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Title: Materials Data on TlSn3 by Materials Project

Abstract

TlSn3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tl is bonded to twelve Sn atoms to form a mixture of distorted corner and face-sharing TlSn12 cuboctahedra. There are six shorter (3.36 Å) and six longer (3.57 Å) Tl–Sn bond lengths. There are three inequivalent Sn sites. In the first Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Tl and eight Sn atoms. There are two shorter (3.24 Å) and six longer (3.49 Å) Sn–Sn bond lengths. In the second Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Tl and eight Sn atoms. All Sn–Sn bond lengths are 3.49 Å. In the third Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Tl and eight Sn atoms. Both Sn–Sn bond lengths are 3.49 Å.

Publication Date:
Other Number(s):
mp-1187690
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; TlSn3; Sn-Tl
OSTI Identifier:
1744308
DOI:
https://doi.org/10.17188/1744308

Citation Formats

The Materials Project. Materials Data on TlSn3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1744308.
The Materials Project. Materials Data on TlSn3 by Materials Project. United States. doi:https://doi.org/10.17188/1744308
The Materials Project. 2020. "Materials Data on TlSn3 by Materials Project". United States. doi:https://doi.org/10.17188/1744308. https://www.osti.gov/servlets/purl/1744308. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1744308,
title = {Materials Data on TlSn3 by Materials Project},
author = {The Materials Project},
abstractNote = {TlSn3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tl is bonded to twelve Sn atoms to form a mixture of distorted corner and face-sharing TlSn12 cuboctahedra. There are six shorter (3.36 Å) and six longer (3.57 Å) Tl–Sn bond lengths. There are three inequivalent Sn sites. In the first Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Tl and eight Sn atoms. There are two shorter (3.24 Å) and six longer (3.49 Å) Sn–Sn bond lengths. In the second Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Tl and eight Sn atoms. All Sn–Sn bond lengths are 3.49 Å. In the third Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Tl and eight Sn atoms. Both Sn–Sn bond lengths are 3.49 Å.},
doi = {10.17188/1744308},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}