LaVO3 is Orthorhombic Perovskite structured and crystallizes in the monoclinic P2_1/c space group. La(1) is bonded in a 8-coordinate geometry to two equivalent O(1), three equivalent O(2), and three equivalent O(3) atoms. There are two inequivalent V sites. In the first V site, V(1) is bonded to two equivalent O(1) and four equivalent O(3) atoms to form corner-sharing VO6 octahedra. The corner-sharing octahedral tilt angles range from 23-24°. In the second V site, V(2) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing VO6 octahedra. The corner-sharing octahedral tilt angles range from 23-24°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to two equivalent La(1), one V(1), and one V(2) atom. In the second O site, O(2) is bonded in a 5-coordinate geometry to three equivalent La(1) and two equivalent V(2) atoms. In the third O site, O(3) is bonded in a 5-coordinate geometry to three equivalent La(1) and two equivalent V(1) atoms.
LaVO3 is Orthorhombic Perovskite structured and crystallizes in the monoclinic P2_1/c space group. La(1) is bonded in a 8-coordinate geometry to two equivalent O(1), three equivalent O(2), and three equivalent O(3) atoms. There is one shorter (2.46 Å) and one longer (2.58 Å) La(1)-O(1) bond length. There are a spread of La(1)-O(2) bond distances ranging from 2.43-2.73 Å. There are a spread of La(1)-O(3) bond distances ranging from 2.43-2.73 Å. There are two inequivalent V sites. In the first V site, V(1) is bonded to two equivalent O(1) and four equivalent O(3) atoms to form corner-sharing VO6 octahedra. The corner-sharing octahedral tilt angles range from 23-24°. Both V(1)-O(1) bond lengths are 1.97 Å. There are two shorter (1.99 Å) and two longer (2.05 Å) V(1)-O(3) bond lengths. In the second V site, V(2) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form corner-sharing VO6 octahedra. The corner-sharing octahedral tilt angles range from 23-24°. Both V(2)-O(1) bond lengths are 1.97 Å. There are two shorter (1.99 Å) and two longer (2.06 Å) V(2)-O(2) bond lengths. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to two equivalent La(1), one V(1), and one V(2) atom. In the second O site, O(2) is bonded in a 5-coordinate geometry to three equivalent La(1) and two equivalent V(2) atoms. In the third O site, O(3) is bonded in a 5-coordinate geometry to three equivalent La(1) and two equivalent V(1) atoms.