Materials Data on Nd(FeB)4 by Materials Project
Abstract
NdFe4B4 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Nd3+ is bonded in a 12-coordinate geometry to eight equivalent B3- atoms. There are four shorter (2.79 Å) and four longer (2.84 Å) Nd–B bond lengths. Fe+2.25+ is bonded in a 5-coordinate geometry to five equivalent B3- atoms. There are a spread of Fe–B bond distances ranging from 2.01–2.38 Å. B3- is bonded in a 5-coordinate geometry to two equivalent Nd3+, five equivalent Fe+2.25+, and one B3- atom. The B–B bond length is 1.76 Å.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1106404
- 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; Nd(FeB)4; B-Fe-Nd
- OSTI Identifier:
- 1715971
- DOI:
- https://doi.org/10.17188/1715971
Citation Formats
The Materials Project. Materials Data on Nd(FeB)4 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1715971.
The Materials Project. Materials Data on Nd(FeB)4 by Materials Project. United States. doi:https://doi.org/10.17188/1715971
The Materials Project. 2019.
"Materials Data on Nd(FeB)4 by Materials Project". United States. doi:https://doi.org/10.17188/1715971. https://www.osti.gov/servlets/purl/1715971. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1715971,
title = {Materials Data on Nd(FeB)4 by Materials Project},
author = {The Materials Project},
abstractNote = {NdFe4B4 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Nd3+ is bonded in a 12-coordinate geometry to eight equivalent B3- atoms. There are four shorter (2.79 Å) and four longer (2.84 Å) Nd–B bond lengths. Fe+2.25+ is bonded in a 5-coordinate geometry to five equivalent B3- atoms. There are a spread of Fe–B bond distances ranging from 2.01–2.38 Å. B3- is bonded in a 5-coordinate geometry to two equivalent Nd3+, five equivalent Fe+2.25+, and one B3- atom. The B–B bond length is 1.76 Å.},
doi = {10.17188/1715971},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri Jan 11 00:00:00 EST 2019},
month = {Fri Jan 11 00:00:00 EST 2019}
}
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