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Title: Materials Data on Tl2FeS2 by Materials Project

Abstract

FeTl2S2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Fe2+ is bonded in a linear geometry to two equivalent S2- atoms. Both Fe–S bond lengths are 2.13 Å. Tl1+ is bonded in a rectangular see-saw-like geometry to four equivalent S2- atoms. All Tl–S bond lengths are 3.12 Å. S2- is bonded to one Fe2+ and four equivalent Tl1+ atoms to form a mixture of distorted corner and edge-sharing STl4Fe square pyramids.

Authors:
Publication Date:
Other Number(s):
mp-1206916
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; Tl2FeS2; Fe-S-Tl
OSTI Identifier:
1710938
DOI:
https://doi.org/10.17188/1710938

Citation Formats

The Materials Project. Materials Data on Tl2FeS2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1710938.
The Materials Project. Materials Data on Tl2FeS2 by Materials Project. United States. doi:https://doi.org/10.17188/1710938
The Materials Project. 2019. "Materials Data on Tl2FeS2 by Materials Project". United States. doi:https://doi.org/10.17188/1710938. https://www.osti.gov/servlets/purl/1710938. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1710938,
title = {Materials Data on Tl2FeS2 by Materials Project},
author = {The Materials Project},
abstractNote = {FeTl2S2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Fe2+ is bonded in a linear geometry to two equivalent S2- atoms. Both Fe–S bond lengths are 2.13 Å. Tl1+ is bonded in a rectangular see-saw-like geometry to four equivalent S2- atoms. All Tl–S bond lengths are 3.12 Å. S2- is bonded to one Fe2+ and four equivalent Tl1+ atoms to form a mixture of distorted corner and edge-sharing STl4Fe square pyramids.},
doi = {10.17188/1710938},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}