U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ba2SrWO6 by Materials Project
Abstract
Ba2SrWO6 is Orthorhombic Perovskite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ba2+ is bonded in a 9-coordinate geometry to nine equivalent O2- atoms. There are a spread of Ba–O bond distances ranging from 2.73–3.17 Å. Sr2+ is bonded to six equivalent O2- atoms to form SrO6 octahedra that share corners with six equivalent WO6 octahedra. The corner-sharing octahedral tilt angles are 20°. All Sr–O bond lengths are 2.46 Å. W6+ is bonded to six equivalent O2- atoms to form WO6 octahedra that share corners with six equivalent SrO6 octahedra. The corner-sharing octahedral tilt angles are 20°. All W–O bond lengths are 1.97 Å. O2- is bonded in a 5-coordinate geometry to three equivalent Ba2+, one Sr2+, and one W6+ atom.
- Publication Date:
- Other Number(s):
- mp-19078
- 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; Ba-O-Sr-W; Ba2SrWO6; crystal structure
- OSTI Identifier:
- 1193862
- DOI:
- https://doi.org/10.17188/1193862
Citation Formats
Materials Data on Ba2SrWO6 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1193862.
Materials Data on Ba2SrWO6 by Materials Project. United States. doi:https://doi.org/10.17188/1193862
2017.
"Materials Data on Ba2SrWO6 by Materials Project". United States. doi:https://doi.org/10.17188/1193862. https://www.osti.gov/servlets/purl/1193862. Pub date:Wed May 10 00:00:00 EDT 2017
@article{osti_1193862,
title = {Materials Data on Ba2SrWO6 by Materials Project},
abstractNote = {Ba2SrWO6 is Orthorhombic Perovskite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ba2+ is bonded in a 9-coordinate geometry to nine equivalent O2- atoms. There are a spread of Ba–O bond distances ranging from 2.73–3.17 Å. Sr2+ is bonded to six equivalent O2- atoms to form SrO6 octahedra that share corners with six equivalent WO6 octahedra. The corner-sharing octahedral tilt angles are 20°. All Sr–O bond lengths are 2.46 Å. W6+ is bonded to six equivalent O2- atoms to form WO6 octahedra that share corners with six equivalent SrO6 octahedra. The corner-sharing octahedral tilt angles are 20°. All W–O bond lengths are 1.97 Å. O2- is bonded in a 5-coordinate geometry to three equivalent Ba2+, one Sr2+, and one W6+ atom.},
doi = {10.17188/1193862},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}