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Title: Materials Data on V2CN by Materials Project

Abstract

V2CN is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. V+3.50+ is bonded to three equivalent C4- and three equivalent N3- atoms to form a mixture of edge and corner-sharing VC3N3 octahedra. The corner-sharing octahedral tilt angles are 0°. All V–C bond lengths are 2.03 Å. All V–N bond lengths are 2.12 Å. C4- is bonded to six equivalent V+3.50+ atoms to form CV6 octahedra that share corners with six equivalent NV6 octahedra, edges with six equivalent CV6 octahedra, and edges with six equivalent NV6 octahedra. The corner-sharing octahedral tilt angles are 4°. N3- is bonded to six equivalent V+3.50+ atoms to form NV6 octahedra that share corners with six equivalent CV6 octahedra, edges with six equivalent CV6 octahedra, and edges with six equivalent NV6 octahedra. The corner-sharing octahedral tilt angles are 4°.

Authors:
Publication Date:
Other Number(s):
mp-1216616
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; V2CN; C-N-V
OSTI Identifier:
1758531
DOI:
https://doi.org/10.17188/1758531

Citation Formats

The Materials Project. Materials Data on V2CN by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1758531.
The Materials Project. Materials Data on V2CN by Materials Project. United States. doi:https://doi.org/10.17188/1758531
The Materials Project. 2020. "Materials Data on V2CN by Materials Project". United States. doi:https://doi.org/10.17188/1758531. https://www.osti.gov/servlets/purl/1758531. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1758531,
title = {Materials Data on V2CN by Materials Project},
author = {The Materials Project},
abstractNote = {V2CN is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. V+3.50+ is bonded to three equivalent C4- and three equivalent N3- atoms to form a mixture of edge and corner-sharing VC3N3 octahedra. The corner-sharing octahedral tilt angles are 0°. All V–C bond lengths are 2.03 Å. All V–N bond lengths are 2.12 Å. C4- is bonded to six equivalent V+3.50+ atoms to form CV6 octahedra that share corners with six equivalent NV6 octahedra, edges with six equivalent CV6 octahedra, and edges with six equivalent NV6 octahedra. The corner-sharing octahedral tilt angles are 4°. N3- is bonded to six equivalent V+3.50+ atoms to form NV6 octahedra that share corners with six equivalent CV6 octahedra, edges with six equivalent CV6 octahedra, and edges with six equivalent NV6 octahedra. The corner-sharing octahedral tilt angles are 4°.},
doi = {10.17188/1758531},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}