U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LuAl2Pd5 by Materials Project
Abstract
LuPd5Al2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Lu is bonded to twelve Pd atoms to form a mixture of face and corner-sharing LuPd12 cuboctahedra. There are four shorter (2.91 Å) and eight longer (2.96 Å) Lu–Pd bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted square co-planar geometry to four equivalent Lu atoms. In the second Pd site, Pd is bonded in a 6-coordinate geometry to two equivalent Lu and four equivalent Al atoms. There are two shorter (2.58 Å) and two longer (2.64 Å) Pd–Al bond lengths. Al is bonded in a body-centered cubic geometry to eight equivalent Pd atoms.
- Publication Date:
- Other Number(s):
- mp-1025564
- 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-Lu-Pd; LuAl2Pd5; crystal structure
- OSTI Identifier:
- 1355431
- DOI:
- https://doi.org/10.17188/1355431
Citation Formats
Materials Data on LuAl2Pd5 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1355431.
Materials Data on LuAl2Pd5 by Materials Project. United States. doi:https://doi.org/10.17188/1355431
2020.
"Materials Data on LuAl2Pd5 by Materials Project". United States. doi:https://doi.org/10.17188/1355431. https://www.osti.gov/servlets/purl/1355431. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1355431,
title = {Materials Data on LuAl2Pd5 by Materials Project},
abstractNote = {LuPd5Al2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Lu is bonded to twelve Pd atoms to form a mixture of face and corner-sharing LuPd12 cuboctahedra. There are four shorter (2.91 Å) and eight longer (2.96 Å) Lu–Pd bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted square co-planar geometry to four equivalent Lu atoms. In the second Pd site, Pd is bonded in a 6-coordinate geometry to two equivalent Lu and four equivalent Al atoms. There are two shorter (2.58 Å) and two longer (2.64 Å) Pd–Al bond lengths. Al is bonded in a body-centered cubic geometry to eight equivalent Pd atoms.},
doi = {10.17188/1355431},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.