U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on BaAgSF by Materials Project
Abstract
BaFAgS is Parent of FeAs superconductors structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ba2+ is bonded in a 4-coordinate geometry to four equivalent S2- and four equivalent F1- atoms. All Ba–S bond lengths are 3.38 Å. All Ba–F bond lengths are 2.67 Å. Ag1+ is bonded to four equivalent S2- atoms to form a mixture of edge and corner-sharing AgS4 tetrahedra. All Ag–S bond lengths are 2.71 Å. S2- is bonded in a 8-coordinate geometry to four equivalent Ba2+ and four equivalent Ag1+ atoms. F1- is bonded to four equivalent Ba2+ atoms to form a mixture of edge and corner-sharing FBa4 tetrahedra.
- Publication Date:
- Other Number(s):
- mp-1086652
- 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-Ba-F-S; BaAgSF; crystal structure
- OSTI Identifier:
- 1688185
- DOI:
- https://doi.org/10.17188/1688185
Citation Formats
Materials Data on BaAgSF by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1688185.
Materials Data on BaAgSF by Materials Project. United States. doi:https://doi.org/10.17188/1688185
2020.
"Materials Data on BaAgSF by Materials Project". United States. doi:https://doi.org/10.17188/1688185. https://www.osti.gov/servlets/purl/1688185. Pub date:Sat May 09 04:00:00 UTC 2020
@article{osti_1688185,
title = {Materials Data on BaAgSF by Materials Project},
abstractNote = {BaFAgS is Parent of FeAs superconductors structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ba2+ is bonded in a 4-coordinate geometry to four equivalent S2- and four equivalent F1- atoms. All Ba–S bond lengths are 3.38 Å. All Ba–F bond lengths are 2.67 Å. Ag1+ is bonded to four equivalent S2- atoms to form a mixture of edge and corner-sharing AgS4 tetrahedra. All Ag–S bond lengths are 2.71 Å. S2- is bonded in a 8-coordinate geometry to four equivalent Ba2+ and four equivalent Ag1+ atoms. F1- is bonded to four equivalent Ba2+ atoms to form a mixture of edge and corner-sharing FBa4 tetrahedra.},
doi = {10.17188/1688185},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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