U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TaTlO3 by Materials Project
Abstract
TlTaO3 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ta5+ is bonded to six equivalent O2- atoms to form corner-sharing TaO6 octahedra. The corner-sharing octahedral tilt angles are 38°. All Ta–O bond lengths are 2.01 Å. Tl1+ is bonded in a hexagonal planar geometry to six equivalent O2- atoms. All Tl–O bond lengths are 2.79 Å. O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Ta5+ and two equivalent Tl1+ atoms.
- Publication Date:
- Other Number(s):
- mp-756933
- 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-Ta-Tl; TaTlO3; crystal structure
- OSTI Identifier:
- 1290665
- DOI:
- https://doi.org/10.17188/1290665
Citation Formats
Materials Data on TaTlO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1290665.
Materials Data on TaTlO3 by Materials Project. United States. doi:https://doi.org/10.17188/1290665
2020.
"Materials Data on TaTlO3 by Materials Project". United States. doi:https://doi.org/10.17188/1290665. https://www.osti.gov/servlets/purl/1290665. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1290665,
title = {Materials Data on TaTlO3 by Materials Project},
abstractNote = {TlTaO3 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ta5+ is bonded to six equivalent O2- atoms to form corner-sharing TaO6 octahedra. The corner-sharing octahedral tilt angles are 38°. All Ta–O bond lengths are 2.01 Å. Tl1+ is bonded in a hexagonal planar geometry to six equivalent O2- atoms. All Tl–O bond lengths are 2.79 Å. O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Ta5+ and two equivalent Tl1+ atoms.},
doi = {10.17188/1290665},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}
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