Materials Data on Li2S by Materials Project
Li2S crystallizes in the orthorhombic Pna2_1 space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 4-coordinate geometry to one Li1+ and four equivalent S2- atoms. The Li–Li bond length is 2.25 Å. There are a spread of Li–S bond distances ranging from 2.43–2.56 Å. In the second Li1+ site, Li1+ is bonded in a 4-coordinate geometry to one Li1+ and four equivalent S2- atoms. There are a spread of Li–S bond distances ranging from 2.43–2.57 Å. S2- is bonded in a 8-coordinate geometry to eight Li1+ atoms.
- 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:
- 1269717
- Report Number(s):
- mp-557142
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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