U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ce(In2Au)2 by Materials Project
Abstract
Ce(AuIn2)2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce is bonded in a 11-coordinate geometry to six Au and ten In atoms. There are a spread of Ce–Au bond distances ranging from 3.46–3.95 Å. There are a spread of Ce–In bond distances ranging from 3.33–3.74 Å. There are two inequivalent Au sites. In the first Au site, Au is bonded in a 9-coordinate geometry to three equivalent Ce and seven In atoms. There are a spread of Au–In bond distances ranging from 2.82–3.05 Å. In the second Au site, Au is bonded in a 7-coordinate geometry to three equivalent Ce and seven In atoms. There are a spread of Au–In bond distances ranging from 2.84–2.91 Å. There are four inequivalent In sites. In the first In site, In is bonded in a 3-coordinate geometry to three equivalent Ce and three equivalent Au atoms. In the second In site, In is bonded in a 4-coordinate geometry to three equivalent Ce and four Au atoms. In the third In site, In is bonded in a 3-coordinate geometry to three equivalent Ce and three equivalent Au atoms. In the fourth In site, In is bonded to one Ce andmore »
- Publication Date:
- Other Number(s):
- mp-21537
- 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; Au-Ce-In; Ce(In2Au)2; crystal structure
- OSTI Identifier:
- 1196980
- DOI:
- https://doi.org/10.17188/1196980
Citation Formats
Materials Data on Ce(In2Au)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1196980.
Materials Data on Ce(In2Au)2 by Materials Project. United States. doi:https://doi.org/10.17188/1196980
2020.
"Materials Data on Ce(In2Au)2 by Materials Project". United States. doi:https://doi.org/10.17188/1196980. https://www.osti.gov/servlets/purl/1196980. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1196980,
title = {Materials Data on Ce(In2Au)2 by Materials Project},
abstractNote = {Ce(AuIn2)2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce is bonded in a 11-coordinate geometry to six Au and ten In atoms. There are a spread of Ce–Au bond distances ranging from 3.46–3.95 Å. There are a spread of Ce–In bond distances ranging from 3.33–3.74 Å. There are two inequivalent Au sites. In the first Au site, Au is bonded in a 9-coordinate geometry to three equivalent Ce and seven In atoms. There are a spread of Au–In bond distances ranging from 2.82–3.05 Å. In the second Au site, Au is bonded in a 7-coordinate geometry to three equivalent Ce and seven In atoms. There are a spread of Au–In bond distances ranging from 2.84–2.91 Å. There are four inequivalent In sites. In the first In site, In is bonded in a 3-coordinate geometry to three equivalent Ce and three equivalent Au atoms. In the second In site, In is bonded in a 4-coordinate geometry to three equivalent Ce and four Au atoms. In the third In site, In is bonded in a 3-coordinate geometry to three equivalent Ce and three equivalent Au atoms. In the fourth In site, In is bonded to one Ce and four Au atoms to form a mixture of distorted edge and corner-sharing InCeAu4 tetrahedra.},
doi = {10.17188/1196980},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 22 00:00:00 EDT 2020},
month = {Wed Jul 22 00:00:00 EDT 2020}
}