U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ThZn4 by Materials Project
Abstract
ThZn4 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th is bonded in a 8-coordinate geometry to sixteen Zn atoms. There are eight shorter (3.27 Å) and eight longer (3.35 Å) Th–Zn bond lengths. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded in a 9-coordinate geometry to four equivalent Th and five Zn atoms. There are one shorter (2.43 Å) and four longer (2.54 Å) Zn–Zn bond lengths. In the second Zn site, Zn is bonded to four equivalent Th and eight Zn atoms to form a mixture of distorted corner, edge, and face-sharing ZnTh4Zn8 cuboctahedra. All Zn–Zn bond lengths are 3.04 Å.
- Publication Date:
- Other Number(s):
- mp-536
- 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; Th-Zn; ThZn4; crystal structure
- OSTI Identifier:
- 1263564
- DOI:
- https://doi.org/10.17188/1263564
Citation Formats
Materials Data on ThZn4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1263564.
Materials Data on ThZn4 by Materials Project. United States. doi:https://doi.org/10.17188/1263564
2020.
"Materials Data on ThZn4 by Materials Project". United States. doi:https://doi.org/10.17188/1263564. https://www.osti.gov/servlets/purl/1263564. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1263564,
title = {Materials Data on ThZn4 by Materials Project},
abstractNote = {ThZn4 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th is bonded in a 8-coordinate geometry to sixteen Zn atoms. There are eight shorter (3.27 Å) and eight longer (3.35 Å) Th–Zn bond lengths. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded in a 9-coordinate geometry to four equivalent Th and five Zn atoms. There are one shorter (2.43 Å) and four longer (2.54 Å) Zn–Zn bond lengths. In the second Zn site, Zn is bonded to four equivalent Th and eight Zn atoms to form a mixture of distorted corner, edge, and face-sharing ZnTh4Zn8 cuboctahedra. All Zn–Zn bond lengths are 3.04 Å.},
doi = {10.17188/1263564},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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