U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ca2CoN2 by Materials Project
Abstract
Ca2CoN2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ca2+ is bonded to five equivalent N3- atoms to form a mixture of corner and edge-sharing CaN5 square pyramids. There are one shorter (2.49 Å) and four longer (2.52 Å) Ca–N bond lengths. Co2+ is bonded in a linear geometry to two equivalent N3- atoms. Both Co–N bond lengths are 1.76 Å. N3- is bonded to five equivalent Ca2+ and one Co2+ atom to form a mixture of corner and edge-sharing NCa5Co octahedra. The corner-sharing octahedra tilt angles range from 0–4°.
- Publication Date:
- Other Number(s):
- mp-1029532
- 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; Ca-Co-N; Ca2CoN2; crystal structure
- OSTI Identifier:
- 1713381
- DOI:
- https://doi.org/10.17188/1713381
Citation Formats
Materials Data on Ca2CoN2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1713381.
Materials Data on Ca2CoN2 by Materials Project. United States. doi:https://doi.org/10.17188/1713381
2020.
"Materials Data on Ca2CoN2 by Materials Project". United States. doi:https://doi.org/10.17188/1713381. https://www.osti.gov/servlets/purl/1713381. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1713381,
title = {Materials Data on Ca2CoN2 by Materials Project},
abstractNote = {Ca2CoN2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ca2+ is bonded to five equivalent N3- atoms to form a mixture of corner and edge-sharing CaN5 square pyramids. There are one shorter (2.49 Å) and four longer (2.52 Å) Ca–N bond lengths. Co2+ is bonded in a linear geometry to two equivalent N3- atoms. Both Co–N bond lengths are 1.76 Å. N3- is bonded to five equivalent Ca2+ and one Co2+ atom to form a mixture of corner and edge-sharing NCa5Co octahedra. The corner-sharing octahedra tilt angles range from 0–4°.},
doi = {10.17188/1713381},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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