U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ce2U3O10 by Materials Project
Abstract
U3Ce2O10 is Fluorite-derived structured and crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are three inequivalent U+4.67+ sites. In the first U+4.67+ site, U+4.67+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.31–2.35 Å. In the second U+4.67+ site, U+4.67+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.29–2.36 Å. In the third U+4.67+ site, U+4.67+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.31–2.35 Å. There are two inequivalent Ce3+ sites. In the first Ce3+ site, Ce3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Ce–O bond distances ranging from 2.38–2.41 Å. In the second Ce3+ site, Ce3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Ce–O bond distances ranging from 2.39–2.41 Å. There are ten inequivalent O2- sites. In the first O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form OCe2U2 tetrahedra that sharemore »
- Publication Date:
- Other Number(s):
- mp-773114
- 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; Ce-O-U; Ce2U3O10; crystal structure
- OSTI Identifier:
- 1282032
- DOI:
- https://doi.org/10.17188/1282032
Citation Formats
Materials Data on Ce2U3O10 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1282032.
Materials Data on Ce2U3O10 by Materials Project. United States. doi:https://doi.org/10.17188/1282032
2020.
"Materials Data on Ce2U3O10 by Materials Project". United States. doi:https://doi.org/10.17188/1282032. https://www.osti.gov/servlets/purl/1282032. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1282032,
title = {Materials Data on Ce2U3O10 by Materials Project},
abstractNote = {U3Ce2O10 is Fluorite-derived structured and crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are three inequivalent U+4.67+ sites. In the first U+4.67+ site, U+4.67+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.31–2.35 Å. In the second U+4.67+ site, U+4.67+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.29–2.36 Å. In the third U+4.67+ site, U+4.67+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.31–2.35 Å. There are two inequivalent Ce3+ sites. In the first Ce3+ site, Ce3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Ce–O bond distances ranging from 2.38–2.41 Å. In the second Ce3+ site, Ce3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Ce–O bond distances ranging from 2.39–2.41 Å. There are ten inequivalent O2- sites. In the first O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form OCe2U2 tetrahedra that share corners with sixteen OCeU3 tetrahedra and edges with six OCe2U2 tetrahedra. In the second O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form OCe2U2 tetrahedra that share corners with sixteen OCeU3 tetrahedra and edges with six OCe2U2 tetrahedra. In the third O2- site, O2- is bonded to three U+4.67+ and one Ce3+ atom to form a mixture of edge and corner-sharing OCeU3 tetrahedra. In the fourth O2- site, O2- is bonded to three U+4.67+ and one Ce3+ atom to form a mixture of edge and corner-sharing OCeU3 tetrahedra. In the fifth O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form a mixture of edge and corner-sharing OCe2U2 tetrahedra. In the sixth O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form a mixture of edge and corner-sharing OCe2U2 tetrahedra. In the seventh O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form a mixture of edge and corner-sharing OCe2U2 tetrahedra. In the eighth O2- site, O2- is bonded to two U+4.67+ and two Ce3+ atoms to form a mixture of edge and corner-sharing OCe2U2 tetrahedra. In the ninth O2- site, O2- is bonded to three U+4.67+ and one Ce3+ atom to form a mixture of edge and corner-sharing OCeU3 tetrahedra. In the tenth O2- site, O2- is bonded to three U+4.67+ and one Ce3+ atom to form a mixture of edge and corner-sharing OCeU3 tetrahedra.},
doi = {10.17188/1282032},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}