Materials Data on Li5Ni2O2F5 by Materials Project

Kristin Persson
Li5Ni2O2F5 is alpha Po-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are three inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded to one O2- and five F1- atoms to form LiOF5 octahedra that share a cornercorner with one NiO5F octahedra, corners with five LiOF5 octahedra, edges with four equivalent NiO5F octahedra, and edges with eight LiOF5 octahedra. The corner-sharing octahedra tilt angles range from 0–3°....
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