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Title: Materials Data on Cr(SbO3)2 by Materials Project

Abstract

Cr(SbO3)2 is zeta iron carbide-derived structured and crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Cr6+ is bonded to six O2- atoms to form CrO6 octahedra that share corners with twelve equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 50–54°. There are two shorter (2.13 Å) and four longer (2.33 Å) Cr–O bond lengths. Sb3+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent CrO6 octahedra and edges with three equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 50–54°. There are a spread of Sb–O bond distances ranging from 2.01–2.04 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to one Cr6+ and two equivalent Sb3+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to one Cr6+ and two equivalent Sb3+ atoms.

Publication Date:
Other Number(s):
mp-1178419
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Cr(SbO3)2; Cr-O-Sb
OSTI Identifier:
1744109
DOI:
https://doi.org/10.17188/1744109

Citation Formats

The Materials Project. Materials Data on Cr(SbO3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1744109.
The Materials Project. Materials Data on Cr(SbO3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1744109
The Materials Project. 2020. "Materials Data on Cr(SbO3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1744109. https://www.osti.gov/servlets/purl/1744109. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1744109,
title = {Materials Data on Cr(SbO3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Cr(SbO3)2 is zeta iron carbide-derived structured and crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Cr6+ is bonded to six O2- atoms to form CrO6 octahedra that share corners with twelve equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 50–54°. There are two shorter (2.13 Å) and four longer (2.33 Å) Cr–O bond lengths. Sb3+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent CrO6 octahedra and edges with three equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 50–54°. There are a spread of Sb–O bond distances ranging from 2.01–2.04 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to one Cr6+ and two equivalent Sb3+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to one Cr6+ and two equivalent Sb3+ atoms.},
doi = {10.17188/1744109},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}