Materials Data on IN3 by Materials Project
Abstract
IN3 crystallizes in the triclinic P1 space group. The structure is one-dimensional and consists of two IN3 clusters. there are five inequivalent N+0.33+ sites. In the first N+0.33+ site, N+0.33+ is bonded in a 1-coordinate geometry to one N+0.33+ atom. The N–N bond length is 1.26 Å. In the second N+0.33+ site, N+0.33+ is bonded in a distorted bent 120 degrees geometry to two N+0.33+ atoms. There is one shorter (1.30 Å) and one longer (1.31 Å) N–N bond length. In the third N+0.33+ site, N+0.33+ is bonded in a distorted trigonal planar geometry to two N+0.33+ and one I1- atom. The N–N bond length is 1.27 Å. The N–I bond length is 2.91 Å. In the fourth N+0.33+ site, N+0.33+ is bonded in a distorted bent 120 degrees geometry to two N+0.33+ atoms. The N–N bond length is 1.31 Å. In the fifth N+0.33+ site, N+0.33+ is bonded in a distorted trigonal planar geometry to two N+0.33+ and one I1- atom. The N–I bond length is 2.91 Å. There are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a 1-coordinate geometry to one N+0.33+ atom. In the second I1- site, I1- is bonded inmore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-684692
- 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; IN3; I-N
- OSTI Identifier:
- 1283963
- DOI:
- https://doi.org/10.17188/1283963
Citation Formats
The Materials Project. Materials Data on IN3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1283963.
The Materials Project. Materials Data on IN3 by Materials Project. United States. doi:https://doi.org/10.17188/1283963
The Materials Project. 2020.
"Materials Data on IN3 by Materials Project". United States. doi:https://doi.org/10.17188/1283963. https://www.osti.gov/servlets/purl/1283963. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1283963,
title = {Materials Data on IN3 by Materials Project},
author = {The Materials Project},
abstractNote = {IN3 crystallizes in the triclinic P1 space group. The structure is one-dimensional and consists of two IN3 clusters. there are five inequivalent N+0.33+ sites. In the first N+0.33+ site, N+0.33+ is bonded in a 1-coordinate geometry to one N+0.33+ atom. The N–N bond length is 1.26 Å. In the second N+0.33+ site, N+0.33+ is bonded in a distorted bent 120 degrees geometry to two N+0.33+ atoms. There is one shorter (1.30 Å) and one longer (1.31 Å) N–N bond length. In the third N+0.33+ site, N+0.33+ is bonded in a distorted trigonal planar geometry to two N+0.33+ and one I1- atom. The N–N bond length is 1.27 Å. The N–I bond length is 2.91 Å. In the fourth N+0.33+ site, N+0.33+ is bonded in a distorted bent 120 degrees geometry to two N+0.33+ atoms. The N–N bond length is 1.31 Å. In the fifth N+0.33+ site, N+0.33+ is bonded in a distorted trigonal planar geometry to two N+0.33+ and one I1- atom. The N–I bond length is 2.91 Å. There are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a 1-coordinate geometry to one N+0.33+ atom. In the second I1- site, I1- is bonded in a 1-coordinate geometry to one N+0.33+ atom.},
doi = {10.17188/1283963},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat May 02 00:00:00 EDT 2020},
month = {Sat May 02 00:00:00 EDT 2020}
}