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Title: Materials Data on TaS2 by Materials Project

Abstract

TaS2 is Molybdenite-like structured and crystallizes in the trigonal R3m space group. The structure is two-dimensional and consists of three TaS2 sheets oriented in the (0, 0, 1) direction. Ta4+ is bonded to six equivalent S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. All Ta–S bond lengths are 2.48 Å. S2- is bonded in a 3-coordinate geometry to three equivalent Ta4+ atoms.

Publication Date:
Other Number(s):
mp-10014
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; TaS2; S-Ta
OSTI Identifier:
1184824
DOI:
https://doi.org/10.17188/1184824

Citation Formats

The Materials Project. Materials Data on TaS2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1184824.
The Materials Project. Materials Data on TaS2 by Materials Project. United States. doi:https://doi.org/10.17188/1184824
The Materials Project. 2020. "Materials Data on TaS2 by Materials Project". United States. doi:https://doi.org/10.17188/1184824. https://www.osti.gov/servlets/purl/1184824. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1184824,
title = {Materials Data on TaS2 by Materials Project},
author = {The Materials Project},
abstractNote = {TaS2 is Molybdenite-like structured and crystallizes in the trigonal R3m space group. The structure is two-dimensional and consists of three TaS2 sheets oriented in the (0, 0, 1) direction. Ta4+ is bonded to six equivalent S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. All Ta–S bond lengths are 2.48 Å. S2- is bonded in a 3-coordinate geometry to three equivalent Ta4+ atoms.},
doi = {10.17188/1184824},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}