Materials Data on NaEr3 by Materials Project
Abstract
NaEr3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a distorted body-centered cubic geometry to fourteen Er atoms. There are eight shorter (3.42 Å) and six longer (3.95 Å) Na–Er bond lengths. There are two inequivalent Er sites. In the first Er site, Er is bonded in a distorted body-centered cubic geometry to four equivalent Na and four equivalent Er atoms. All Er–Er bond lengths are 3.42 Å. In the second Er site, Er is bonded in a 8-coordinate geometry to six equivalent Na and eight equivalent Er atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-976405
- 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; NaEr3; Er-Na
- OSTI Identifier:
- 1315210
- DOI:
- https://doi.org/10.17188/1315210
Citation Formats
The Materials Project. Materials Data on NaEr3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1315210.
The Materials Project. Materials Data on NaEr3 by Materials Project. United States. doi:https://doi.org/10.17188/1315210
The Materials Project. 2020.
"Materials Data on NaEr3 by Materials Project". United States. doi:https://doi.org/10.17188/1315210. https://www.osti.gov/servlets/purl/1315210. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1315210,
title = {Materials Data on NaEr3 by Materials Project},
author = {The Materials Project},
abstractNote = {NaEr3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a distorted body-centered cubic geometry to fourteen Er atoms. There are eight shorter (3.42 Å) and six longer (3.95 Å) Na–Er bond lengths. There are two inequivalent Er sites. In the first Er site, Er is bonded in a distorted body-centered cubic geometry to four equivalent Na and four equivalent Er atoms. All Er–Er bond lengths are 3.42 Å. In the second Er site, Er is bonded in a 8-coordinate geometry to six equivalent Na and eight equivalent Er atoms.},
doi = {10.17188/1315210},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 23 00:00:00 EDT 2020},
month = {Thu Jul 23 00:00:00 EDT 2020}
}
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