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Title: Materials Data on TcIrOs by Materials Project

Abstract

TcOsIr is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Tc3- is bonded in a body-centered cubic geometry to four equivalent Os1- and four equivalent Ir4+ atoms. All Tc–Os bond lengths are 2.56 Å. All Tc–Ir bond lengths are 2.56 Å. Os1- is bonded to four equivalent Tc3- atoms to form OsTc4 tetrahedra that share corners with four equivalent IrTc4 tetrahedra, corners with twelve equivalent OsTc4 tetrahedra, and edges with six equivalent IrTc4 tetrahedra. Ir4+ is bonded to four equivalent Tc3- atoms to form IrTc4 tetrahedra that share corners with four equivalent OsTc4 tetrahedra, corners with twelve equivalent IrTc4 tetrahedra, and edges with six equivalent OsTc4 tetrahedra.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-631320
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; TcIrOs; Ir-Os-Tc
OSTI Identifier:
1279067
DOI:
10.17188/1279067

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on TcIrOs by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279067.
Persson, Kristin, & Project, Materials. Materials Data on TcIrOs by Materials Project. United States. doi:10.17188/1279067.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on TcIrOs by Materials Project". United States. doi:10.17188/1279067. https://www.osti.gov/servlets/purl/1279067. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1279067,
title = {Materials Data on TcIrOs by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {TcOsIr is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Tc3- is bonded in a body-centered cubic geometry to four equivalent Os1- and four equivalent Ir4+ atoms. All Tc–Os bond lengths are 2.56 Å. All Tc–Ir bond lengths are 2.56 Å. Os1- is bonded to four equivalent Tc3- atoms to form OsTc4 tetrahedra that share corners with four equivalent IrTc4 tetrahedra, corners with twelve equivalent OsTc4 tetrahedra, and edges with six equivalent IrTc4 tetrahedra. Ir4+ is bonded to four equivalent Tc3- atoms to form IrTc4 tetrahedra that share corners with four equivalent OsTc4 tetrahedra, corners with twelve equivalent IrTc4 tetrahedra, and edges with six equivalent OsTc4 tetrahedra.},
doi = {10.17188/1279067},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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