U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Li2ZnCl4 by Materials Project
Abstract
Li2ZnCl4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Li1+ is bonded to six equivalent Cl1- atoms to form LiCl6 octahedra that share corners with six equivalent ZnCl4 tetrahedra and edges with six equivalent LiCl6 octahedra. All Li–Cl bond lengths are 2.57 Å. Zn2+ is bonded to four equivalent Cl1- atoms to form ZnCl4 tetrahedra that share corners with twelve equivalent LiCl6 octahedra. The corner-sharing octahedral tilt angles are 56°. All Zn–Cl bond lengths are 2.32 Å. Cl1- is bonded in a distorted rectangular see-saw-like geometry to three equivalent Li1+ and one Zn2+ atom.
- Publication Date:
- Other Number(s):
- mp-22961
- 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; Cl-Li-Zn; Li2ZnCl4; crystal structure
- OSTI Identifier:
- 1199117
- DOI:
- https://doi.org/10.17188/1199117
Citation Formats
Materials Data on Li2ZnCl4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1199117.
Materials Data on Li2ZnCl4 by Materials Project. United States. doi:https://doi.org/10.17188/1199117
2020.
"Materials Data on Li2ZnCl4 by Materials Project". United States. doi:https://doi.org/10.17188/1199117. https://www.osti.gov/servlets/purl/1199117. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1199117,
title = {Materials Data on Li2ZnCl4 by Materials Project},
abstractNote = {Li2ZnCl4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Li1+ is bonded to six equivalent Cl1- atoms to form LiCl6 octahedra that share corners with six equivalent ZnCl4 tetrahedra and edges with six equivalent LiCl6 octahedra. All Li–Cl bond lengths are 2.57 Å. Zn2+ is bonded to four equivalent Cl1- atoms to form ZnCl4 tetrahedra that share corners with twelve equivalent LiCl6 octahedra. The corner-sharing octahedral tilt angles are 56°. All Zn–Cl bond lengths are 2.32 Å. Cl1- is bonded in a distorted rectangular see-saw-like geometry to three equivalent Li1+ and one Zn2+ atom.},
doi = {10.17188/1199117},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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