Materials Data on LiFe3SiPO8 by Materials Project

Kristin Persson
LiFe3SiPO8 crystallizes in the monoclinic Pc space group. The structure is three-dimensional. Li1+ is bonded to five O2- atoms to form distorted LiO5 trigonal bipyramids that share corners with two equivalent SiO4 tetrahedra, corners with three equivalent PO4 tetrahedra, corners with seven FeO5 trigonal bipyramids, and an edgeedge with one FeO5 trigonal bipyramid. There are a spread of Li–O bond distances ranging from 1.99–2.73 Å. There are three inequivalent Fe2+ sites. In the first Fe2+...
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