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Title: Materials Data on BC2N by Materials Project

Abstract

BC2N crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. B3+ is bonded in a trigonal planar geometry to two equivalent C and one N3- atom. Both B–C bond lengths are 1.60 Å. The B–N bond length is 1.42 Å. C is bonded to one B3+, two equivalent C, and one N3- atom to form distorted corner-sharing CBC2N tetrahedra. There is one shorter (1.57 Å) and one longer (1.60 Å) C–C bond length. The C–N bond length is 1.47 Å. N3- is bonded in a trigonal planar geometry to one B3+ and two equivalent C atoms.

Authors:
Publication Date:
Other Number(s):
mp-1078541
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; BC2N; B-C-N
OSTI Identifier:
1705750
DOI:
https://doi.org/10.17188/1705750

Citation Formats

The Materials Project. Materials Data on BC2N by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1705750.
The Materials Project. Materials Data on BC2N by Materials Project. United States. doi:https://doi.org/10.17188/1705750
The Materials Project. 2020. "Materials Data on BC2N by Materials Project". United States. doi:https://doi.org/10.17188/1705750. https://www.osti.gov/servlets/purl/1705750. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1705750,
title = {Materials Data on BC2N by Materials Project},
author = {The Materials Project},
abstractNote = {BC2N crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. B3+ is bonded in a trigonal planar geometry to two equivalent C and one N3- atom. Both B–C bond lengths are 1.60 Å. The B–N bond length is 1.42 Å. C is bonded to one B3+, two equivalent C, and one N3- atom to form distorted corner-sharing CBC2N tetrahedra. There is one shorter (1.57 Å) and one longer (1.60 Å) C–C bond length. The C–N bond length is 1.47 Å. N3- is bonded in a trigonal planar geometry to one B3+ and two equivalent C atoms.},
doi = {10.17188/1705750},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}