Materials Data on NaO3 by Materials Project
Abstract
NaO3 is Baddeleyite-like structured and crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. Na is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of Na–O bond distances ranging from 2.47–2.71 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Na and one O atom to form a mixture of distorted edge and corner-sharing ONa3O tetrahedra. The O–O bond length is 1.37 Å. In the second O site, O is bonded in a trigonal planar geometry to one Na and two equivalent O atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-22464
- 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; NaO3; Na-O
- OSTI Identifier:
- 1198306
- DOI:
- https://doi.org/10.17188/1198306
Citation Formats
The Materials Project. Materials Data on NaO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1198306.
The Materials Project. Materials Data on NaO3 by Materials Project. United States. doi:https://doi.org/10.17188/1198306
The Materials Project. 2020.
"Materials Data on NaO3 by Materials Project". United States. doi:https://doi.org/10.17188/1198306. https://www.osti.gov/servlets/purl/1198306. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1198306,
title = {Materials Data on NaO3 by Materials Project},
author = {The Materials Project},
abstractNote = {NaO3 is Baddeleyite-like structured and crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. Na is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of Na–O bond distances ranging from 2.47–2.71 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Na and one O atom to form a mixture of distorted edge and corner-sharing ONa3O tetrahedra. The O–O bond length is 1.37 Å. In the second O site, O is bonded in a trigonal planar geometry to one Na and two equivalent O atoms.},
doi = {10.17188/1198306},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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