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Title: Materials Data on Y2FeB by Materials Project

Abstract

Y2FeB crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded to four equivalent Fe and six equivalent B atoms to form distorted YFe4B6 tetrahedra that share corners with eighteen YB4 tetrahedra and faces with sixteen YFe4B6 tetrahedra. All Y–Fe bond lengths are 2.79 Å. All Y–B bond lengths are 3.23 Å. In the second Y site, Y is bonded to four equivalent B atoms to form distorted YB4 tetrahedra that share corners with twenty-four YB4 tetrahedra and faces with four equivalent YFe4B6 tetrahedra. All Y–B bond lengths are 2.79 Å. Fe is bonded in a distorted body-centered cubic geometry to four equivalent Y and four equivalent B atoms. All Fe–B bond lengths are 2.79 Å. B is bonded in a 8-coordinate geometry to ten Y and four equivalent Fe atoms.

Publication Date:
Other Number(s):
mp-631661
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; Y2FeB; B-Fe-Y
OSTI Identifier:
1279280
DOI:
10.17188/1279280

Citation Formats

The Materials Project. Materials Data on Y2FeB by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279280.
The Materials Project. Materials Data on Y2FeB by Materials Project. United States. doi:10.17188/1279280.
The Materials Project. 2020. "Materials Data on Y2FeB by Materials Project". United States. doi:10.17188/1279280. https://www.osti.gov/servlets/purl/1279280. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1279280,
title = {Materials Data on Y2FeB by Materials Project},
author = {The Materials Project},
abstractNote = {Y2FeB crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded to four equivalent Fe and six equivalent B atoms to form distorted YFe4B6 tetrahedra that share corners with eighteen YB4 tetrahedra and faces with sixteen YFe4B6 tetrahedra. All Y–Fe bond lengths are 2.79 Å. All Y–B bond lengths are 3.23 Å. In the second Y site, Y is bonded to four equivalent B atoms to form distorted YB4 tetrahedra that share corners with twenty-four YB4 tetrahedra and faces with four equivalent YFe4B6 tetrahedra. All Y–B bond lengths are 2.79 Å. Fe is bonded in a distorted body-centered cubic geometry to four equivalent Y and four equivalent B atoms. All Fe–B bond lengths are 2.79 Å. B is bonded in a 8-coordinate geometry to ten Y and four equivalent Fe atoms.},
doi = {10.17188/1279280},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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