U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Zr2Sb by Materials Project
Abstract
Zr2Sb crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 4-coordinate geometry to four equivalent Zr and four equivalent Sb atoms. All Zr–Zr bond lengths are 2.93 Å. All Zr–Sb bond lengths are 3.03 Å. In the second Zr site, Zr is bonded to five equivalent Sb atoms to form a mixture of distorted edge and corner-sharing ZrSb5 square pyramids. There are one shorter (2.94 Å) and four longer (2.99 Å) Zr–Sb bond lengths. Sb is bonded in a 9-coordinate geometry to nine Zr atoms.
- Publication Date:
- Other Number(s):
- mp-31379
- 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; Sb-Zr; Zr2Sb; crystal structure
- OSTI Identifier:
- 1205618
- DOI:
- https://doi.org/10.17188/1205618
Citation Formats
Materials Data on Zr2Sb by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1205618.
Materials Data on Zr2Sb by Materials Project. United States. doi:https://doi.org/10.17188/1205618
2020.
"Materials Data on Zr2Sb by Materials Project". United States. doi:https://doi.org/10.17188/1205618. https://www.osti.gov/servlets/purl/1205618. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1205618,
title = {Materials Data on Zr2Sb by Materials Project},
abstractNote = {Zr2Sb crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 4-coordinate geometry to four equivalent Zr and four equivalent Sb atoms. All Zr–Zr bond lengths are 2.93 Å. All Zr–Sb bond lengths are 3.03 Å. In the second Zr site, Zr is bonded to five equivalent Sb atoms to form a mixture of distorted edge and corner-sharing ZrSb5 square pyramids. There are one shorter (2.94 Å) and four longer (2.99 Å) Zr–Sb bond lengths. Sb is bonded in a 9-coordinate geometry to nine Zr atoms.},
doi = {10.17188/1205618},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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