U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on BaAgAs by Materials Project
Abstract
BaAgAs crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ba2+ is bonded to six equivalent Ag1+ and six equivalent As3- atoms to form a mixture of distorted edge and face-sharing BaAg6As6 cuboctahedra. All Ba–Ag bond lengths are 3.53 Å. All Ba–As bond lengths are 3.53 Å. Ag1+ is bonded in a trigonal planar geometry to six equivalent Ba2+ and three equivalent As3- atoms. All Ag–As bond lengths are 2.70 Å. As3- is bonded in a 3-coordinate geometry to six equivalent Ba2+ and three equivalent Ag1+ atoms.
- Publication Date:
- Other Number(s):
- mp-7359
- 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; Ag-As-Ba; BaAgAs; crystal structure
- OSTI Identifier:
- 1287846
- DOI:
- https://doi.org/10.17188/1287846
Citation Formats
Materials Data on BaAgAs by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1287846.
Materials Data on BaAgAs by Materials Project. United States. doi:https://doi.org/10.17188/1287846
2020.
"Materials Data on BaAgAs by Materials Project". United States. doi:https://doi.org/10.17188/1287846. https://www.osti.gov/servlets/purl/1287846. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1287846,
title = {Materials Data on BaAgAs by Materials Project},
abstractNote = {BaAgAs crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ba2+ is bonded to six equivalent Ag1+ and six equivalent As3- atoms to form a mixture of distorted edge and face-sharing BaAg6As6 cuboctahedra. All Ba–Ag bond lengths are 3.53 Å. All Ba–As bond lengths are 3.53 Å. Ag1+ is bonded in a trigonal planar geometry to six equivalent Ba2+ and three equivalent As3- atoms. All Ag–As bond lengths are 2.70 Å. As3- is bonded in a 3-coordinate geometry to six equivalent Ba2+ and three equivalent Ag1+ atoms.},
doi = {10.17188/1287846},
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.