U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZnCrO4 by Materials Project
Abstract
ZnCrO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Cr6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Cr–O bond distances ranging from 1.64–1.69 Å. Zn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Zn–O bond distances ranging from 1.96–2.08 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 150 degrees geometry to one Cr6+ and one Zn2+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to one Cr6+ and one Zn2+ atom. In the third O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Cr6+ and one Zn2+ atom. In the fourth O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Cr6+ and one Zn2+ atom.
- Publication Date:
- Other Number(s):
- mp-770735
- 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; Cr-O-Zn; crystal structure; ZnCrO4
- OSTI Identifier:
- 1300056
- DOI:
- https://doi.org/10.17188/1300056
Citation Formats
Materials Data on ZnCrO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1300056.
Materials Data on ZnCrO4 by Materials Project. United States. doi:https://doi.org/10.17188/1300056
2020.
"Materials Data on ZnCrO4 by Materials Project". United States. doi:https://doi.org/10.17188/1300056. https://www.osti.gov/servlets/purl/1300056. Pub date:Tue Apr 28 20:00:00 EDT 2020
@article{osti_1300056,
title = {Materials Data on ZnCrO4 by Materials Project},
abstractNote = {ZnCrO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Cr6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Cr–O bond distances ranging from 1.64–1.69 Å. Zn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Zn–O bond distances ranging from 1.96–2.08 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 150 degrees geometry to one Cr6+ and one Zn2+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to one Cr6+ and one Zn2+ atom. In the third O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Cr6+ and one Zn2+ atom. In the fourth O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Cr6+ and one Zn2+ atom.},
doi = {10.17188/1300056},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}