U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Rh2O3 by Materials Project
Abstract
Rh2O3 is Corundum-like structured and crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. there are two inequivalent Rh3+ sites. In the first Rh3+ site, Rh3+ is bonded to six O2- atoms to form a mixture of corner, edge, and face-sharing RhO6 octahedra. The corner-sharing octahedra tilt angles range from 46–64°. There are a spread of Rh–O bond distances ranging from 2.04–2.09 Å. In the second Rh3+ site, Rh3+ is bonded to six O2- atoms to form a mixture of corner, edge, and face-sharing RhO6 octahedra. The corner-sharing octahedra tilt angles range from 49–70°. There are a spread of Rh–O bond distances ranging from 2.05–2.17 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to four Rh3+ atoms to form a mixture of distorted corner and edge-sharing ORh4 trigonal pyramids. In the second O2- site, O2- is bonded to four Rh3+ atoms to form a mixture of distorted corner and edge-sharing ORh4 trigonal pyramids. In the third O2- site, O2- is bonded to four Rh3+ atoms to form a mixture of distorted corner and edge-sharing ORh4 tetrahedra.
- Authors:
- Publication Date:
- Other Number(s):
- mp-613620
- 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; Rh2O3; O-Rh
- OSTI Identifier:
- 1277754
- DOI:
- https://doi.org/10.17188/1277754
Citation Formats
The Materials Project. Materials Data on Rh2O3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1277754.
The Materials Project. Materials Data on Rh2O3 by Materials Project. United States. doi:https://doi.org/10.17188/1277754
The Materials Project. 2020.
"Materials Data on Rh2O3 by Materials Project". United States. doi:https://doi.org/10.17188/1277754. https://www.osti.gov/servlets/purl/1277754. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1277754,
title = {Materials Data on Rh2O3 by Materials Project},
author = {The Materials Project},
abstractNote = {Rh2O3 is Corundum-like structured and crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. there are two inequivalent Rh3+ sites. In the first Rh3+ site, Rh3+ is bonded to six O2- atoms to form a mixture of corner, edge, and face-sharing RhO6 octahedra. The corner-sharing octahedra tilt angles range from 46–64°. There are a spread of Rh–O bond distances ranging from 2.04–2.09 Å. In the second Rh3+ site, Rh3+ is bonded to six O2- atoms to form a mixture of corner, edge, and face-sharing RhO6 octahedra. The corner-sharing octahedra tilt angles range from 49–70°. There are a spread of Rh–O bond distances ranging from 2.05–2.17 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to four Rh3+ atoms to form a mixture of distorted corner and edge-sharing ORh4 trigonal pyramids. In the second O2- site, O2- is bonded to four Rh3+ atoms to form a mixture of distorted corner and edge-sharing ORh4 trigonal pyramids. In the third O2- site, O2- is bonded to four Rh3+ atoms to form a mixture of distorted corner and edge-sharing ORh4 tetrahedra.},
doi = {10.17188/1277754},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Mon Jul 20 00:00:00 EDT 2020},
month = {Mon Jul 20 00:00:00 EDT 2020}
}