skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Li2ZrAl by Materials Project

Abstract

ZrLi2Al crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to four equivalent Li and four equivalent Al atoms to form distorted edge-sharing LiLi4Al4 tetrahedra. All Li–Li bond lengths are 2.85 Å. All Li–Al bond lengths are 2.85 Å. In the second Li site, Li is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Zr atoms. All Li–Zr bond lengths are 2.85 Å. Zr is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Al atoms. All Zr–Al bond lengths are 2.85 Å. Al is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Zr atoms.

Publication Date:
Other Number(s):
mp-1206664
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; Li2ZrAl; Al-Li-Zr
OSTI Identifier:
1680280
DOI:
https://doi.org/10.17188/1680280

Citation Formats

The Materials Project. Materials Data on Li2ZrAl by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1680280.
The Materials Project. Materials Data on Li2ZrAl by Materials Project. United States. doi:https://doi.org/10.17188/1680280
The Materials Project. 2019. "Materials Data on Li2ZrAl by Materials Project". United States. doi:https://doi.org/10.17188/1680280. https://www.osti.gov/servlets/purl/1680280. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1680280,
title = {Materials Data on Li2ZrAl by Materials Project},
author = {The Materials Project},
abstractNote = {ZrLi2Al crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to four equivalent Li and four equivalent Al atoms to form distorted edge-sharing LiLi4Al4 tetrahedra. All Li–Li bond lengths are 2.85 Å. All Li–Al bond lengths are 2.85 Å. In the second Li site, Li is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Zr atoms. All Li–Zr bond lengths are 2.85 Å. Zr is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Al atoms. All Zr–Al bond lengths are 2.85 Å. Al is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Zr atoms.},
doi = {10.17188/1680280},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}