Materials Data on LaMg6Al by Materials Project
Abstract
Mg6LaAl crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are four inequivalent Mg sites. In the first Mg site, Mg is bonded in a 1-coordinate geometry to eight Mg, two equivalent La, and one Al atom. There are a spread of Mg–Mg bond distances ranging from 2.98–3.49 Å. There are one shorter (3.56 Å) and one longer (3.79 Å) Mg–La bond lengths. The Mg–Al bond length is 3.05 Å. In the second Mg site, Mg is bonded in a 10-coordinate geometry to six Mg, two equivalent La, and two equivalent Al atoms. There are a spread of Mg–Mg bond distances ranging from 3.06–3.25 Å. Both Mg–La bond lengths are 3.33 Å. Both Mg–Al bond lengths are 3.00 Å. In the third Mg site, Mg is bonded in a 2-coordinate geometry to eight Mg and two equivalent Al atoms. Both Mg–Mg bond lengths are 3.23 Å. Both Mg–Al bond lengths are 3.22 Å. In the fourth Mg site, Mg is bonded in a 10-coordinate geometry to eight Mg and two equivalent La atoms. Both Mg–La bond lengths are 3.31 Å. La is bonded in a 12-coordinate geometry to ten Mg and two equivalent Al atoms. Both La–Almore »
- Publication Date:
- Other Number(s):
- mp-1023325
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Product Type:
- Dataset
- 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)
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; LaMg6Al; Al-La-Mg
- OSTI Identifier:
- 1651989
- DOI:
- https://doi.org/10.17188/1651989
Citation Formats
The Materials Project. Materials Data on LaMg6Al by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1651989.
The Materials Project. Materials Data on LaMg6Al by Materials Project. United States. doi:https://doi.org/10.17188/1651989
The Materials Project. 2020.
"Materials Data on LaMg6Al by Materials Project". United States. doi:https://doi.org/10.17188/1651989. https://www.osti.gov/servlets/purl/1651989. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1651989,
title = {Materials Data on LaMg6Al by Materials Project},
author = {The Materials Project},
abstractNote = {Mg6LaAl crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are four inequivalent Mg sites. In the first Mg site, Mg is bonded in a 1-coordinate geometry to eight Mg, two equivalent La, and one Al atom. There are a spread of Mg–Mg bond distances ranging from 2.98–3.49 Å. There are one shorter (3.56 Å) and one longer (3.79 Å) Mg–La bond lengths. The Mg–Al bond length is 3.05 Å. In the second Mg site, Mg is bonded in a 10-coordinate geometry to six Mg, two equivalent La, and two equivalent Al atoms. There are a spread of Mg–Mg bond distances ranging from 3.06–3.25 Å. Both Mg–La bond lengths are 3.33 Å. Both Mg–Al bond lengths are 3.00 Å. In the third Mg site, Mg is bonded in a 2-coordinate geometry to eight Mg and two equivalent Al atoms. Both Mg–Mg bond lengths are 3.23 Å. Both Mg–Al bond lengths are 3.22 Å. In the fourth Mg site, Mg is bonded in a 10-coordinate geometry to eight Mg and two equivalent La atoms. Both Mg–La bond lengths are 3.31 Å. La is bonded in a 12-coordinate geometry to ten Mg and two equivalent Al atoms. Both La–Al bond lengths are 3.19 Å. Al is bonded in a 10-coordinate geometry to eight Mg and two equivalent La atoms.},
doi = {10.17188/1651989},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}