U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on NaSmO2 by Materials Project
Abstract
NaSmO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Na1+ is bonded to six equivalent O2- atoms to form NaO6 octahedra that share corners with six equivalent SmO6 octahedra, edges with six equivalent NaO6 octahedra, and edges with six equivalent SmO6 octahedra. The corner-sharing octahedral tilt angles are 8°. All Na–O bond lengths are 2.59 Å. Sm3+ is bonded to six equivalent O2- atoms to form SmO6 octahedra that share corners with six equivalent NaO6 octahedra, edges with six equivalent NaO6 octahedra, and edges with six equivalent SmO6 octahedra. The corner-sharing octahedral tilt angles are 8°. All Sm–O bond lengths are 2.37 Å. O2- is bonded to three equivalent Na1+ and three equivalent Sm3+ atoms to form a mixture of edge and corner-sharing ONa3Sm3 octahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-756034
- 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; Na-O-Sm; NaSmO2; crystal structure
- OSTI Identifier:
- 1290326
- DOI:
- https://doi.org/10.17188/1290326
Citation Formats
Materials Data on NaSmO2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1290326.
Materials Data on NaSmO2 by Materials Project. United States. doi:https://doi.org/10.17188/1290326
2020.
"Materials Data on NaSmO2 by Materials Project". United States. doi:https://doi.org/10.17188/1290326. https://www.osti.gov/servlets/purl/1290326. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1290326,
title = {Materials Data on NaSmO2 by Materials Project},
abstractNote = {NaSmO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Na1+ is bonded to six equivalent O2- atoms to form NaO6 octahedra that share corners with six equivalent SmO6 octahedra, edges with six equivalent NaO6 octahedra, and edges with six equivalent SmO6 octahedra. The corner-sharing octahedral tilt angles are 8°. All Na–O bond lengths are 2.59 Å. Sm3+ is bonded to six equivalent O2- atoms to form SmO6 octahedra that share corners with six equivalent NaO6 octahedra, edges with six equivalent NaO6 octahedra, and edges with six equivalent SmO6 octahedra. The corner-sharing octahedral tilt angles are 8°. All Sm–O bond lengths are 2.37 Å. O2- is bonded to three equivalent Na1+ and three equivalent Sm3+ atoms to form a mixture of edge and corner-sharing ONa3Sm3 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1290326},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}