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Title: Materials Data on Li2GePbS4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1195083· OSTI ID:1195083

Li2PbGeS4 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Li1+ is bonded in a distorted square co-planar geometry to four equivalent S2- atoms. All Li–S bond lengths are 2.47 Å. Pb2+ is bonded in a 8-coordinate geometry to eight equivalent S2- atoms. There are four shorter (3.10 Å) and four longer (3.23 Å) Pb–S bond lengths. Ge4+ is bonded in a tetrahedral geometry to four equivalent S2- atoms. All Ge–S bond lengths are 2.24 Å. S2- is bonded in a 3-coordinate geometry to two equivalent Li1+, two equivalent Pb2+, and one Ge4+ atom.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1195083
Report Number(s):
mp-19896
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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