Materials Data on BaZn13 by Materials Project
Abstract
BaZn13 crystallizes in the cubic Fm-3c space group. The structure is three-dimensional. Ba is bonded in a 1-coordinate geometry to twenty-four equivalent Zn atoms. All Ba–Zn bond lengths are 3.60 Å. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded in a 12-coordinate geometry to two equivalent Ba and ten Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.60–2.97 Å. In the second Zn site, Zn is bonded in a cuboctahedral geometry to twelve equivalent Zn atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-672225
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; BaZn13; Ba-Zn
- OSTI Identifier:
- 1281784
- DOI:
- https://doi.org/10.17188/1281784
Citation Formats
The Materials Project. Materials Data on BaZn13 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1281784.
The Materials Project. Materials Data on BaZn13 by Materials Project. United States. doi:https://doi.org/10.17188/1281784
The Materials Project. 2020.
"Materials Data on BaZn13 by Materials Project". United States. doi:https://doi.org/10.17188/1281784. https://www.osti.gov/servlets/purl/1281784. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1281784,
title = {Materials Data on BaZn13 by Materials Project},
author = {The Materials Project},
abstractNote = {BaZn13 crystallizes in the cubic Fm-3c space group. The structure is three-dimensional. Ba is bonded in a 1-coordinate geometry to twenty-four equivalent Zn atoms. All Ba–Zn bond lengths are 3.60 Å. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded in a 12-coordinate geometry to two equivalent Ba and ten Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.60–2.97 Å. In the second Zn site, Zn is bonded in a cuboctahedral geometry to twelve equivalent Zn atoms.},
doi = {10.17188/1281784},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Mon Jul 20 00:00:00 EDT 2020},
month = {Mon Jul 20 00:00:00 EDT 2020}
}
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