NiBBi is half-Heusler structured and crystallizes in the cubic F-43m space group. Ni(1) is bonded in a body-centered cubic geometry to four equivalent B(1) and four equivalent Bi(1) atoms. B(1) is bonded to four equivalent Ni(1) atoms to form distorted BNi4 tetrahedra that share corners with four equivalent Bi(1)Ni4 tetrahedra, corners with twelve equivalent B(1)Ni4 tetrahedra, and edges with six equivalent Bi(1)Ni4 tetrahedra. Bi(1) is bonded to four equivalent Ni(1) atoms to form distorted BiNi4 tetrahedra that share corners with four equivalent B(1)Ni4 tetrahedra, corners with twelve equivalent Bi(1)Ni4 tetrahedra, and edges with six equivalent B(1)Ni4 tetrahedra.
NiBBi is half-Heusler structured and crystallizes in the cubic F-43m space group. Ni(1) is bonded in a body-centered cubic geometry to four equivalent B(1) and four equivalent Bi(1) atoms. All Ni(1)-B(1) bond lengths are 2.52 Å. All Ni(1)-Bi(1) bond lengths are 2.52 Å. B(1) is bonded to four equivalent Ni(1) atoms to form distorted BNi4 tetrahedra that share corners with four equivalent Bi(1)Ni4 tetrahedra, corners with twelve equivalent B(1)Ni4 tetrahedra, and edges with six equivalent Bi(1)Ni4 tetrahedra. Bi(1) is bonded to four equivalent Ni(1) atoms to form distorted BiNi4 tetrahedra that share corners with four equivalent B(1)Ni4 tetrahedra, corners with twelve equivalent Bi(1)Ni4 tetrahedra, and edges with six equivalent B(1)Ni4 tetrahedra.