Materials Data on SbH3SO6 by Materials Project
Abstract
SbH3SO6 is Protactinium structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two SbH3SO6 clusters. Sb3+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sb–O bond distances ranging from 2.09–2.30 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.56 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Sb3+ and one H1+ atom. In the third O2- site, O2- is bonded in a distorted water-like geometry tomore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-720857
- 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; SbH3SO6; H-O-S-Sb
- OSTI Identifier:
- 1287248
- DOI:
- https://doi.org/10.17188/1287248
Citation Formats
The Materials Project. Materials Data on SbH3SO6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1287248.
The Materials Project. Materials Data on SbH3SO6 by Materials Project. United States. doi:https://doi.org/10.17188/1287248
The Materials Project. 2020.
"Materials Data on SbH3SO6 by Materials Project". United States. doi:https://doi.org/10.17188/1287248. https://www.osti.gov/servlets/purl/1287248. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1287248,
title = {Materials Data on SbH3SO6 by Materials Project},
author = {The Materials Project},
abstractNote = {SbH3SO6 is Protactinium structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two SbH3SO6 clusters. Sb3+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sb–O bond distances ranging from 2.09–2.30 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.56 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Sb3+ and one H1+ atom. In the third O2- site, O2- is bonded in a distorted water-like geometry to one Sb3+ and two H1+ atoms. In the fourth O2- site, O2- is bonded in a bent 120 degrees geometry to one Sb3+ and one S6+ atom. In the fifth O2- site, O2- is bonded in a single-bond geometry to one S6+ atom. In the sixth O2- site, O2- is bonded in a distorted single-bond geometry to one S6+ atom.},
doi = {10.17188/1287248},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}