In the second Cu site, Cu is bonded in a 12-coordinate geometry to four equivalent U, six equivalent Pd, and six equivalent Cu atoms.

36 MATERIALS SCIENCE↗