U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ba2CePtO6 by Materials Project
Abstract
Ba2PtCeO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent O2- atoms to form BaO12 cuboctahedra that share corners with twelve equivalent BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, faces with four equivalent CeO6 octahedra, and faces with four equivalent PtO6 octahedra. All Ba–O bond lengths are 3.01 Å. Ce3+ is bonded to six equivalent O2- atoms to form CeO6 octahedra that share corners with six equivalent PtO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ce–O bond lengths are 2.22 Å. Pt5+ is bonded to six equivalent O2- atoms to form PtO6 octahedra that share corners with six equivalent CeO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pt–O bond lengths are 2.04 Å. O2- is bonded in a distorted linear geometry to four equivalent Ba2+, one Ce3+, and one Pt5+ atom.
- Publication Date:
- Other Number(s):
- mp-21879
- 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-Ce-O-Pt; Ba2CePtO6; crystal structure
- OSTI Identifier:
- 1197220
- DOI:
- https://doi.org/10.17188/1197220
Citation Formats
Materials Data on Ba2CePtO6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1197220.
Materials Data on Ba2CePtO6 by Materials Project. United States. doi:https://doi.org/10.17188/1197220
2020.
"Materials Data on Ba2CePtO6 by Materials Project". United States. doi:https://doi.org/10.17188/1197220. https://www.osti.gov/servlets/purl/1197220. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1197220,
title = {Materials Data on Ba2CePtO6 by Materials Project},
abstractNote = {Ba2PtCeO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent O2- atoms to form BaO12 cuboctahedra that share corners with twelve equivalent BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, faces with four equivalent CeO6 octahedra, and faces with four equivalent PtO6 octahedra. All Ba–O bond lengths are 3.01 Å. Ce3+ is bonded to six equivalent O2- atoms to form CeO6 octahedra that share corners with six equivalent PtO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ce–O bond lengths are 2.22 Å. Pt5+ is bonded to six equivalent O2- atoms to form PtO6 octahedra that share corners with six equivalent CeO6 octahedra and faces with eight equivalent BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pt–O bond lengths are 2.04 Å. O2- is bonded in a distorted linear geometry to four equivalent Ba2+, one Ce3+, and one Pt5+ atom.},
doi = {10.17188/1197220},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}