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Materials Data on Mg(CrN)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1318887· OSTI ID:1318887
Mg(CrN)2 crystallizes in the tetragonal P-4m2 space group. The structure is two-dimensional and consists of one Mg(CrN)2 sheet oriented in the (0, 0, 1) direction. Mg2+ is bonded to four equivalent N3- atoms to form corner-sharing MgN4 tetrahedra. All Mg–N bond lengths are 2.24 Å. Cr2+ is bonded in a linear geometry to two equivalent N3- atoms. Both Cr–N bond lengths are 1.85 Å. N3- is bonded in a see-saw-like geometry to two equivalent Mg2+ and two equivalent Cr2+ atoms.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1318887
Report Number(s):
mvc-13436
Country of Publication:
United States
Language:
English

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