U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ir3F by Materials Project
Abstract
Ir3F is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Ir sites. In the first Ir site, Ir is bonded to four equivalent Ir and four equivalent F atoms to form a mixture of distorted face, edge, and corner-sharing IrIr4F4 tetrahedra. All Ir–Ir bond lengths are 2.62 Å. All Ir–F bond lengths are 2.62 Å. In the second Ir site, Ir is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. F is bonded in a body-centered cubic geometry to eight equivalent Ir atoms.
- Publication Date:
- Other Number(s):
- mp-1184748
- 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; F-Ir; Ir3F; crystal structure
- OSTI Identifier:
- 1695375
- DOI:
- https://doi.org/10.17188/1695375
Citation Formats
Materials Data on Ir3F by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1695375.
Materials Data on Ir3F by Materials Project. United States. doi:https://doi.org/10.17188/1695375
2020.
"Materials Data on Ir3F by Materials Project". United States. doi:https://doi.org/10.17188/1695375. https://www.osti.gov/servlets/purl/1695375. Pub date:Sun May 03 04:00:00 UTC 2020
@article{osti_1695375,
title = {Materials Data on Ir3F by Materials Project},
abstractNote = {Ir3F is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Ir sites. In the first Ir site, Ir is bonded to four equivalent Ir and four equivalent F atoms to form a mixture of distorted face, edge, and corner-sharing IrIr4F4 tetrahedra. All Ir–Ir bond lengths are 2.62 Å. All Ir–F bond lengths are 2.62 Å. In the second Ir site, Ir is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. F is bonded in a body-centered cubic geometry to eight equivalent Ir atoms.},
doi = {10.17188/1695375},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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