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Title: Materials Data on YSeBr by Materials Project

Abstract

YSeBr is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Y3+ is bonded to four equivalent Se2- and six equivalent Br1- atoms to form a mixture of distorted corner and face-sharing YSe4Br6 tetrahedra. All Y–Se bond lengths are 3.03 Å. All Y–Br bond lengths are 3.50 Å. Se2- is bonded in a body-centered cubic geometry to four equivalent Y3+ and four equivalent Br1- atoms. All Se–Br bond lengths are 3.03 Å. Br1- is bonded in a 10-coordinate geometry to six equivalent Y3+ and four equivalent Se2- atoms.

Publication Date:
Other Number(s):
mp-1100439
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; YSeBr; Br-Se-Y
OSTI Identifier:
1722481
DOI:
https://doi.org/10.17188/1722481

Citation Formats

The Materials Project. Materials Data on YSeBr by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1722481.
The Materials Project. Materials Data on YSeBr by Materials Project. United States. doi:https://doi.org/10.17188/1722481
The Materials Project. 2020. "Materials Data on YSeBr by Materials Project". United States. doi:https://doi.org/10.17188/1722481. https://www.osti.gov/servlets/purl/1722481. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1722481,
title = {Materials Data on YSeBr by Materials Project},
author = {The Materials Project},
abstractNote = {YSeBr is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Y3+ is bonded to four equivalent Se2- and six equivalent Br1- atoms to form a mixture of distorted corner and face-sharing YSe4Br6 tetrahedra. All Y–Se bond lengths are 3.03 Å. All Y–Br bond lengths are 3.50 Å. Se2- is bonded in a body-centered cubic geometry to four equivalent Y3+ and four equivalent Br1- atoms. All Se–Br bond lengths are 3.03 Å. Br1- is bonded in a 10-coordinate geometry to six equivalent Y3+ and four equivalent Se2- atoms.},
doi = {10.17188/1722481},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}