U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on PrMg3 by Materials Project
Abstract
Mg3Pr is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 8-coordinate geometry to eight equivalent Mg and six equivalent Pr atoms. All Mg–Mg bond lengths are 3.22 Å. All Mg–Pr bond lengths are 3.72 Å. In the second Mg site, Mg is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Pr atoms. All Mg–Pr bond lengths are 3.22 Å. Pr is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms.
- Publication Date:
- Other Number(s):
- mp-428
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Mg-Pr; PrMg3; crystal structure
- OSTI Identifier:
- 1208028
- DOI:
- https://doi.org/10.17188/1208028
Citation Formats
Materials Data on PrMg3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1208028.
Materials Data on PrMg3 by Materials Project. United States. doi:https://doi.org/10.17188/1208028
2020.
"Materials Data on PrMg3 by Materials Project". United States. doi:https://doi.org/10.17188/1208028. https://www.osti.gov/servlets/purl/1208028. Pub date:Wed Jul 15 04:00:00 UTC 2020
@article{osti_1208028,
title = {Materials Data on PrMg3 by Materials Project},
abstractNote = {Mg3Pr is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 8-coordinate geometry to eight equivalent Mg and six equivalent Pr atoms. All Mg–Mg bond lengths are 3.22 Å. All Mg–Pr bond lengths are 3.72 Å. In the second Mg site, Mg is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Pr atoms. All Mg–Pr bond lengths are 3.22 Å. Pr is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms.},
doi = {10.17188/1208028},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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