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Materials Data on BN by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1280475· OSTI ID:1280475
BN is SC16 CuCl, stable at 5GPa-like structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. B3+ is bonded to four equivalent N3- atoms to form a mixture of edge and corner-sharing BN4 tetrahedra. There are a spread of B–N bond distances ranging from 1.51–1.65 Å. N3- is bonded to four equivalent B3+ atoms to form a mixture of distorted edge and corner-sharing NB4 trigonal pyramids.
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:
1280475
Report Number(s):
mp-644751
Country of Publication:
United States
Language:
English

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