Results for “Cu-Hf-Pb”

Materials Data on Hf5CuPb3 by Materials Project

Hf5CuPb3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All Hf–Pb bond lengths are 3.07 Å. In the second Hf site, Hf is bonded to two equivalent Cu and five equivalent Pb atoms to form a mixture of distorted corner, edge, and face-sharing HfCu2Pb5 pentagonal bipyramids. Both Hf–Cu bond lengths are 2.68 Å. There are a spread of Hf–Pb bond distances ranging from 2.98–3.15 Å. Cu is bonded to six equivalent Hf atoms to form face-sharing CuHf6 octahedra. Pb is bonded in a 9-coordinate geometry to nine Hf atoms.