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Title: Materials Data on TaSe2 by Materials Project

Abstract

TaSe2 is Molybdenite-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of four TaSe2 sheets oriented in the (0, 0, 1) direction. Ta4+ is bonded to six equivalent Se2- atoms to form edge-sharing TaSe6 octahedra. All Ta–Se bond lengths are 2.61 Å. Se2- is bonded in a 3-coordinate geometry to three equivalent Ta4+ atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-501
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; TaSe2; Se-Ta
OSTI Identifier:
1208559
DOI:
10.17188/1208559

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on TaSe2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1208559.
Persson, Kristin, & Project, Materials. Materials Data on TaSe2 by Materials Project. United States. doi:10.17188/1208559.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on TaSe2 by Materials Project". United States. doi:10.17188/1208559. https://www.osti.gov/servlets/purl/1208559. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1208559,
title = {Materials Data on TaSe2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {TaSe2 is Molybdenite-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of four TaSe2 sheets oriented in the (0, 0, 1) direction. Ta4+ is bonded to six equivalent Se2- atoms to form edge-sharing TaSe6 octahedra. All Ta–Se bond lengths are 2.61 Å. Se2- is bonded in a 3-coordinate geometry to three equivalent Ta4+ atoms.},
doi = {10.17188/1208559},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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