LiVO2 is Caswellsilverite structured and crystallizes in the monoclinic Pc space group. Li(1) is bonded to three equivalent O(1) and three equivalent O(2) atoms to form LiO6 octahedra that share corners with six equivalent V(1)O6 octahedra, edges with six equivalent Li(1)O6 octahedra, and edges with six equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-4°. V(1) is bonded to three equivalent O(1) and three equivalent O(2) atoms to form VO6 octahedra that share corners with six equivalent Li(1)O6 octahedra, edges with six equivalent Li(1)O6 octahedra, and edges with six equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-4°. There are two inequivalent O sites. In the first O site, O(1) is bonded to three equivalent Li(1) and three equivalent V(1) atoms to form a mixture of corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 0-2°. In the second O site, O(2) is bonded to three equivalent Li(1) and three equivalent V(1) atoms to form a mixture of corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 0-2°.
LiVO2 is Caswellsilverite structured and crystallizes in the monoclinic Pc space group. Li(1) is bonded to three equivalent O(1) and three equivalent O(2) atoms to form LiO6 octahedra that share corners with six equivalent V(1)O6 octahedra, edges with six equivalent Li(1)O6 octahedra, and edges with six equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-4°. There are a spread of Li(1)-O(1) bond distances ranging from 2.08-2.14 Å. There are two shorter (2.10 Å) and one longer (2.12 Å) Li(1)-O(2) bond length. V(1) is bonded to three equivalent O(1) and three equivalent O(2) atoms to form VO6 octahedra that share corners with six equivalent Li(1)O6 octahedra, edges with six equivalent Li(1)O6 octahedra, and edges with six equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-4°. There are a spread of V(1)-O(1) bond distances ranging from 1.99-2.04 Å. There are a spread of V(1)-O(2) bond distances ranging from 1.99-2.07 Å. There are two inequivalent O sites. In the first O site, O(1) is bonded to three equivalent Li(1) and three equivalent V(1) atoms to form a mixture of corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 0-2°. In the second O site, O(2) is bonded to three equivalent Li(1) and three equivalent V(1) atoms to form a mixture of corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 0-2°.