U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ReSb(OF4)2 by Materials Project
Abstract
ReSb(OF4)2 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two ReSb(OF4)2 ribbons oriented in the (0, 1, 0) direction. Re7+ is bonded in a 6-coordinate geometry to two O2- and four F1- atoms. Both Re–O bond lengths are 1.70 Å. There are a spread of Re–F bond distances ranging from 1.85–2.26 Å. There are two inequivalent Sb5+ sites. In the first Sb5+ site, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Sb–F bond distances ranging from 1.89–2.00 Å. In the second Sb5+ site, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is four shorter (1.89 Å) and two longer (2.01 Å) Sb–F bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one Re7+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one Re7+ atom. There are eight inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Re7+ and one Sb5+ atom. In the second F1- site, F1- is bonded in a single-bond geometrymore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-558576
- 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; ReSb(OF4)2; F-O-Re-Sb
- OSTI Identifier:
- 1270400
- DOI:
- https://doi.org/10.17188/1270400
Citation Formats
The Materials Project. Materials Data on ReSb(OF4)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1270400.
The Materials Project. Materials Data on ReSb(OF4)2 by Materials Project. United States. doi:https://doi.org/10.17188/1270400
The Materials Project. 2020.
"Materials Data on ReSb(OF4)2 by Materials Project". United States. doi:https://doi.org/10.17188/1270400. https://www.osti.gov/servlets/purl/1270400. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1270400,
title = {Materials Data on ReSb(OF4)2 by Materials Project},
author = {The Materials Project},
abstractNote = {ReSb(OF4)2 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two ReSb(OF4)2 ribbons oriented in the (0, 1, 0) direction. Re7+ is bonded in a 6-coordinate geometry to two O2- and four F1- atoms. Both Re–O bond lengths are 1.70 Å. There are a spread of Re–F bond distances ranging from 1.85–2.26 Å. There are two inequivalent Sb5+ sites. In the first Sb5+ site, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of Sb–F bond distances ranging from 1.89–2.00 Å. In the second Sb5+ site, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is four shorter (1.89 Å) and two longer (2.01 Å) Sb–F bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one Re7+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one Re7+ atom. There are eight inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Re7+ and one Sb5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the fourth F1- site, F1- is bonded in a bent 150 degrees geometry to one Re7+ and one Sb5+ atom. In the fifth F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the sixth F1- site, F1- is bonded in a single-bond geometry to one Re7+ atom. In the seventh F1- site, F1- is bonded in a single-bond geometry to one Re7+ atom. In the eighth F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.},
doi = {10.17188/1270400},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 15 00:00:00 EDT 2020},
month = {Wed Jul 15 00:00:00 EDT 2020}
}