U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LaCoN3 by Materials Project
Abstract
LaCoN3 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. La3+ is bonded in a 5-coordinate geometry to five N+1.67- atoms. There are a spread of La–N bond distances ranging from 2.42–2.81 Å. Co2+ is bonded in a distorted trigonal planar geometry to three N+1.67- atoms. There are a spread of Co–N bond distances ranging from 1.68–1.91 Å. There are three inequivalent N+1.67- sites. In the first N+1.67- site, N+1.67- is bonded to three equivalent La3+ and two equivalent Co2+ atoms to form a mixture of edge and corner-sharing NLa3Co2 trigonal bipyramids. In the second N+1.67- site, N+1.67- is bonded in a 1-coordinate geometry to one Co2+ and one N+1.67- atom. The N–N bond length is 1.18 Å. In the third N+1.67- site, N+1.67- is bonded in a 3-coordinate geometry to two equivalent La3+ and one N+1.67- atom.
- Publication Date:
- Other Number(s):
- mp-989643
- 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; Co-La-N; LaCoN3; crystal structure
- OSTI Identifier:
- 1316936
- DOI:
- https://doi.org/10.17188/1316936
Citation Formats
Materials Data on LaCoN3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1316936.
Materials Data on LaCoN3 by Materials Project. United States. doi:https://doi.org/10.17188/1316936
2020.
"Materials Data on LaCoN3 by Materials Project". United States. doi:https://doi.org/10.17188/1316936. https://www.osti.gov/servlets/purl/1316936. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1316936,
title = {Materials Data on LaCoN3 by Materials Project},
abstractNote = {LaCoN3 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. La3+ is bonded in a 5-coordinate geometry to five N+1.67- atoms. There are a spread of La–N bond distances ranging from 2.42–2.81 Å. Co2+ is bonded in a distorted trigonal planar geometry to three N+1.67- atoms. There are a spread of Co–N bond distances ranging from 1.68–1.91 Å. There are three inequivalent N+1.67- sites. In the first N+1.67- site, N+1.67- is bonded to three equivalent La3+ and two equivalent Co2+ atoms to form a mixture of edge and corner-sharing NLa3Co2 trigonal bipyramids. In the second N+1.67- site, N+1.67- is bonded in a 1-coordinate geometry to one Co2+ and one N+1.67- atom. The N–N bond length is 1.18 Å. In the third N+1.67- site, N+1.67- is bonded in a 3-coordinate geometry to two equivalent La3+ and one N+1.67- atom.},
doi = {10.17188/1316936},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}