Zn2TiO4 is Spinel-like structured and crystallizes in the tetragonal P4_122 space group. Ti(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form TiO6 octahedra that share corners with six equivalent Zn(1)O4 tetrahedra, edges with two equivalent Ti(1)O6 octahedra, and edges with four equivalent Zn(2)O6 octahedra. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form ZnO4 tetrahedra that share corners with six equivalent Ti(1)O6 octahedra and corners with six equivalent Zn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 53-63°. In the second Zn site, Zn(2) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form ZnO6 octahedra that share corners with six equivalent Zn(1)O4 tetrahedra, edges with two equivalent Zn(2)O6 octahedra, and edges with four equivalent Ti(1)O6 octahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded in a rectangular see-saw-like geometry to one Ti(1), one Zn(1), and two equivalent Zn(2) atoms. In the second O site, O(2) is bonded in a distorted rectangular see-saw-like geometry to two equivalent Ti(1), one Zn(1), and one Zn(2) atom.
Zn2TiO4 is Spinel-like structured and crystallizes in the tetragonal P4_122 space group. Ti(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form TiO6 octahedra that share corners with six equivalent Zn(1)O4 tetrahedra, edges with two equivalent Ti(1)O6 octahedra, and edges with four equivalent Zn(2)O6 octahedra. Both Ti(1)-O(1) bond lengths are 1.92 Å. There are two shorter (1.98 Å) and two longer (2.07 Å) Ti(1)-O(2) bond lengths. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form ZnO4 tetrahedra that share corners with six equivalent Ti(1)O6 octahedra and corners with six equivalent Zn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 53-63°. Both Zn(1)-O(1) bond lengths are 2.00 Å. Both Zn(1)-O(2) bond lengths are 2.00 Å. In the second Zn site, Zn(2) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form ZnO6 octahedra that share corners with six equivalent Zn(1)O4 tetrahedra, edges with two equivalent Zn(2)O6 octahedra, and edges with four equivalent Ti(1)O6 octahedra. Both Zn(2)-O(2) bond lengths are 2.19 Å. There are two shorter (2.09 Å) and two longer (2.14 Å) Zn(2)-O(1) bond lengths. There are two inequivalent O sites. In the first O site, O(1) is bonded in a rectangular see-saw-like geometry to one Ti(1), one Zn(1), and two equivalent Zn(2) atoms. In the second O site, O(2) is bonded in a distorted rectangular see-saw-like geometry to two equivalent Ti(1), one Zn(1), and one Zn(2) atom.