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Title: Materials Data on TeRuSe by Materials Project

Abstract

RuTeSe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ru4+ is bonded to four equivalent Se2- atoms to form distorted RuSe4 tetrahedra that share corners with four equivalent TeSe4 tetrahedra, corners with twelve equivalent RuSe4 tetrahedra, and edges with six equivalent TeSe4 tetrahedra. All Ru–Se bond lengths are 2.77 Å. Te2- is bonded to four equivalent Se2- atoms to form distorted TeSe4 tetrahedra that share corners with four equivalent RuSe4 tetrahedra, corners with twelve equivalent TeSe4 tetrahedra, and edges with six equivalent RuSe4 tetrahedra. All Te–Se bond lengths are 2.77 Å. Se2- is bonded in a body-centered cubic geometry to four equivalent Ru4+ and four equivalent Te2- atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-631381
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; TeRuSe; Ru-Se-Te
OSTI Identifier:
1279110
DOI:
10.17188/1279110

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on TeRuSe by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279110.
Persson, Kristin, & Project, Materials. Materials Data on TeRuSe by Materials Project. United States. doi:10.17188/1279110.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on TeRuSe by Materials Project". United States. doi:10.17188/1279110. https://www.osti.gov/servlets/purl/1279110. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1279110,
title = {Materials Data on TeRuSe by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {RuTeSe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ru4+ is bonded to four equivalent Se2- atoms to form distorted RuSe4 tetrahedra that share corners with four equivalent TeSe4 tetrahedra, corners with twelve equivalent RuSe4 tetrahedra, and edges with six equivalent TeSe4 tetrahedra. All Ru–Se bond lengths are 2.77 Å. Te2- is bonded to four equivalent Se2- atoms to form distorted TeSe4 tetrahedra that share corners with four equivalent RuSe4 tetrahedra, corners with twelve equivalent TeSe4 tetrahedra, and edges with six equivalent RuSe4 tetrahedra. All Te–Se bond lengths are 2.77 Å. Se2- is bonded in a body-centered cubic geometry to four equivalent Ru4+ and four equivalent Te2- atoms.},
doi = {10.17188/1279110},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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