NbNiIn is half-Heusler structured and crystallizes in the cubic F-43m space group. Nb(1) is bonded in a body-centered cubic geometry to four equivalent Ni(1) and four equivalent In(1) atoms. Ni(1) is bonded to four equivalent Nb(1) and six equivalent In(1) atoms to form distorted NiNb4In6 tetrahedra that share corners with four equivalent In(1)Nb4Ni6 tetrahedra, corners with six equivalent Ni(1)Nb4In6 tetrahedra, edges with six equivalent In(1)Nb4Ni6 tetrahedra, and faces with twelve equivalent Ni(1)Nb4In6 tetrahedra. In(1) is bonded to four equivalent Nb(1) and six equivalent Ni(1) atoms to form distorted InNb4Ni6 tetrahedra that share corners with four equivalent Ni(1)Nb4In6 tetrahedra, corners with six equivalent In(1)Nb4Ni6 tetrahedra, edges with six equivalent Ni(1)Nb4In6 tetrahedra, and faces with twelve equivalent In(1)Nb4Ni6 tetrahedra.
NbNiIn is half-Heusler structured and crystallizes in the cubic F-43m space group. Nb(1) is bonded in a body-centered cubic geometry to four equivalent Ni(1) and four equivalent In(1) atoms. All Nb(1)-Ni(1) bond lengths are 2.69 Å. All Nb(1)-In(1) bond lengths are 2.69 Å. Ni(1) is bonded to four equivalent Nb(1) and six equivalent In(1) atoms to form distorted NiNb4In6 tetrahedra that share corners with four equivalent In(1)Nb4Ni6 tetrahedra, corners with six equivalent Ni(1)Nb4In6 tetrahedra, edges with six equivalent In(1)Nb4Ni6 tetrahedra, and faces with twelve equivalent Ni(1)Nb4In6 tetrahedra. All Ni(1)-In(1) bond lengths are 3.11 Å. In(1) is bonded to four equivalent Nb(1) and six equivalent Ni(1) atoms to form distorted InNb4Ni6 tetrahedra that share corners with four equivalent Ni(1)Nb4In6 tetrahedra, corners with six equivalent In(1)Nb4Ni6 tetrahedra, edges with six equivalent Ni(1)Nb4In6 tetrahedra, and faces with twelve equivalent In(1)Nb4Ni6 tetrahedra.