Materials Data on CsI by Materials Project

Kristin Persson
CsI is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to six equivalent I1- atoms to form a mixture of edge and corner-sharing CsI6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Cs–I bond lengths are 3.93 Å. I1- is bonded to six equivalent Cs1+ atoms to form a mixture of edge and corner-sharing ICs6 octahedra. The corner-sharing octahedral tilt angles are 0°.
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