ZrTiO4 is Hydrophilite-derived structured and crystallizes in the orthorhombic P2_12_12 space group. Zr(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form ZrO6 octahedra that share corners with four equivalent Zr(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent Ti(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 49-57°. Ti(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form TiO6 octahedra that share corners with four equivalent Zr(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent Zr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-54°. There are two inequivalent O sites. In the first O site, O(2) is bonded in a trigonal planar geometry to two equivalent Zr(1) and one Ti(1) atom. In the second O site, O(1) is bonded in a distorted trigonal planar geometry to one Zr(1) and two equivalent Ti(1) atoms.
ZrTiO4 is Hydrophilite-derived structured and crystallizes in the orthorhombic P2_12_12 space group. Zr(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form ZrO6 octahedra that share corners with four equivalent Zr(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent Ti(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 49-57°. Both Zr(1)-O(1) bond lengths are 2.21 Å. There are two shorter (2.03 Å) and two longer (2.06 Å) Zr(1)-O(2) bond lengths. Ti(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form TiO6 octahedra that share corners with four equivalent Zr(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent Zr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 48-54°. Both Ti(1)-O(2) bond lengths are 2.06 Å. There are two shorter (1.90 Å) and two longer (2.02 Å) Ti(1)-O(1) bond lengths. There are two inequivalent O sites. In the first O site, O(2) is bonded in a trigonal planar geometry to two equivalent Zr(1) and one Ti(1) atom. In the second O site, O(1) is bonded in a distorted trigonal planar geometry to one Zr(1) and two equivalent Ti(1) atoms.