SrZrO3 crystallizes in the tetragonal P4/mbm space group. Sr(1) is bonded in a 8-coordinate geometry to four equivalent O(1) and four equivalent O(2) atoms. Zr(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing ZrO6 octahedra. The corner-sharing octahedral tilt angles range from 0-24°. There are two inequivalent O sites. In the first O site, O(1) is bonded to four equivalent Sr(1) and two equivalent Zr(1) atoms to form a mixture of distorted corner and edge-sharing OSr4Zr2 octahedra. The corner-sharing octahedra are not tilted. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Sr(1) and two equivalent Zr(1) atoms.
SrZrO3 crystallizes in the tetragonal P4/mbm space group. Sr(1) is bonded in a 8-coordinate geometry to four equivalent O(1) and four equivalent O(2) atoms. All Sr(1)-O(1) bond lengths are 2.89 Å. All Sr(1)-O(2) bond lengths are 2.63 Å. Zr(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing ZrO6 octahedra. The corner-sharing octahedral tilt angles range from 0-24°. Both Zr(1)-O(1) bond lengths are 2.09 Å. All Zr(1)-O(2) bond lengths are 2.09 Å. There are two inequivalent O sites. In the first O site, O(1) is bonded to four equivalent Sr(1) and two equivalent Zr(1) atoms to form a mixture of distorted corner and edge-sharing OSr4Zr2 octahedra. The corner-sharing octahedra are not tilted. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Sr(1) and two equivalent Zr(1) atoms.