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Title: Materials Data on Sb4NF13 by Materials Project

Abstract

Sb4NF13 crystallizes in the tetragonal I4/m space group. The structure is one-dimensional and consists of two Sb4NF13 ribbons oriented in the (0, 0, 1) direction. Sb4+ is bonded in a 3-coordinate geometry to four F1- atoms. There are a spread of Sb–F bond distances ranging from 1.94–2.69 Å. N3- is bonded in a 10-coordinate geometry to ten F1- atoms. There are eight shorter (2.86 Å) and two longer (3.04 Å) N–F bond lengths. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb4+ atom. In the second F1- site, F1- is bonded in a 6-coordinate geometry to four equivalent Sb4+, two equivalent N3-, and eight equivalent F1- atoms. All F–F bond lengths are 2.71 Å. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb4+, one N3-, and one F1- atom.

Authors:
Publication Date:
Other Number(s):
mp-1209209
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; Sb4NF13; F-N-Sb
OSTI Identifier:
1738557
DOI:
https://doi.org/10.17188/1738557

Citation Formats

The Materials Project. Materials Data on Sb4NF13 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1738557.
The Materials Project. Materials Data on Sb4NF13 by Materials Project. United States. doi:https://doi.org/10.17188/1738557
The Materials Project. 2020. "Materials Data on Sb4NF13 by Materials Project". United States. doi:https://doi.org/10.17188/1738557. https://www.osti.gov/servlets/purl/1738557. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1738557,
title = {Materials Data on Sb4NF13 by Materials Project},
author = {The Materials Project},
abstractNote = {Sb4NF13 crystallizes in the tetragonal I4/m space group. The structure is one-dimensional and consists of two Sb4NF13 ribbons oriented in the (0, 0, 1) direction. Sb4+ is bonded in a 3-coordinate geometry to four F1- atoms. There are a spread of Sb–F bond distances ranging from 1.94–2.69 Å. N3- is bonded in a 10-coordinate geometry to ten F1- atoms. There are eight shorter (2.86 Å) and two longer (3.04 Å) N–F bond lengths. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb4+ atom. In the second F1- site, F1- is bonded in a 6-coordinate geometry to four equivalent Sb4+, two equivalent N3-, and eight equivalent F1- atoms. All F–F bond lengths are 2.71 Å. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb4+, one N3-, and one F1- atom.},
doi = {10.17188/1738557},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}