Materials Data on FeAg3 by Materials Project
Abstract
FeAg3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Fe is bonded in a distorted body-centered cubic geometry to fourteen Ag atoms. There are eight shorter (2.80 Å) and six longer (3.23 Å) Fe–Ag bond lengths. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded in a distorted body-centered cubic geometry to four equivalent Fe and four equivalent Ag atoms. All Ag–Ag bond lengths are 2.80 Å. In the second Ag site, Ag is bonded in a 8-coordinate geometry to six equivalent Fe and eight equivalent Ag atoms.
- Authors:
- Contributors:
-
Researcher:
- Publication Date:
- Other Number(s):
- mp-973533
- 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; FeAg3; Ag-Fe
- OSTI Identifier:
- 1282198
- DOI:
- 10.17188/1282198
Citation Formats
Persson, Kristin, and Project, Materials. Materials Data on FeAg3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1282198.
Persson, Kristin, & Project, Materials. Materials Data on FeAg3 by Materials Project. United States. doi:10.17188/1282198.
Persson, Kristin, and Project, Materials. 2020.
"Materials Data on FeAg3 by Materials Project". United States. doi:10.17188/1282198. https://www.osti.gov/servlets/purl/1282198. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1282198,
title = {Materials Data on FeAg3 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {FeAg3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Fe is bonded in a distorted body-centered cubic geometry to fourteen Ag atoms. There are eight shorter (2.80 Å) and six longer (3.23 Å) Fe–Ag bond lengths. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded in a distorted body-centered cubic geometry to four equivalent Fe and four equivalent Ag atoms. All Ag–Ag bond lengths are 2.80 Å. In the second Ag site, Ag is bonded in a 8-coordinate geometry to six equivalent Fe and eight equivalent Ag atoms.},
doi = {10.17188/1282198},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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