DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on SrCN2 by Materials Project

Abstract

SrCN2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr2+ is bonded to six N3- atoms to form a mixture of corner and edge-sharing SrN6 octahedra. The corner-sharing octahedral tilt angles are 65°. There are a spread of Sr–N bond distances ranging from 2.63–2.70 Å. C4+ is bonded in a linear geometry to two N3- atoms. Both C–N bond lengths are 1.24 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded to three equivalent Sr2+ and one C4+ atom to form a mixture of distorted corner and edge-sharing NSr3C tetrahedra. In the second N3- site, N3- is bonded to three equivalent Sr2+ and one C4+ atom to form a mixture of distorted corner and edge-sharing NSr3C tetrahedra.

Authors:
Publication Date:
Other Number(s):
mp-9167
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; SrCN2; C-N-Sr
OSTI Identifier:
1313027
DOI:
https://doi.org/10.17188/1313027

Citation Formats

The Materials Project. Materials Data on SrCN2 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1313027.
The Materials Project. Materials Data on SrCN2 by Materials Project. United States. doi:https://doi.org/10.17188/1313027
The Materials Project. 2017. "Materials Data on SrCN2 by Materials Project". United States. doi:https://doi.org/10.17188/1313027. https://www.osti.gov/servlets/purl/1313027. Pub date:Thu May 25 00:00:00 EDT 2017
@article{osti_1313027,
title = {Materials Data on SrCN2 by Materials Project},
author = {The Materials Project},
abstractNote = {SrCN2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr2+ is bonded to six N3- atoms to form a mixture of corner and edge-sharing SrN6 octahedra. The corner-sharing octahedral tilt angles are 65°. There are a spread of Sr–N bond distances ranging from 2.63–2.70 Å. C4+ is bonded in a linear geometry to two N3- atoms. Both C–N bond lengths are 1.24 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded to three equivalent Sr2+ and one C4+ atom to form a mixture of distorted corner and edge-sharing NSr3C tetrahedra. In the second N3- site, N3- is bonded to three equivalent Sr2+ and one C4+ atom to form a mixture of distorted corner and edge-sharing NSr3C tetrahedra.},
doi = {10.17188/1313027},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}