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Title: Materials Data on Al by Materials Project

Abstract

Al is alpha La structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Al sites. In the first Al site, Al is bonded to twelve Al atoms to form a mixture of corner, edge, and face-sharing AlAl12 cuboctahedra. There are six shorter (2.85 Å) and six longer (2.86 Å) Al–Al bond lengths. In the second Al site, Al is bonded to twelve Al atoms to form a mixture of corner, edge, and face-sharing AlAl12 cuboctahedra. All Al–Al bond lengths are 2.86 Å.

Publication Date:
Other Number(s):
mp-1183144
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; crystal structure
OSTI Identifier:
1695238
DOI:
https://doi.org/10.17188/1695238

Citation Formats

Materials Data on Al by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1695238.
Materials Data on Al by Materials Project. United States. doi:https://doi.org/10.17188/1695238
2020. "Materials Data on Al by Materials Project". United States. doi:https://doi.org/10.17188/1695238. https://www.osti.gov/servlets/purl/1695238. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1695238,
title = {Materials Data on Al by Materials Project},
abstractNote = {Al is alpha La structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Al sites. In the first Al site, Al is bonded to twelve Al atoms to form a mixture of corner, edge, and face-sharing AlAl12 cuboctahedra. There are six shorter (2.85 Å) and six longer (2.86 Å) Al–Al bond lengths. In the second Al site, Al is bonded to twelve Al atoms to form a mixture of corner, edge, and face-sharing AlAl12 cuboctahedra. All Al–Al bond lengths are 2.86 Å.},
doi = {10.17188/1695238},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}