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Title: Materials Data on Rb3BrO by Materials Project

Abstract

Rb3OBr is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded in a distorted linear geometry to two equivalent O2- and four equivalent Br1- atoms. Both Rb–O bond lengths are 2.79 Å. All Rb–Br bond lengths are 3.94 Å. O2- is bonded to six equivalent Rb1+ atoms to form ORb6 octahedra that share corners with six equivalent ORb6 octahedra and faces with eight equivalent BrRb12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. Br1- is bonded to twelve equivalent Rb1+ atoms to form BrRb12 cuboctahedra that share corners with twelve equivalent BrRb12 cuboctahedra, faces with six equivalent BrRb12 cuboctahedra, and faces with eight equivalent ORb6 octahedra.

Publication Date:
Other Number(s):
mp-30055
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; Rb3BrO; Br-O-Rb
OSTI Identifier:
1204482
DOI:
https://doi.org/10.17188/1204482

Citation Formats

The Materials Project. Materials Data on Rb3BrO by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204482.
The Materials Project. Materials Data on Rb3BrO by Materials Project. United States. doi:https://doi.org/10.17188/1204482
The Materials Project. 2020. "Materials Data on Rb3BrO by Materials Project". United States. doi:https://doi.org/10.17188/1204482. https://www.osti.gov/servlets/purl/1204482. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1204482,
title = {Materials Data on Rb3BrO by Materials Project},
author = {The Materials Project},
abstractNote = {Rb3OBr is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded in a distorted linear geometry to two equivalent O2- and four equivalent Br1- atoms. Both Rb–O bond lengths are 2.79 Å. All Rb–Br bond lengths are 3.94 Å. O2- is bonded to six equivalent Rb1+ atoms to form ORb6 octahedra that share corners with six equivalent ORb6 octahedra and faces with eight equivalent BrRb12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. Br1- is bonded to twelve equivalent Rb1+ atoms to form BrRb12 cuboctahedra that share corners with twelve equivalent BrRb12 cuboctahedra, faces with six equivalent BrRb12 cuboctahedra, and faces with eight equivalent ORb6 octahedra.},
doi = {10.17188/1204482},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}