CrTiO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. Ti(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 38-42°. Cr(1) is bonded in a 6-coordinate geometry to two equivalent O(1) and four equivalent O(2) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Ti(1) and two equivalent Cr(1) atoms to form corner-sharing OTi2Cr2 trigonal pyramids. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Ti(1) and two equivalent Cr(1) atoms.
CrTiO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. Ti(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles range from 38-42°. Both Ti(1)-O(1) bond lengths are 2.04 Å. There are two shorter (1.96 Å) and two longer (1.98 Å) Ti(1)-O(2) bond lengths. Cr(1) is bonded in a 6-coordinate geometry to two equivalent O(1) and four equivalent O(2) atoms. There is one shorter (2.07 Å) and one longer (2.12 Å) Cr(1)-O(1) bond length. There are two shorter (2.26 Å) and two longer (2.34 Å) Cr(1)-O(2) bond lengths. There are two inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Ti(1) and two equivalent Cr(1) atoms to form corner-sharing OTi2Cr2 trigonal pyramids. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Ti(1) and two equivalent Cr(1) atoms.