U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on YAu3 by Materials Project
Abstract
Au3Y is beta Cu3Ti structured and crystallizes in the orthorhombic Pmmn space group. The structure is three-dimensional. Y3+ is bonded to twelve Au1- atoms to form a mixture of corner, edge, and face-sharing YAu12 cuboctahedra. There are a spread of Y–Au bond distances ranging from 3.03–3.11 Å. There are two inequivalent Au1- sites. In the first Au1- site, Au1- is bonded in a 12-coordinate geometry to four equivalent Y3+ atoms. In the second Au1- site, Au1- is bonded in a distorted see-saw-like geometry to four equivalent Y3+ atoms.
- Publication Date:
- Other Number(s):
- mp-1079467
- 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; Au-Y; YAu3; crystal structure
- OSTI Identifier:
- 1729035
- DOI:
- https://doi.org/10.17188/1729035
Citation Formats
Materials Data on YAu3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1729035.
Materials Data on YAu3 by Materials Project. United States. doi:https://doi.org/10.17188/1729035
2020.
"Materials Data on YAu3 by Materials Project". United States. doi:https://doi.org/10.17188/1729035. https://www.osti.gov/servlets/purl/1729035. Pub date:Sun May 03 04:00:00 UTC 2020
@article{osti_1729035,
title = {Materials Data on YAu3 by Materials Project},
abstractNote = {Au3Y is beta Cu3Ti structured and crystallizes in the orthorhombic Pmmn space group. The structure is three-dimensional. Y3+ is bonded to twelve Au1- atoms to form a mixture of corner, edge, and face-sharing YAu12 cuboctahedra. There are a spread of Y–Au bond distances ranging from 3.03–3.11 Å. There are two inequivalent Au1- sites. In the first Au1- site, Au1- is bonded in a 12-coordinate geometry to four equivalent Y3+ atoms. In the second Au1- site, Au1- is bonded in a distorted see-saw-like geometry to four equivalent Y3+ atoms.},
doi = {10.17188/1729035},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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