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Title: Materials Data on TlCo(NCl)6 by Materials Project

Abstract

CoTl(NCl)6 is Halite, Rock Salt structured and crystallizes in the cubic Pa-3 space group. The structure is zero-dimensional and consists of four cobalt molecules and four Tl(NCl)6 clusters. In each Tl(NCl)6 cluster, Tl1+ is bonded in an octahedral geometry to six equivalent Cl1- atoms. All Tl–Cl bond lengths are 3.81 Å. N+0.33+ is bonded in a single-bond geometry to one Cl1- atom. The N–Cl bond length is 1.66 Å. Cl1- is bonded in a distorted single-bond geometry to one Tl1+ and one N+0.33+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1199809
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; TlCo(NCl)6; Cl-Co-N-Tl
OSTI Identifier:
1734110
DOI:
https://doi.org/10.17188/1734110

Citation Formats

The Materials Project. Materials Data on TlCo(NCl)6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1734110.
The Materials Project. Materials Data on TlCo(NCl)6 by Materials Project. United States. doi:https://doi.org/10.17188/1734110
The Materials Project. 2020. "Materials Data on TlCo(NCl)6 by Materials Project". United States. doi:https://doi.org/10.17188/1734110. https://www.osti.gov/servlets/purl/1734110. Pub date:Fri May 01 00:00:00 EDT 2020
@article{osti_1734110,
title = {Materials Data on TlCo(NCl)6 by Materials Project},
author = {The Materials Project},
abstractNote = {CoTl(NCl)6 is Halite, Rock Salt structured and crystallizes in the cubic Pa-3 space group. The structure is zero-dimensional and consists of four cobalt molecules and four Tl(NCl)6 clusters. In each Tl(NCl)6 cluster, Tl1+ is bonded in an octahedral geometry to six equivalent Cl1- atoms. All Tl–Cl bond lengths are 3.81 Å. N+0.33+ is bonded in a single-bond geometry to one Cl1- atom. The N–Cl bond length is 1.66 Å. Cl1- is bonded in a distorted single-bond geometry to one Tl1+ and one N+0.33+ atom.},
doi = {10.17188/1734110},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}