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Title: Materials Data on YFe5 by Materials Project

Abstract

YFe5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Y is bonded in a 6-coordinate geometry to eighteen Fe atoms. There are six shorter (2.93 Å) and twelve longer (3.21 Å) Y–Fe bond lengths. There are two inequivalent Fe sites. In the first Fe site, Fe is bonded to four equivalent Y and eight Fe atoms to form a mixture of corner, edge, and face-sharing FeY4Fe8 cuboctahedra. There are four shorter (2.45 Å) and four longer (2.54 Å) Fe–Fe bond lengths. In the second Fe site, Fe is bonded in a 12-coordinate geometry to three equivalent Y and six equivalent Fe atoms.

Publication Date:
Other Number(s):
mp-11385
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; YFe5; Fe-Y
OSTI Identifier:
1187790
DOI:
https://doi.org/10.17188/1187790

Citation Formats

The Materials Project. Materials Data on YFe5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1187790.
The Materials Project. Materials Data on YFe5 by Materials Project. United States. doi:https://doi.org/10.17188/1187790
The Materials Project. 2020. "Materials Data on YFe5 by Materials Project". United States. doi:https://doi.org/10.17188/1187790. https://www.osti.gov/servlets/purl/1187790. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1187790,
title = {Materials Data on YFe5 by Materials Project},
author = {The Materials Project},
abstractNote = {YFe5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Y is bonded in a 6-coordinate geometry to eighteen Fe atoms. There are six shorter (2.93 Å) and twelve longer (3.21 Å) Y–Fe bond lengths. There are two inequivalent Fe sites. In the first Fe site, Fe is bonded to four equivalent Y and eight Fe atoms to form a mixture of corner, edge, and face-sharing FeY4Fe8 cuboctahedra. There are four shorter (2.45 Å) and four longer (2.54 Å) Fe–Fe bond lengths. In the second Fe site, Fe is bonded in a 12-coordinate geometry to three equivalent Y and six equivalent Fe atoms.},
doi = {10.17188/1187790},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}