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Title: Materials Data on Li2ZnSi by Materials Project

Abstract

Li2ZnSi crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a trigonal planar geometry to three equivalent Si4- atoms. All Li–Si bond lengths are 2.50 Å. In the second Li1+ site, Li1+ is bonded in a 1-coordinate geometry to one Zn2+ and four equivalent Si4- atoms. The Li–Zn bond length is 2.50 Å. There are one shorter (2.61 Å) and three longer (2.86 Å) Li–Si bond lengths. Zn2+ is bonded in a 5-coordinate geometry to one Li1+ and four equivalent Si4- atoms. There are one shorter (2.54 Å) and three longer (2.72 Å) Zn–Si bond lengths. Si4- is bonded in a 11-coordinate geometry to seven Li1+ and four equivalent Zn2+ atoms.

Publication Date:
Other Number(s):
mp-1087492
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; Li2ZnSi; Li-Si-Zn
OSTI Identifier:
1662286
DOI:
https://doi.org/10.17188/1662286

Citation Formats

The Materials Project. Materials Data on Li2ZnSi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1662286.
The Materials Project. Materials Data on Li2ZnSi by Materials Project. United States. doi:https://doi.org/10.17188/1662286
The Materials Project. 2020. "Materials Data on Li2ZnSi by Materials Project". United States. doi:https://doi.org/10.17188/1662286. https://www.osti.gov/servlets/purl/1662286. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1662286,
title = {Materials Data on Li2ZnSi by Materials Project},
author = {The Materials Project},
abstractNote = {Li2ZnSi crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a trigonal planar geometry to three equivalent Si4- atoms. All Li–Si bond lengths are 2.50 Å. In the second Li1+ site, Li1+ is bonded in a 1-coordinate geometry to one Zn2+ and four equivalent Si4- atoms. The Li–Zn bond length is 2.50 Å. There are one shorter (2.61 Å) and three longer (2.86 Å) Li–Si bond lengths. Zn2+ is bonded in a 5-coordinate geometry to one Li1+ and four equivalent Si4- atoms. There are one shorter (2.54 Å) and three longer (2.72 Å) Zn–Si bond lengths. Si4- is bonded in a 11-coordinate geometry to seven Li1+ and four equivalent Zn2+ atoms.},
doi = {10.17188/1662286},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}