Materials Data on CaCoF4 by Materials Project

Kristin Persson
CaCoF4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Ca2+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Ca–F bond distances ranging from 2.36–2.39 Å. There are two inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a distorted square co-planar geometry to four F1- atoms. There is two shorter (1.98 Å) and two longer (2.01 Å) Co–F bond length. In the...
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