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Title: Materials Data on LiCN by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1204484· OSTI ID:1204484

LiCN crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of two LiCN ribbons oriented in the (1, 0, 0) direction. Li1+ is bonded in a distorted T-shaped geometry to three equivalent N3- atoms. There are one shorter (2.07 Å) and two longer (2.18 Å) Li–N bond lengths. C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.18 Å. N3- is bonded in a see-saw-like geometry to three equivalent Li1+ and one C2+ 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:
1204484
Report Number(s):
mp-30057
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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