U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LaCu5 by Materials Project
Abstract
LaCu5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. La is bonded in a 6-coordinate geometry to eighteen Cu atoms. There are six shorter (2.98 Å) and twelve longer (3.31 Å) La–Cu bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded to four equivalent La and eight Cu atoms to form a mixture of corner, edge, and face-sharing CuLa4Cu8 cuboctahedra. There are four shorter (2.55 Å) and four longer (2.58 Å) Cu–Cu bond lengths. In the second Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent La and six equivalent Cu atoms.
- Publication Date:
- Other Number(s):
- mp-2613
- 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; Cu-La; LaCu5; crystal structure
- OSTI Identifier:
- 1201110
- DOI:
- https://doi.org/10.17188/1201110
Citation Formats
Materials Data on LaCu5 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1201110.
Materials Data on LaCu5 by Materials Project. United States. doi:https://doi.org/10.17188/1201110
2020.
"Materials Data on LaCu5 by Materials Project". United States. doi:https://doi.org/10.17188/1201110. https://www.osti.gov/servlets/purl/1201110. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1201110,
title = {Materials Data on LaCu5 by Materials Project},
abstractNote = {LaCu5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. La is bonded in a 6-coordinate geometry to eighteen Cu atoms. There are six shorter (2.98 Å) and twelve longer (3.31 Å) La–Cu bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded to four equivalent La and eight Cu atoms to form a mixture of corner, edge, and face-sharing CuLa4Cu8 cuboctahedra. There are four shorter (2.55 Å) and four longer (2.58 Å) Cu–Cu bond lengths. In the second Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent La and six equivalent Cu atoms.},
doi = {10.17188/1201110},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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