U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Na3Rh(NO2)6 by Materials Project
Abstract
(Na(NO2)2)3Rh crystallizes in the trigonal R-3m space group. The structure is three-dimensional and consists of three rhodium molecules and one Na(NO2)2 framework. In the Na(NO2)2 framework, there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded to six O2- atoms to form a mixture of corner and face-sharing NaO6 octahedra. There are three shorter (2.36 Å) and three longer (2.41 Å) Na–O bond lengths. In the second Na1+ site, Na1+ is bonded to twelve O2- atoms to form a mixture of corner and face-sharing NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 45°. There are six shorter (2.66 Å) and six longer (2.95 Å) Na–O bond lengths. N3+ is bonded in a bent 120 degrees geometry to two O2- atoms. There is one shorter (1.24 Å) and one longer (1.25 Å) N–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two Na1+ and one N3+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to two Na1+ and one N3+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-14374
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; Na3Rh(NO2)6; N-Na-O-Rh
- OSTI Identifier:
- 1190638
- DOI:
- https://doi.org/10.17188/1190638
Citation Formats
The Materials Project. Materials Data on Na3Rh(NO2)6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1190638.
The Materials Project. Materials Data on Na3Rh(NO2)6 by Materials Project. United States. doi:https://doi.org/10.17188/1190638
The Materials Project. 2020.
"Materials Data on Na3Rh(NO2)6 by Materials Project". United States. doi:https://doi.org/10.17188/1190638. https://www.osti.gov/servlets/purl/1190638. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1190638,
title = {Materials Data on Na3Rh(NO2)6 by Materials Project},
author = {The Materials Project},
abstractNote = {(Na(NO2)2)3Rh crystallizes in the trigonal R-3m space group. The structure is three-dimensional and consists of three rhodium molecules and one Na(NO2)2 framework. In the Na(NO2)2 framework, there are two inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded to six O2- atoms to form a mixture of corner and face-sharing NaO6 octahedra. There are three shorter (2.36 Å) and three longer (2.41 Å) Na–O bond lengths. In the second Na1+ site, Na1+ is bonded to twelve O2- atoms to form a mixture of corner and face-sharing NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 45°. There are six shorter (2.66 Å) and six longer (2.95 Å) Na–O bond lengths. N3+ is bonded in a bent 120 degrees geometry to two O2- atoms. There is one shorter (1.24 Å) and one longer (1.25 Å) N–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two Na1+ and one N3+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to two Na1+ and one N3+ atom.},
doi = {10.17188/1190638},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}