Materials Data on Ho6Fe23 by Materials Project
Abstract
Ho6Fe23 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ho is bonded in a 12-coordinate geometry to twelve Fe atoms. There are a spread of Ho–Fe bond distances ranging from 2.89–3.03 Å. There are four inequivalent Fe sites. In the first Fe site, Fe is bonded in a 10-coordinate geometry to three equivalent Ho and ten Fe atoms. There are a spread of Fe–Fe bond distances ranging from 2.52–2.91 Å. In the second Fe site, Fe is bonded in a body-centered cubic geometry to eight equivalent Fe atoms. In the third Fe site, Fe is bonded to four equivalent Ho and eight Fe atoms to form a mixture of face and corner-sharing FeHo4Fe8 cuboctahedra. All Fe–Fe bond lengths are 2.45 Å. In the fourth Fe site, Fe is bonded in a distorted q6 geometry to three equivalent Ho and nine Fe atoms. All Fe–Fe bond lengths are 2.53 Å.
- Authors:
- Publication Date:
- Other Number(s):
- mp-2759
- 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; Ho6Fe23; Fe-Ho
- OSTI Identifier:
- 1201803
- DOI:
- https://doi.org/10.17188/1201803
Citation Formats
The Materials Project. Materials Data on Ho6Fe23 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1201803.
The Materials Project. Materials Data on Ho6Fe23 by Materials Project. United States. doi:https://doi.org/10.17188/1201803
The Materials Project. 2020.
"Materials Data on Ho6Fe23 by Materials Project". United States. doi:https://doi.org/10.17188/1201803. https://www.osti.gov/servlets/purl/1201803. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1201803,
title = {Materials Data on Ho6Fe23 by Materials Project},
author = {The Materials Project},
abstractNote = {Ho6Fe23 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ho is bonded in a 12-coordinate geometry to twelve Fe atoms. There are a spread of Ho–Fe bond distances ranging from 2.89–3.03 Å. There are four inequivalent Fe sites. In the first Fe site, Fe is bonded in a 10-coordinate geometry to three equivalent Ho and ten Fe atoms. There are a spread of Fe–Fe bond distances ranging from 2.52–2.91 Å. In the second Fe site, Fe is bonded in a body-centered cubic geometry to eight equivalent Fe atoms. In the third Fe site, Fe is bonded to four equivalent Ho and eight Fe atoms to form a mixture of face and corner-sharing FeHo4Fe8 cuboctahedra. All Fe–Fe bond lengths are 2.45 Å. In the fourth Fe site, Fe is bonded in a distorted q6 geometry to three equivalent Ho and nine Fe atoms. All Fe–Fe bond lengths are 2.53 Å.},
doi = {10.17188/1201803},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat Jul 18 00:00:00 EDT 2020},
month = {Sat Jul 18 00:00:00 EDT 2020}
}