DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Rb2CoBr4 by Materials Project

Abstract

Rb2CoBr4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight Br1- atoms. There are a spread of Rb–Br bond distances ranging from 3.55–3.92 Å. In the second Rb1+ site, Rb1+ is bonded in a 9-coordinate geometry to nine Br1- atoms. There are a spread of Rb–Br bond distances ranging from 3.50–4.05 Å. Co2+ is bonded in a tetrahedral geometry to four Br1- atoms. There are three shorter (2.39 Å) and one longer (2.41 Å) Co–Br bond lengths. There are three inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a 1-coordinate geometry to four Rb1+ and one Co2+ atom. In the second Br1- site, Br1- is bonded in a 1-coordinate geometry to four Rb1+ and one Co2+ atom. In the third Br1- site, Br1- is bonded in a 1-coordinate geometry to five Rb1+ and one Co2+ atom.

Authors:
Publication Date:
Other Number(s):
mp-23366
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; Rb2CoBr4; Br-Co-Rb
OSTI Identifier:
1199458
DOI:
https://doi.org/10.17188/1199458

Citation Formats

The Materials Project. Materials Data on Rb2CoBr4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199458.
The Materials Project. Materials Data on Rb2CoBr4 by Materials Project. United States. doi:https://doi.org/10.17188/1199458
The Materials Project. 2020. "Materials Data on Rb2CoBr4 by Materials Project". United States. doi:https://doi.org/10.17188/1199458. https://www.osti.gov/servlets/purl/1199458. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1199458,
title = {Materials Data on Rb2CoBr4 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb2CoBr4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight Br1- atoms. There are a spread of Rb–Br bond distances ranging from 3.55–3.92 Å. In the second Rb1+ site, Rb1+ is bonded in a 9-coordinate geometry to nine Br1- atoms. There are a spread of Rb–Br bond distances ranging from 3.50–4.05 Å. Co2+ is bonded in a tetrahedral geometry to four Br1- atoms. There are three shorter (2.39 Å) and one longer (2.41 Å) Co–Br bond lengths. There are three inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a 1-coordinate geometry to four Rb1+ and one Co2+ atom. In the second Br1- site, Br1- is bonded in a 1-coordinate geometry to four Rb1+ and one Co2+ atom. In the third Br1- site, Br1- is bonded in a 1-coordinate geometry to five Rb1+ and one Co2+ atom.},
doi = {10.17188/1199458},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}