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Title: Materials Data on NaS by Materials Project

Abstract

NaS crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded to six equivalent S1- atoms to form edge-sharing NaS6 octahedra. All Na–S bond lengths are 3.00 Å. In the second Na1+ site, Na1+ is bonded in a 6-coordinate geometry to six equivalent S1- atoms. All Na–S bond lengths are 2.82 Å. S1- is bonded in a 7-coordinate geometry to six Na1+ and one S1- atom. The S–S bond length is 2.17 Å.

Publication Date:
Other Number(s):
mp-2400
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; NaS; Na-S
OSTI Identifier:
1199856
DOI:
https://doi.org/10.17188/1199856

Citation Formats

The Materials Project. Materials Data on NaS by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199856.
The Materials Project. Materials Data on NaS by Materials Project. United States. doi:https://doi.org/10.17188/1199856
The Materials Project. 2020. "Materials Data on NaS by Materials Project". United States. doi:https://doi.org/10.17188/1199856. https://www.osti.gov/servlets/purl/1199856. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1199856,
title = {Materials Data on NaS by Materials Project},
author = {The Materials Project},
abstractNote = {NaS crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded to six equivalent S1- atoms to form edge-sharing NaS6 octahedra. All Na–S bond lengths are 3.00 Å. In the second Na1+ site, Na1+ is bonded in a 6-coordinate geometry to six equivalent S1- atoms. All Na–S bond lengths are 2.82 Å. S1- is bonded in a 7-coordinate geometry to six Na1+ and one S1- atom. The S–S bond length is 2.17 Å.},
doi = {10.17188/1199856},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}