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Title: Materials Data on NaHO by Materials Project

Abstract

NaOH crystallizes in the triclinic P1 space group. The structure is one-dimensional and consists of two NaOH ribbons oriented in the (0, 0, 1) direction. there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. Both Na–O bond lengths are 2.39 Å. In the second Na1+ site, Na1+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. There are one shorter (2.38 Å) and one longer (2.39 Å) Na–O bond lengths. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a single-bond geometry to two Na1+ and one H1+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-626778
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; NaHO; H-Na-O
OSTI Identifier:
1278800
DOI:
10.17188/1278800

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on NaHO by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1278800.
Persson, Kristin, & Project, Materials. Materials Data on NaHO by Materials Project. United States. doi:10.17188/1278800.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on NaHO by Materials Project". United States. doi:10.17188/1278800. https://www.osti.gov/servlets/purl/1278800. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1278800,
title = {Materials Data on NaHO by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {NaOH crystallizes in the triclinic P1 space group. The structure is one-dimensional and consists of two NaOH ribbons oriented in the (0, 0, 1) direction. there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. Both Na–O bond lengths are 2.39 Å. In the second Na1+ site, Na1+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. There are one shorter (2.38 Å) and one longer (2.39 Å) Na–O bond lengths. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a single-bond geometry to two Na1+ and one H1+ atom.},
doi = {10.17188/1278800},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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