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Title: Materials Data on Li2CaAl by Materials Project

Abstract

Li2CaAl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Al atoms. All Li–Ca bond lengths are 3.02 Å. All Li–Al bond lengths are 3.02 Å. Ca is bonded in a 8-coordinate geometry to eight equivalent Li and six equivalent Al atoms. All Ca–Al bond lengths are 3.49 Å. Al is bonded in a distorted body-centered cubic geometry to eight equivalent Li and six equivalent Ca atoms.

Authors:
Publication Date:
Other Number(s):
mp-1185028
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Li2CaAl; Al-Ca-Li
OSTI Identifier:
1708624
DOI:
https://doi.org/10.17188/1708624

Citation Formats

The Materials Project. Materials Data on Li2CaAl by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1708624.
The Materials Project. Materials Data on Li2CaAl by Materials Project. United States. doi:https://doi.org/10.17188/1708624
The Materials Project. 2020. "Materials Data on Li2CaAl by Materials Project". United States. doi:https://doi.org/10.17188/1708624. https://www.osti.gov/servlets/purl/1708624. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1708624,
title = {Materials Data on Li2CaAl by Materials Project},
author = {The Materials Project},
abstractNote = {Li2CaAl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Al atoms. All Li–Ca bond lengths are 3.02 Å. All Li–Al bond lengths are 3.02 Å. Ca is bonded in a 8-coordinate geometry to eight equivalent Li and six equivalent Al atoms. All Ca–Al bond lengths are 3.49 Å. Al is bonded in a distorted body-centered cubic geometry to eight equivalent Li and six equivalent Ca atoms.},
doi = {10.17188/1708624},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}