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Title: Materials Data on Mg(C2N3)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1187195· OSTI ID:1187195

Mg(C2N3)2 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Mg2+ is bonded in an octahedral geometry to six N3- atoms. There are four shorter (2.13 Å) and two longer (2.31 Å) Mg–N bond lengths. C4+ is bonded in a linear geometry to two N3- atoms. There is one shorter (1.17 Å) and one longer (1.31 Å) C–N bond length. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a trigonal planar geometry to one Mg2+ and two equivalent C4+ atoms. In the second N3- site, N3- is bonded in a linear geometry to one Mg2+ and one C4+ 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:
1187195
Report Number(s):
mp-10553
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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