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Materials Data on CsSnF3 by Materials Project

CsSnF3 crystallizes in the trigonal R3c space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six equivalent F1- atoms. There are three shorter (3.07 Å) and three longer (3.20 Å) Cs–F bond lengths. Sn2+ is bonded in a distorted T-shaped geometry to three equivalent F1- atoms. All Sn–F bond lengths are 2.12 Å. F1- is bonded in a 1-coordinate geometry to two equivalent Cs1+ and one Sn2+ atom.

36 MATERIALS SCIENCE↗

Materials Data on CsSnF3 by Materials Project

CsSnF3 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Cs1+ is bonded in a 9-coordinate geometry to nine F1- atoms. There are a spread of Cs–F bond distances ranging from 3.04–3.54 Å. Sn2+ is bonded in a distorted T-shaped geometry to three F1- atoms. There are a spread of Sn–F bond distances ranging from 2.08–2.12 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted single-bond geometry to three equivalent Cs1+ and one Sn2+ atom. In the second F1- site, F1- is bonded in a distorted single-bond geometry to three equivalent Cs1+ and one Sn2+ atom. In the third F1- site, F1- is bonded in a 4-coordinate geometry to three equivalent Cs1+ and one Sn2+ atom.

36 MATERIALS SCIENCE↗