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Title: Materials Data on Dy6Fe23 by Materials Project

Abstract

Dy6Fe23 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a 12-coordinate geometry to twelve Fe atoms. There are a spread of Dy–Fe bond distances ranging from 2.89–3.05 Å. There are four inequivalent Fe sites. In the first Fe site, Fe is bonded in a distorted q6 geometry to three equivalent Dy and nine Fe atoms. There are a spread of Fe–Fe bond distances ranging from 2.46–2.61 Å. In the second Fe site, Fe is bonded in a body-centered cubic geometry to eight equivalent Fe atoms. All Fe–Fe bond lengths are 2.54 Å. In the third Fe site, Fe is bonded to four equivalent Dy and eight Fe atoms to form a mixture of face and corner-sharing FeDy4Fe8 cuboctahedra. All Fe–Fe bond lengths are 2.63 Å. In the fourth Fe site, Fe is bonded in a 10-coordinate geometry to three equivalent Dy and ten Fe atoms. All Fe–Fe bond lengths are 2.93 Å.

Authors:
Publication Date:
Other Number(s):
mp-1194186
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; Dy6Fe23; Dy-Fe
OSTI Identifier:
1692983
DOI:
https://doi.org/10.17188/1692983

Citation Formats

The Materials Project. Materials Data on Dy6Fe23 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1692983.
The Materials Project. Materials Data on Dy6Fe23 by Materials Project. United States. doi:https://doi.org/10.17188/1692983
The Materials Project. 2020. "Materials Data on Dy6Fe23 by Materials Project". United States. doi:https://doi.org/10.17188/1692983. https://www.osti.gov/servlets/purl/1692983. Pub date:Thu Jun 04 00:00:00 EDT 2020
@article{osti_1692983,
title = {Materials Data on Dy6Fe23 by Materials Project},
author = {The Materials Project},
abstractNote = {Dy6Fe23 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a 12-coordinate geometry to twelve Fe atoms. There are a spread of Dy–Fe bond distances ranging from 2.89–3.05 Å. There are four inequivalent Fe sites. In the first Fe site, Fe is bonded in a distorted q6 geometry to three equivalent Dy and nine Fe atoms. There are a spread of Fe–Fe bond distances ranging from 2.46–2.61 Å. In the second Fe site, Fe is bonded in a body-centered cubic geometry to eight equivalent Fe atoms. All Fe–Fe bond lengths are 2.54 Å. In the third Fe site, Fe is bonded to four equivalent Dy and eight Fe atoms to form a mixture of face and corner-sharing FeDy4Fe8 cuboctahedra. All Fe–Fe bond lengths are 2.63 Å. In the fourth Fe site, Fe is bonded in a 10-coordinate geometry to three equivalent Dy and ten Fe atoms. All Fe–Fe bond lengths are 2.93 Å.},
doi = {10.17188/1692983},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {6}
}