U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Hf6Al2Fe by Materials Project
Abstract
Hf6FeAl2 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 5-coordinate geometry to one Fe and four equivalent Al atoms. The Hf–Fe bond length is 3.11 Å. All Hf–Al bond lengths are 2.91 Å. In the second Hf site, Hf is bonded in a 2-coordinate geometry to two equivalent Fe and two equivalent Al atoms. Both Hf–Fe bond lengths are 2.55 Å. Both Hf–Al bond lengths are 3.00 Å. Fe is bonded in a 6-coordinate geometry to nine Hf atoms. Al is bonded in a 9-coordinate geometry to nine Hf atoms.
- Publication Date:
- Other Number(s):
- mp-1224393
- 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; Al-Fe-Hf; Hf6Al2Fe; crystal structure
- OSTI Identifier:
- 1680492
- DOI:
- https://doi.org/10.17188/1680492
Citation Formats
Materials Data on Hf6Al2Fe by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1680492.
Materials Data on Hf6Al2Fe by Materials Project. United States. doi:https://doi.org/10.17188/1680492
2019.
"Materials Data on Hf6Al2Fe by Materials Project". United States. doi:https://doi.org/10.17188/1680492. https://www.osti.gov/servlets/purl/1680492. Pub date:Sat Jan 12 23:00:00 EST 2019
@article{osti_1680492,
title = {Materials Data on Hf6Al2Fe by Materials Project},
abstractNote = {Hf6FeAl2 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 5-coordinate geometry to one Fe and four equivalent Al atoms. The Hf–Fe bond length is 3.11 Å. All Hf–Al bond lengths are 2.91 Å. In the second Hf site, Hf is bonded in a 2-coordinate geometry to two equivalent Fe and two equivalent Al atoms. Both Hf–Fe bond lengths are 2.55 Å. Both Hf–Al bond lengths are 3.00 Å. Fe is bonded in a 6-coordinate geometry to nine Hf atoms. Al is bonded in a 9-coordinate geometry to nine Hf atoms.},
doi = {10.17188/1680492},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}
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