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Title: Materials Data on RbInI4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1202331· OSTI ID:1202331

RbInI4 crystallizes in the trigonal R3c space group. The structure is three-dimensional. Rb1+ is bonded in a 7-coordinate geometry to seven I1- atoms. There are a spread of Rb–I bond distances ranging from 3.78–4.13 Å. In3+ is bonded in a tetrahedral geometry to four I1- atoms. There are one shorter (2.76 Å) and three longer (2.77 Å) In–I bond lengths. There are four inequivalent I1- sites. In the first I1- site, I1- is bonded in an L-shaped geometry to one Rb1+ and one In3+ atom. In the second I1- site, I1- is bonded in a 3-coordinate geometry to two equivalent Rb1+ and one In3+ atom. In the third I1- site, I1- is bonded in a 1-coordinate geometry to two equivalent Rb1+ and one In3+ atom. In the fourth I1- site, I1- is bonded in a 3-coordinate geometry to two equivalent Rb1+ and one In3+ atom.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1202331
Report Number(s):
mp-28198
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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