LiPd2Tl is Heusler structured and crystallizes in the tetragonal I4/mmm space group. Li(1) is bonded to eight equivalent Pd(1) and four equivalent Tl(1) atoms to form LiTl4Pd8 cuboctahedra that share corners with four equivalent Li(1)Tl4Pd8 cuboctahedra, corners with eight equivalent Tl(1)Li4Pd8 cuboctahedra, edges with eight equivalent Li(1)Tl4Pd8 cuboctahedra, faces with four equivalent Li(1)Tl4Pd8 cuboctahedra, and faces with six equivalent Tl(1)Li4Pd8 cuboctahedra. Pd(1) is bonded in a distorted body-centered cubic geometry to four equivalent Li(1) and four equivalent Tl(1) atoms. Tl(1) is bonded to four equivalent Li(1) and eight equivalent Pd(1) atoms to form TlLi4Pd8 cuboctahedra that share corners with four equivalent Tl(1)Li4Pd8 cuboctahedra, corners with eight equivalent Li(1)Tl4Pd8 cuboctahedra, edges with eight equivalent Tl(1)Li4Pd8 cuboctahedra, faces with four equivalent Tl(1)Li4Pd8 cuboctahedra, and faces with six equivalent Li(1)Tl4Pd8 cuboctahedra.
LiPd2Tl is Heusler structured and crystallizes in the tetragonal I4/mmm space group. Li(1) is bonded to eight equivalent Pd(1) and four equivalent Tl(1) atoms to form LiTl4Pd8 cuboctahedra that share corners with four equivalent Li(1)Tl4Pd8 cuboctahedra, corners with eight equivalent Tl(1)Li4Pd8 cuboctahedra, edges with eight equivalent Li(1)Tl4Pd8 cuboctahedra, faces with four equivalent Li(1)Tl4Pd8 cuboctahedra, and faces with six equivalent Tl(1)Li4Pd8 cuboctahedra. All Li(1)-Pd(1) bond lengths are 2.80 Å. All Li(1)-Tl(1) bond lengths are 2.94 Å. Pd(1) is bonded in a distorted body-centered cubic geometry to four equivalent Li(1) and four equivalent Tl(1) atoms. All Pd(1)-Tl(1) bond lengths are 2.80 Å. Tl(1) is bonded to four equivalent Li(1) and eight equivalent Pd(1) atoms to form TlLi4Pd8 cuboctahedra that share corners with four equivalent Tl(1)Li4Pd8 cuboctahedra, corners with eight equivalent Li(1)Tl4Pd8 cuboctahedra, edges with eight equivalent Tl(1)Li4Pd8 cuboctahedra, faces with four equivalent Tl(1)Li4Pd8 cuboctahedra, and faces with six equivalent Li(1)Tl4Pd8 cuboctahedra.