U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cs8Ta6O19 by Materials Project
Abstract
Cs8Ta6O19 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Cs–O bond distances ranging from 2.93–3.42 Å. There are four inequivalent Ta5+ sites. In the first Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.83–2.39 Å. In the second Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.83–2.39 Å. In the third Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.83–2.39 Å. In the fourth Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.84–2.36 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one Ta5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Cs1+ andmore »
- Publication Date:
- Other Number(s):
- mp-542069
- 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; Cs-O-Ta; Cs8Ta6O19; crystal structure
- OSTI Identifier:
- 1266380
- DOI:
- https://doi.org/10.17188/1266380
Citation Formats
Materials Data on Cs8Ta6O19 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1266380.
Materials Data on Cs8Ta6O19 by Materials Project. United States. doi:https://doi.org/10.17188/1266380
2020.
"Materials Data on Cs8Ta6O19 by Materials Project". United States. doi:https://doi.org/10.17188/1266380. https://www.osti.gov/servlets/purl/1266380. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1266380,
title = {Materials Data on Cs8Ta6O19 by Materials Project},
abstractNote = {Cs8Ta6O19 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Cs–O bond distances ranging from 2.93–3.42 Å. There are four inequivalent Ta5+ sites. In the first Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.83–2.39 Å. In the second Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.83–2.39 Å. In the third Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.83–2.39 Å. In the fourth Ta5+ site, Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.84–2.36 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one Ta5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Cs1+ and two Ta5+ atoms. In the third O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Cs1+ and two Ta5+ atoms. In the fourth O2- site, O2- is bonded in an octahedral geometry to six Ta5+ atoms. In the fifth O2- site, O2- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one Ta5+ atom.},
doi = {10.17188/1266380},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}