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Title: Materials Data on NaBrO3 by Materials Project

Abstract

NaBrO3 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Na1+ is bonded to six equivalent O2- atoms to form corner-sharing NaO6 octahedra. The corner-sharing octahedral tilt angles are 62°. There are three shorter (2.45 Å) and three longer (2.54 Å) Na–O bond lengths. O2- is bonded in a trigonal planar geometry to two equivalent Na1+ and one Br5+ atom. The O–Br bond length is 1.69 Å. Br5+ is bonded in a trigonal non-coplanar geometry to three equivalent O2- atoms.

Publication Date:
Other Number(s):
mp-23339
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; NaBrO3; Br-Na-O
OSTI Identifier:
1199439
DOI:
https://doi.org/10.17188/1199439

Citation Formats

The Materials Project. Materials Data on NaBrO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199439.
The Materials Project. Materials Data on NaBrO3 by Materials Project. United States. doi:https://doi.org/10.17188/1199439
The Materials Project. 2020. "Materials Data on NaBrO3 by Materials Project". United States. doi:https://doi.org/10.17188/1199439. https://www.osti.gov/servlets/purl/1199439. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1199439,
title = {Materials Data on NaBrO3 by Materials Project},
author = {The Materials Project},
abstractNote = {NaBrO3 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Na1+ is bonded to six equivalent O2- atoms to form corner-sharing NaO6 octahedra. The corner-sharing octahedral tilt angles are 62°. There are three shorter (2.45 Å) and three longer (2.54 Å) Na–O bond lengths. O2- is bonded in a trigonal planar geometry to two equivalent Na1+ and one Br5+ atom. The O–Br bond length is 1.69 Å. Br5+ is bonded in a trigonal non-coplanar geometry to three equivalent O2- atoms.},
doi = {10.17188/1199439},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}