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Title: Materials Data on NaTlO by Materials Project

Abstract

NaTlO is Marcasite-derived structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Na1+ is bonded in a 3-coordinate geometry to one Tl1+ and three equivalent O2- atoms. The Na–Tl bond length is 3.23 Å. All Na–O bond lengths are 2.33 Å. Tl1+ is bonded in a 4-coordinate geometry to one Na1+ and three equivalent O2- atoms. All Tl–O bond lengths are 2.51 Å. O2- is bonded to three equivalent Na1+ and three equivalent Tl1+ atoms to form edge-sharing ONa3Tl3 octahedra.

Authors:
Publication Date:
Other Number(s):
mp-1220867
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; NaTlO; Na-O-Tl
OSTI Identifier:
1758164
DOI:
https://doi.org/10.17188/1758164

Citation Formats

The Materials Project. Materials Data on NaTlO by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1758164.
The Materials Project. Materials Data on NaTlO by Materials Project. United States. doi:https://doi.org/10.17188/1758164
The Materials Project. 2020. "Materials Data on NaTlO by Materials Project". United States. doi:https://doi.org/10.17188/1758164. https://www.osti.gov/servlets/purl/1758164. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1758164,
title = {Materials Data on NaTlO by Materials Project},
author = {The Materials Project},
abstractNote = {NaTlO is Marcasite-derived structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Na1+ is bonded in a 3-coordinate geometry to one Tl1+ and three equivalent O2- atoms. The Na–Tl bond length is 3.23 Å. All Na–O bond lengths are 2.33 Å. Tl1+ is bonded in a 4-coordinate geometry to one Na1+ and three equivalent O2- atoms. All Tl–O bond lengths are 2.51 Å. O2- is bonded to three equivalent Na1+ and three equivalent Tl1+ atoms to form edge-sharing ONa3Tl3 octahedra.},
doi = {10.17188/1758164},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}