KBaSb is half-Heusler structured and crystallizes in the cubic F-43m space group. K(1) is bonded in a body-centered cubic geometry to four equivalent Ba(1) and four equivalent Sb(1) atoms. Ba(1) is bonded in a distorted q6 geometry to four equivalent K(1) and six equivalent Sb(1) atoms. Sb(1) is bonded to four equivalent K(1) and six equivalent Ba(1) atoms to form a mixture of distorted corner and face-sharing SbK4Ba6 tetrahedra.
KBaSb is half-Heusler structured and crystallizes in the cubic F-43m space group. K(1) is bonded in a body-centered cubic geometry to four equivalent Ba(1) and four equivalent Sb(1) atoms. All K(1)-Ba(1) bond lengths are 3.44 Å. All K(1)-Sb(1) bond lengths are 3.44 Å. Ba(1) is bonded in a distorted q6 geometry to four equivalent K(1) and six equivalent Sb(1) atoms. All Ba(1)-Sb(1) bond lengths are 3.97 Å. Sb(1) is bonded to four equivalent K(1) and six equivalent Ba(1) atoms to form a mixture of distorted corner and face-sharing SbK4Ba6 tetrahedra.