Materials Data on DyZr by Materials Project

Abstract

DyZr crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Dy is bonded to six equivalent Dy and six equivalent Zr atoms to form DyDy6Zr6 cuboctahedra that share corners with eighteen equivalent DyDy6Zr6 cuboctahedra, edges with six equivalent DyDy6Zr6 cuboctahedra, edges with twelve equivalent ZrDy6Zr6 cuboctahedra, faces with eight equivalent DyDy6Zr6 cuboctahedra, and faces with twelve equivalent ZrDy6Zr6 cuboctahedra. All Dy–Dy bond lengths are 3.40 Å. All Dy–Zr bond lengths are 3.35 Å. Zr is bonded to six equivalent Dy and six equivalent Zr atoms to form ZrDy6Zr6 cuboctahedra that share corners with eighteen equivalent ZrDy6Zr6 cuboctahedra, edges with six equivalent ZrDy6Zr6 cuboctahedra, edges with twelve equivalent DyDy6Zr6 cuboctahedra, faces with eight equivalent ZrDy6Zr6 cuboctahedra, and faces with twelve equivalent DyDy6Zr6 cuboctahedra. All Zr–Zr bond lengths are 3.40 Å.