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

Title: Materials Data on RbSm2Br5 by Materials Project

Abstract

RbSm2Br5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six Br1- atoms. There are a spread of Rb–Br bond distances ranging from 3.38–3.74 Å. There are two inequivalent Sm2+ sites. In the first Sm2+ site, Sm2+ is bonded in a 6-coordinate geometry to seven Br1- atoms. There are a spread of Sm–Br bond distances ranging from 2.90–3.62 Å. In the second Sm2+ site, Sm2+ is bonded in a 6-coordinate geometry to six Br1- atoms. There are a spread of Sm–Br bond distances ranging from 2.94–3.09 Å. There are five inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a 3-coordinate geometry to two equivalent Rb1+ and one Sm2+ atom. In the second Br1- site, Br1- is bonded in a 3-coordinate geometry to one Rb1+ and two Sm2+ atoms. In the third Br1- site, Br1- is bonded in a 5-coordinate geometry to two equivalent Rb1+ and three Sm2+ atoms. In the fourth Br1- site, Br1- is bonded in a 4-coordinate geometry to one Rb1+ and three Sm2+ atoms. In the fifth Br1- site, Br1- is bonded in a 4-coordinate geometry to four Sm2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1209565
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; RbSm2Br5; Br-Rb-Sm
OSTI Identifier:
1758707
DOI:
https://doi.org/10.17188/1758707

Citation Formats

The Materials Project. Materials Data on RbSm2Br5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1758707.
The Materials Project. Materials Data on RbSm2Br5 by Materials Project. United States. doi:https://doi.org/10.17188/1758707
The Materials Project. 2020. "Materials Data on RbSm2Br5 by Materials Project". United States. doi:https://doi.org/10.17188/1758707. https://www.osti.gov/servlets/purl/1758707. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1758707,
title = {Materials Data on RbSm2Br5 by Materials Project},
author = {The Materials Project},
abstractNote = {RbSm2Br5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six Br1- atoms. There are a spread of Rb–Br bond distances ranging from 3.38–3.74 Å. There are two inequivalent Sm2+ sites. In the first Sm2+ site, Sm2+ is bonded in a 6-coordinate geometry to seven Br1- atoms. There are a spread of Sm–Br bond distances ranging from 2.90–3.62 Å. In the second Sm2+ site, Sm2+ is bonded in a 6-coordinate geometry to six Br1- atoms. There are a spread of Sm–Br bond distances ranging from 2.94–3.09 Å. There are five inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a 3-coordinate geometry to two equivalent Rb1+ and one Sm2+ atom. In the second Br1- site, Br1- is bonded in a 3-coordinate geometry to one Rb1+ and two Sm2+ atoms. In the third Br1- site, Br1- is bonded in a 5-coordinate geometry to two equivalent Rb1+ and three Sm2+ atoms. In the fourth Br1- site, Br1- is bonded in a 4-coordinate geometry to one Rb1+ and three Sm2+ atoms. In the fifth Br1- site, Br1- is bonded in a 4-coordinate geometry to four Sm2+ atoms.},
doi = {10.17188/1758707},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}