U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LiZnAs by Materials Project
Abstract
LiZnAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent As3- atoms to form LiAs4 tetrahedra that share corners with four equivalent ZnAs4 tetrahedra, corners with twelve equivalent LiAs4 tetrahedra, and edges with six equivalent ZnAs4 tetrahedra. All Li–As bond lengths are 2.59 Å. Zn2+ is bonded to four equivalent As3- atoms to form ZnAs4 tetrahedra that share corners with four equivalent LiAs4 tetrahedra, corners with twelve equivalent ZnAs4 tetrahedra, and edges with six equivalent LiAs4 tetrahedra. All Zn–As bond lengths are 2.59 Å. As3- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Zn2+ atoms.
- Publication Date:
- Other Number(s):
- mp-9124
- 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; As-Li-Zn; LiZnAs; crystal structure
- OSTI Identifier:
- 1312992
- DOI:
- https://doi.org/10.17188/1312992
Citation Formats
Materials Data on LiZnAs by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1312992.
Materials Data on LiZnAs by Materials Project. United States. doi:https://doi.org/10.17188/1312992
2020.
"Materials Data on LiZnAs by Materials Project". United States. doi:https://doi.org/10.17188/1312992. https://www.osti.gov/servlets/purl/1312992. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1312992,
title = {Materials Data on LiZnAs by Materials Project},
abstractNote = {LiZnAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent As3- atoms to form LiAs4 tetrahedra that share corners with four equivalent ZnAs4 tetrahedra, corners with twelve equivalent LiAs4 tetrahedra, and edges with six equivalent ZnAs4 tetrahedra. All Li–As bond lengths are 2.59 Å. Zn2+ is bonded to four equivalent As3- atoms to form ZnAs4 tetrahedra that share corners with four equivalent LiAs4 tetrahedra, corners with twelve equivalent ZnAs4 tetrahedra, and edges with six equivalent LiAs4 tetrahedra. All Zn–As bond lengths are 2.59 Å. As3- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Zn2+ atoms.},
doi = {10.17188/1312992},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}