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Materials Data on Li2SO4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1728938· OSTI ID:1728938
Li2SO4 is Cuprite-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional and consists of four lithium molecules and one LiSO4 framework. In the LiSO4 framework, Li1+ is bonded to four equivalent O2- atoms to form LiO4 tetrahedra that share corners with four equivalent SO4 tetrahedra. All Li–O bond lengths are 1.86 Å. S6+ is bonded to four equivalent O2- atoms to form SO4 tetrahedra that share corners with four equivalent LiO4 tetrahedra. All S–O bond lengths are 1.48 Å. O2- is bonded in a linear geometry to one Li1+ and one S6+ atom.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1728938
Report Number(s):
mp-1222624
Country of Publication:
United States
Language:
English

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