U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cr2N by Materials Project
Abstract
Cr2N is beta Vanadium nitride structured and crystallizes in the trigonal P-31m space group. The structure is three-dimensional. Cr is bonded in a distorted T-shaped geometry to three N atoms. There is one shorter (1.92 Å) and two longer (1.94 Å) Cr–N bond length. There are two inequivalent N sites. In the first N site, N is bonded to six equivalent Cr atoms to form corner-sharing NCr6 octahedra. The corner-sharing octahedral tilt angles are 48°. In the second N site, N is bonded to six equivalent Cr atoms to form a mixture of edge and corner-sharing NCr6 octahedra. The corner-sharing octahedral tilt angles are 48°.
- Publication Date:
- Other Number(s):
- mp-8780
- 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; Cr-N; Cr2N; crystal structure
- OSTI Identifier:
- 1312709
- DOI:
- https://doi.org/10.17188/1312709
Citation Formats
Materials Data on Cr2N by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1312709.
Materials Data on Cr2N by Materials Project. United States. doi:https://doi.org/10.17188/1312709
2020.
"Materials Data on Cr2N by Materials Project". United States. doi:https://doi.org/10.17188/1312709. https://www.osti.gov/servlets/purl/1312709. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1312709,
title = {Materials Data on Cr2N by Materials Project},
abstractNote = {Cr2N is beta Vanadium nitride structured and crystallizes in the trigonal P-31m space group. The structure is three-dimensional. Cr is bonded in a distorted T-shaped geometry to three N atoms. There is one shorter (1.92 Å) and two longer (1.94 Å) Cr–N bond length. There are two inequivalent N sites. In the first N site, N is bonded to six equivalent Cr atoms to form corner-sharing NCr6 octahedra. The corner-sharing octahedral tilt angles are 48°. In the second N site, N is bonded to six equivalent Cr atoms to form a mixture of edge and corner-sharing NCr6 octahedra. The corner-sharing octahedral tilt angles are 48°.},
doi = {10.17188/1312709},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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