U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZrSeO by Materials Project
Abstract
ZrSeO is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr4+ is bonded in a 9-coordinate geometry to five equivalent Se2- and four equivalent O2- atoms. There are four shorter (2.90 Å) and one longer (2.97 Å) Zr–Se bond lengths. All Zr–O bond lengths are 2.23 Å. Se2- is bonded in a 5-coordinate geometry to five equivalent Zr4+ atoms. O2- is bonded to four equivalent Zr4+ atoms to form a mixture of edge and corner-sharing OZr4 tetrahedra.
- Publication Date:
- Other Number(s):
- mp-756134
- 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; O-Se-Zr; ZrSeO; crystal structure
- OSTI Identifier:
- 1290359
- DOI:
- https://doi.org/10.17188/1290359
Citation Formats
Materials Data on ZrSeO by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1290359.
Materials Data on ZrSeO by Materials Project. United States. doi:https://doi.org/10.17188/1290359
2020.
"Materials Data on ZrSeO by Materials Project". United States. doi:https://doi.org/10.17188/1290359. https://www.osti.gov/servlets/purl/1290359. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1290359,
title = {Materials Data on ZrSeO by Materials Project},
abstractNote = {ZrSeO is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr4+ is bonded in a 9-coordinate geometry to five equivalent Se2- and four equivalent O2- atoms. There are four shorter (2.90 Å) and one longer (2.97 Å) Zr–Se bond lengths. All Zr–O bond lengths are 2.23 Å. Se2- is bonded in a 5-coordinate geometry to five equivalent Zr4+ atoms. O2- is bonded to four equivalent Zr4+ atoms to form a mixture of edge and corner-sharing OZr4 tetrahedra.},
doi = {10.17188/1290359},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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