Materials Data on Ti3In by Materials Project

Abstract

Ti3In is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ti is bonded to eight equivalent Ti and four equivalent In atoms to form TiTi8In4 cuboctahedra that share corners with twelve equivalent TiTi8In4 cuboctahedra, edges with eight equivalent InTi12 cuboctahedra, edges with sixteen equivalent TiTi8In4 cuboctahedra, faces with four equivalent InTi12 cuboctahedra, and faces with fourteen equivalent TiTi8In4 cuboctahedra. All Ti–Ti bond lengths are 2.95 Å. All Ti–In bond lengths are 2.95 Å. In is bonded to twelve equivalent Ti atoms to form InTi12 cuboctahedra that share corners with twelve equivalent InTi12 cuboctahedra, edges with twenty-four equivalent TiTi8In4 cuboctahedra, faces with six equivalent InTi12 cuboctahedra, and faces with twelve equivalent TiTi8In4 cuboctahedra.