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Title: Materials Data on RbBi by Materials Project

Abstract

BiRb is Magnesium tetraboride-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are four inequivalent Rb sites. In the first Rb site, Rb is bonded in a 6-coordinate geometry to six Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.76–4.13 Å. In the second Rb site, Rb is bonded in a 7-coordinate geometry to seven Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.80–4.29 Å. In the third Rb site, Rb is bonded in a 7-coordinate geometry to seven Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.79–4.35 Å. In the fourth Rb site, Rb is bonded in a 6-coordinate geometry to six Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.78–4.13 Å. There are four inequivalent Bi sites. In the first Bi site, Bi is bonded in a 9-coordinate geometry to seven Rb and two equivalent Bi atoms. There are one shorter (3.07 Å) and one longer (3.10 Å) Bi–Bi bond lengths. In the second Bi site, Bi is bonded in a 8-coordinate geometry to six Rb and two equivalent Bi atoms. In the third Bi site,more » Bi is bonded in a 9-coordinate geometry to seven Rb and two equivalent Bi atoms. There are one shorter (3.06 Å) and one longer (3.08 Å) Bi–Bi bond lengths. In the fourth Bi site, Bi is bonded in a 8-coordinate geometry to six Rb and two equivalent Bi atoms.« less

Publication Date:
Other Number(s):
mp-31105
DOE Contract Number:  
AC02-05CH11231
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Bi-Rb; RbBi; crystal structure
OSTI Identifier:
1205430
DOI:
https://doi.org/10.17188/1205430

Citation Formats

Materials Data on RbBi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205430.
Materials Data on RbBi by Materials Project. United States. doi:https://doi.org/10.17188/1205430
2020. "Materials Data on RbBi by Materials Project". United States. doi:https://doi.org/10.17188/1205430. https://www.osti.gov/servlets/purl/1205430. Pub date:Wed Apr 29 04:00:00 UTC 2020
@article{osti_1205430,
title = {Materials Data on RbBi by Materials Project},
abstractNote = {BiRb is Magnesium tetraboride-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are four inequivalent Rb sites. In the first Rb site, Rb is bonded in a 6-coordinate geometry to six Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.76–4.13 Å. In the second Rb site, Rb is bonded in a 7-coordinate geometry to seven Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.80–4.29 Å. In the third Rb site, Rb is bonded in a 7-coordinate geometry to seven Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.79–4.35 Å. In the fourth Rb site, Rb is bonded in a 6-coordinate geometry to six Bi atoms. There are a spread of Rb–Bi bond distances ranging from 3.78–4.13 Å. There are four inequivalent Bi sites. In the first Bi site, Bi is bonded in a 9-coordinate geometry to seven Rb and two equivalent Bi atoms. There are one shorter (3.07 Å) and one longer (3.10 Å) Bi–Bi bond lengths. In the second Bi site, Bi is bonded in a 8-coordinate geometry to six Rb and two equivalent Bi atoms. In the third Bi site, Bi is bonded in a 9-coordinate geometry to seven Rb and two equivalent Bi atoms. There are one shorter (3.06 Å) and one longer (3.08 Å) Bi–Bi bond lengths. In the fourth Bi site, Bi is bonded in a 8-coordinate geometry to six Rb and two equivalent Bi atoms.},
doi = {10.17188/1205430},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}