U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on BaAu2 by Materials Project
Abstract
BaAu2 is hexagonal omega structure structured and crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent Au1- atoms to form a mixture of face and edge-sharing BaAu12 cuboctahedra. All Ba–Au bond lengths are 3.54 Å. Au1- is bonded in a 9-coordinate geometry to six equivalent Ba2+ and three equivalent Au1- atoms. All Au–Au bond lengths are 2.83 Å.
- Publication Date:
- Other Number(s):
- mp-30363
- 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-Ba; BaAu2; crystal structure
- OSTI Identifier:
- 1204778
- DOI:
- https://doi.org/10.17188/1204778
Citation Formats
Materials Data on BaAu2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1204778.
Materials Data on BaAu2 by Materials Project. United States. doi:https://doi.org/10.17188/1204778
2020.
"Materials Data on BaAu2 by Materials Project". United States. doi:https://doi.org/10.17188/1204778. https://www.osti.gov/servlets/purl/1204778. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1204778,
title = {Materials Data on BaAu2 by Materials Project},
abstractNote = {BaAu2 is hexagonal omega structure structured and crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Ba2+ is bonded to twelve equivalent Au1- atoms to form a mixture of face and edge-sharing BaAu12 cuboctahedra. All Ba–Au bond lengths are 3.54 Å. Au1- is bonded in a 9-coordinate geometry to six equivalent Ba2+ and three equivalent Au1- atoms. All Au–Au bond lengths are 2.83 Å.},
doi = {10.17188/1204778},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.