Materials Data on LiV2O4 by Materials Project
LiV2O4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent O2- atoms to form LiO4 tetrahedra that share corners with twelve equivalent VO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Li–O bond lengths are 1.97 Å. V+3.50+ is bonded to six equivalent O2- atoms to form VO6 octahedra that share corners with six equivalent LiO4 tetrahedra and edges with six equivalent VO6 octahedra. All V–O bond lengths are 2.01 Å. O2- is bonded to one Li1+ and three equivalent V+3.50+ atoms to form a mixture of distorted corner and edge-sharing OLiV3 trigonal pyramids.
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