U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on NdInCu by Materials Project
Abstract
NdCuIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Nd is bonded in a 11-coordinate geometry to five Cu and six equivalent In atoms. There are four shorter (3.07 Å) and one longer (3.14 Å) Nd–Cu bond lengths. There are two shorter (3.29 Å) and four longer (3.42 Å) Nd–In bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 9-coordinate geometry to six equivalent Nd and three equivalent In atoms. All Cu–In bond lengths are 2.91 Å. In the second Cu site, Cu is bonded in a 9-coordinate geometry to three equivalent Nd and six equivalent In atoms. All Cu–In bond lengths are 2.79 Å. In is bonded in a 12-coordinate geometry to six equivalent Nd and four Cu atoms.
- Publication Date:
- Other Number(s):
- mp-22696
- 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-In-Nd; NdInCu; crystal structure
- OSTI Identifier:
- 1198901
- DOI:
- https://doi.org/10.17188/1198901
Citation Formats
Materials Data on NdInCu by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1198901.
Materials Data on NdInCu by Materials Project. United States. doi:https://doi.org/10.17188/1198901
2020.
"Materials Data on NdInCu by Materials Project". United States. doi:https://doi.org/10.17188/1198901. https://www.osti.gov/servlets/purl/1198901. Pub date:Sat May 02 04:00:00 UTC 2020
@article{osti_1198901,
title = {Materials Data on NdInCu by Materials Project},
abstractNote = {NdCuIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Nd is bonded in a 11-coordinate geometry to five Cu and six equivalent In atoms. There are four shorter (3.07 Å) and one longer (3.14 Å) Nd–Cu bond lengths. There are two shorter (3.29 Å) and four longer (3.42 Å) Nd–In bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 9-coordinate geometry to six equivalent Nd and three equivalent In atoms. All Cu–In bond lengths are 2.91 Å. In the second Cu site, Cu is bonded in a 9-coordinate geometry to three equivalent Nd and six equivalent In atoms. All Cu–In bond lengths are 2.79 Å. In is bonded in a 12-coordinate geometry to six equivalent Nd and four Cu atoms.},
doi = {10.17188/1198901},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}