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Title: Materials Data on LiCu2Si by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1268460· OSTI ID:1268460

LiCu2Si is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li1+ is bonded in a 8-coordinate geometry to eight equivalent Cu+1.50+ and six equivalent Si4- atoms. All Li–Cu bond lengths are 2.48 Å. All Li–Si bond lengths are 2.86 Å. Cu+1.50+ is bonded in a distorted body-centered cubic geometry to four equivalent Li1+ and four equivalent Si4- atoms. All Cu–Si bond lengths are 2.48 Å. Si4- is bonded in a 8-coordinate geometry to six equivalent Li1+ and eight equivalent Cu+1.50+ 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:
1268460
Report Number(s):
mp-7473
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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