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Title: Materials Data on TaReSi by Materials Project

Abstract

TaReSi crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Ta is bonded in a 11-coordinate geometry to six equivalent Re and five Si atoms. There are two shorter (2.86 Å) and four longer (2.94 Å) Ta–Re bond lengths. There are four shorter (2.67 Å) and one longer (2.77 Å) Ta–Si bond lengths. Re is bonded in a 10-coordinate geometry to six equivalent Ta and four Si atoms. There are two shorter (2.43 Å) and two longer (2.59 Å) Re–Si bond lengths. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to three equivalent Ta and six equivalent Re atoms. In the second Si site, Si is bonded in a 9-coordinate geometry to six equivalent Ta and three equivalent Re atoms.

Authors:
Publication Date:
Other Number(s):
mp-1079158
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; TaReSi; Re-Si-Ta
OSTI Identifier:
1654905
DOI:
https://doi.org/10.17188/1654905

Citation Formats

The Materials Project. Materials Data on TaReSi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1654905.
The Materials Project. Materials Data on TaReSi by Materials Project. United States. doi:https://doi.org/10.17188/1654905
The Materials Project. 2020. "Materials Data on TaReSi by Materials Project". United States. doi:https://doi.org/10.17188/1654905. https://www.osti.gov/servlets/purl/1654905. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1654905,
title = {Materials Data on TaReSi by Materials Project},
author = {The Materials Project},
abstractNote = {TaReSi crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Ta is bonded in a 11-coordinate geometry to six equivalent Re and five Si atoms. There are two shorter (2.86 Å) and four longer (2.94 Å) Ta–Re bond lengths. There are four shorter (2.67 Å) and one longer (2.77 Å) Ta–Si bond lengths. Re is bonded in a 10-coordinate geometry to six equivalent Ta and four Si atoms. There are two shorter (2.43 Å) and two longer (2.59 Å) Re–Si bond lengths. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to three equivalent Ta and six equivalent Re atoms. In the second Si site, Si is bonded in a 9-coordinate geometry to six equivalent Ta and three equivalent Re atoms.},
doi = {10.17188/1654905},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}