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Title: Materials Data on Rb3BiF6 by Materials Project

Abstract

Rb3BiF6 is Ilmenite-like structured and crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are three inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a distorted hexagonal planar geometry to six F1- atoms. There are a spread of Rb–F bond distances ranging from 2.84–3.09 Å. In the second Rb1+ site, Rb1+ is bonded in a distorted hexagonal planar geometry to six F1- atoms. There are a spread of Rb–F bond distances ranging from 2.88–3.08 Å. In the third Rb1+ site, Rb1+ is bonded in a distorted hexagonal planar geometry to six F1- atoms. There are four shorter (2.91 Å) and two longer (3.02 Å) Rb–F bond lengths. Bi3+ is bonded in an octahedral geometry to six F1- atoms. All Bi–F bond lengths are 2.28 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted rectangular see-saw-like geometry to three Rb1+ and one Bi3+ atom. In the second F1- site, F1- is bonded in a distorted rectangular see-saw-like geometry to three Rb1+ and one Bi3+ atom. In the third F1- site, F1- is bonded in a distorted rectangular see-saw-like geometry to three Rb1+ and one Bi3+more » atom.« less

Authors:
Publication Date:
Other Number(s):
mp-1209619
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; Rb3BiF6; Bi-F-Rb
OSTI Identifier:
1732263
DOI:
https://doi.org/10.17188/1732263

Citation Formats

The Materials Project. Materials Data on Rb3BiF6 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1732263.
The Materials Project. Materials Data on Rb3BiF6 by Materials Project. United States. doi:https://doi.org/10.17188/1732263
The Materials Project. 2019. "Materials Data on Rb3BiF6 by Materials Project". United States. doi:https://doi.org/10.17188/1732263. https://www.osti.gov/servlets/purl/1732263. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1732263,
title = {Materials Data on Rb3BiF6 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb3BiF6 is Ilmenite-like structured and crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are three inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a distorted hexagonal planar geometry to six F1- atoms. There are a spread of Rb–F bond distances ranging from 2.84–3.09 Å. In the second Rb1+ site, Rb1+ is bonded in a distorted hexagonal planar geometry to six F1- atoms. There are a spread of Rb–F bond distances ranging from 2.88–3.08 Å. In the third Rb1+ site, Rb1+ is bonded in a distorted hexagonal planar geometry to six F1- atoms. There are four shorter (2.91 Å) and two longer (3.02 Å) Rb–F bond lengths. Bi3+ is bonded in an octahedral geometry to six F1- atoms. All Bi–F bond lengths are 2.28 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted rectangular see-saw-like geometry to three Rb1+ and one Bi3+ atom. In the second F1- site, F1- is bonded in a distorted rectangular see-saw-like geometry to three Rb1+ and one Bi3+ atom. In the third F1- site, F1- is bonded in a distorted rectangular see-saw-like geometry to three Rb1+ and one Bi3+ atom.},
doi = {10.17188/1732263},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}