U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on AsS4N4F5 by Materials Project
Abstract
(NS)4AsF5 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four 1,3,5,7,2,4,6,8-tetrathiatetrazocane molecules and four AsF5 clusters. In each AsF5 cluster, As5+ is bonded in a square pyramidal geometry to five F1- atoms. There are a spread of As–F bond distances ranging from 1.77–1.79 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the fifth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-558254
- 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; AsS4N4F5; As-F-N-S
- OSTI Identifier:
- 1270243
- DOI:
- https://doi.org/10.17188/1270243
Citation Formats
The Materials Project. Materials Data on AsS4N4F5 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1270243.
The Materials Project. Materials Data on AsS4N4F5 by Materials Project. United States. doi:https://doi.org/10.17188/1270243
The Materials Project. 2020.
"Materials Data on AsS4N4F5 by Materials Project". United States. doi:https://doi.org/10.17188/1270243. https://www.osti.gov/servlets/purl/1270243. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1270243,
title = {Materials Data on AsS4N4F5 by Materials Project},
author = {The Materials Project},
abstractNote = {(NS)4AsF5 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four 1,3,5,7,2,4,6,8-tetrathiatetrazocane molecules and four AsF5 clusters. In each AsF5 cluster, As5+ is bonded in a square pyramidal geometry to five F1- atoms. There are a spread of As–F bond distances ranging from 1.77–1.79 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom. In the fifth F1- site, F1- is bonded in a single-bond geometry to one As5+ atom.},
doi = {10.17188/1270243},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Apr 29 00:00:00 EDT 2020},
month = {Wed Apr 29 00:00:00 EDT 2020}
}