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Title: Materials Data on Rb2MnI4 by Materials Project

Abstract

Rb2MnI4 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six I1- atoms. There are a spread of Rb–I bond distances ranging from 3.69–3.84 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 3.77–4.36 Å. Mn2+ is bonded in a tetrahedral geometry to four I1- atoms. There are a spread of Mn–I bond distances ranging from 2.68–2.70 Å. There are three inequivalent I1- sites. In the first I1- site, I1- is bonded in a 3-coordinate geometry to two Rb1+ and one Mn2+ atom. In the second I1- site, I1- is bonded to four Rb1+ and one Mn2+ atom to form a mixture of distorted face, edge, and corner-sharing IRb4Mn square pyramids. In the third I1- site, I1- is bonded in a 3-coordinate geometry to four Rb1+ and one Mn2+ atom.

Publication Date:
Other Number(s):
mp-1209441
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Rb2MnI4; I-Mn-Rb
OSTI Identifier:
1662749
DOI:
https://doi.org/10.17188/1662749

Citation Formats

The Materials Project. Materials Data on Rb2MnI4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1662749.
The Materials Project. Materials Data on Rb2MnI4 by Materials Project. United States. doi:https://doi.org/10.17188/1662749
The Materials Project. 2020. "Materials Data on Rb2MnI4 by Materials Project". United States. doi:https://doi.org/10.17188/1662749. https://www.osti.gov/servlets/purl/1662749. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1662749,
title = {Materials Data on Rb2MnI4 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb2MnI4 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six I1- atoms. There are a spread of Rb–I bond distances ranging from 3.69–3.84 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 3.77–4.36 Å. Mn2+ is bonded in a tetrahedral geometry to four I1- atoms. There are a spread of Mn–I bond distances ranging from 2.68–2.70 Å. There are three inequivalent I1- sites. In the first I1- site, I1- is bonded in a 3-coordinate geometry to two Rb1+ and one Mn2+ atom. In the second I1- site, I1- is bonded to four Rb1+ and one Mn2+ atom to form a mixture of distorted face, edge, and corner-sharing IRb4Mn square pyramids. In the third I1- site, I1- is bonded in a 3-coordinate geometry to four Rb1+ and one Mn2+ atom.},
doi = {10.17188/1662749},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}