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Title: Materials Data on ZrH24C8(NF3)2 by Materials Project

Abstract

ZrF6(N(CH3)4)2 is Silicon tetrafluoride-derived structured and crystallizes in the trigonal R-3 space group. The structure is zero-dimensional and consists of six tetramethylammonium molecules and three ZrF6 clusters. In each ZrF6 cluster, Zr4+ is bonded in an octahedral geometry to six equivalent F1- atoms. All Zr–F bond lengths are 2.05 Å. F1- is bonded in a single-bond geometry to one Zr4+ atom.

Publication Date:
Other Number(s):
mp-1203669
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; ZrH24C8(NF3)2; C-F-H-N-Zr
OSTI Identifier:
1743876
DOI:
https://doi.org/10.17188/1743876

Citation Formats

The Materials Project. Materials Data on ZrH24C8(NF3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1743876.
The Materials Project. Materials Data on ZrH24C8(NF3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1743876
The Materials Project. 2020. "Materials Data on ZrH24C8(NF3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1743876. https://www.osti.gov/servlets/purl/1743876. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1743876,
title = {Materials Data on ZrH24C8(NF3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {ZrF6(N(CH3)4)2 is Silicon tetrafluoride-derived structured and crystallizes in the trigonal R-3 space group. The structure is zero-dimensional and consists of six tetramethylammonium molecules and three ZrF6 clusters. In each ZrF6 cluster, Zr4+ is bonded in an octahedral geometry to six equivalent F1- atoms. All Zr–F bond lengths are 2.05 Å. F1- is bonded in a single-bond geometry to one Zr4+ atom.},
doi = {10.17188/1743876},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}