Materials Data on PmAg3 by Materials Project
Abstract
PmAg3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pm is bonded in a distorted body-centered cubic geometry to fourteen Ag atoms. There are eight shorter (3.06 Å) and six longer (3.53 Å) Pm–Ag bond lengths. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded to four equivalent Pm and four equivalent Ag atoms to form a mixture of distorted face, edge, and corner-sharing AgPm4Ag4 tetrahedra. All Ag–Ag bond lengths are 3.06 Å. In the second Ag site, Ag is bonded in a 8-coordinate geometry to six equivalent Pm and eight equivalent Ag atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-862878
- 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; PmAg3; Ag-Pm
- OSTI Identifier:
- 1309693
- DOI:
- https://doi.org/10.17188/1309693
Citation Formats
The Materials Project. Materials Data on PmAg3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1309693.
The Materials Project. Materials Data on PmAg3 by Materials Project. United States. doi:https://doi.org/10.17188/1309693
The Materials Project. 2020.
"Materials Data on PmAg3 by Materials Project". United States. doi:https://doi.org/10.17188/1309693. https://www.osti.gov/servlets/purl/1309693. Pub date:Tue Jul 21 00:00:00 EDT 2020
@article{osti_1309693,
title = {Materials Data on PmAg3 by Materials Project},
author = {The Materials Project},
abstractNote = {PmAg3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pm is bonded in a distorted body-centered cubic geometry to fourteen Ag atoms. There are eight shorter (3.06 Å) and six longer (3.53 Å) Pm–Ag bond lengths. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded to four equivalent Pm and four equivalent Ag atoms to form a mixture of distorted face, edge, and corner-sharing AgPm4Ag4 tetrahedra. All Ag–Ag bond lengths are 3.06 Å. In the second Ag site, Ag is bonded in a 8-coordinate geometry to six equivalent Pm and eight equivalent Ag atoms.},
doi = {10.17188/1309693},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Tue Jul 21 00:00:00 EDT 2020},
month = {Tue Jul 21 00:00:00 EDT 2020}
}
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