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Title: Materials Data on CrN2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1318894· OSTI ID:1318894

CrN2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Cr6+ is bonded in a 6-coordinate geometry to six N3- atoms. There are a spread of Cr–N bond distances ranging from 1.65–2.27 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a T-shaped geometry to three equivalent Cr6+ atoms. In the second N3- site, N3- is bonded in a distorted single-bond geometry to three equivalent Cr6+ 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:
1318894
Report Number(s):
mvc-13461
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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