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Title: Materials Data on Rb2FeI4 by Materials Project

Abstract

Rb2FeI4 crystallizes in the monoclinic P2_1 space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 9-coordinate geometry to nine I1- atoms. There are a spread of Rb–I bond distances ranging from 3.69–4.45 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight I1- atoms. There are a spread of Rb–I bond distances ranging from 3.81–4.36 Å. Fe2+ is bonded in a tetrahedral geometry to four I1- atoms. There are three shorter (2.63 Å) and one longer (2.64 Å) Fe–I bond lengths. There are four inequivalent I1- sites. In the first I1- site, I1- is bonded in a 1-coordinate geometry to five Rb1+ and one Fe2+ atom. In the second I1- site, I1- is bonded in a 1-coordinate geometry to four Rb1+ and one Fe2+ atom. In the third I1- site, I1- is bonded in a 5-coordinate geometry to four Rb1+ and one Fe2+ atom. In the fourth I1- site, I1- is bonded in a 5-coordinate geometry to four Rb1+ and one Fe2+ atom.

Authors:
Publication Date:
Other Number(s):
mp-581600
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Rb2FeI4; Fe-I-Rb
OSTI Identifier:
1276864
DOI:
https://doi.org/10.17188/1276864

Citation Formats

The Materials Project. Materials Data on Rb2FeI4 by Materials Project. United States: N. p., 2014. Web. doi:10.17188/1276864.
The Materials Project. Materials Data on Rb2FeI4 by Materials Project. United States. doi:https://doi.org/10.17188/1276864
The Materials Project. 2014. "Materials Data on Rb2FeI4 by Materials Project". United States. doi:https://doi.org/10.17188/1276864. https://www.osti.gov/servlets/purl/1276864. Pub date:Mon Feb 24 00:00:00 EST 2014
@article{osti_1276864,
title = {Materials Data on Rb2FeI4 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb2FeI4 crystallizes in the monoclinic P2_1 space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 9-coordinate geometry to nine I1- atoms. There are a spread of Rb–I bond distances ranging from 3.69–4.45 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight I1- atoms. There are a spread of Rb–I bond distances ranging from 3.81–4.36 Å. Fe2+ is bonded in a tetrahedral geometry to four I1- atoms. There are three shorter (2.63 Å) and one longer (2.64 Å) Fe–I bond lengths. There are four inequivalent I1- sites. In the first I1- site, I1- is bonded in a 1-coordinate geometry to five Rb1+ and one Fe2+ atom. In the second I1- site, I1- is bonded in a 1-coordinate geometry to four Rb1+ and one Fe2+ atom. In the third I1- site, I1- is bonded in a 5-coordinate geometry to four Rb1+ and one Fe2+ atom. In the fourth I1- site, I1- is bonded in a 5-coordinate geometry to four Rb1+ and one Fe2+ atom.},
doi = {10.17188/1276864},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2014},
month = {2}
}