U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on SmNi5 by Materials Project
Abstract
SmNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Sm is bonded in a 6-coordinate geometry to eighteen Ni atoms. There are six shorter (2.84 Å) and twelve longer (3.16 Å) Sm–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Sm and six equivalent Ni atoms. All Ni–Ni bond lengths are 2.43 Å. In the second Ni site, Ni is bonded to four equivalent Sm and eight Ni atoms to form a mixture of edge, face, and corner-sharing NiSm4Ni8 cuboctahedra. All Ni–Ni bond lengths are 2.46 Å.
- Publication Date:
- Other Number(s):
- mp-1075
- 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; Ni-Sm; SmNi5; crystal structure
- OSTI Identifier:
- 1187332
- DOI:
- https://doi.org/10.17188/1187332
Citation Formats
Materials Data on SmNi5 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1187332.
Materials Data on SmNi5 by Materials Project. United States. doi:https://doi.org/10.17188/1187332
2017.
"Materials Data on SmNi5 by Materials Project". United States. doi:https://doi.org/10.17188/1187332. https://www.osti.gov/servlets/purl/1187332. Pub date:Tue Jul 18 04:00:00 UTC 2017
@article{osti_1187332,
title = {Materials Data on SmNi5 by Materials Project},
abstractNote = {SmNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Sm is bonded in a 6-coordinate geometry to eighteen Ni atoms. There are six shorter (2.84 Å) and twelve longer (3.16 Å) Sm–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Sm and six equivalent Ni atoms. All Ni–Ni bond lengths are 2.43 Å. In the second Ni site, Ni is bonded to four equivalent Sm and eight Ni atoms to form a mixture of edge, face, and corner-sharing NiSm4Ni8 cuboctahedra. All Ni–Ni bond lengths are 2.46 Å.},
doi = {10.17188/1187332},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {7}
}
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