U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on VSO10 by Materials Project
Abstract
VSO8O2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four oxygen molecules and four VSO8 clusters. In each VSO8 cluster, V is bonded to five O atoms to form distorted VO5 trigonal bipyramids that share a cornercorner with one SO4 tetrahedra. There are a spread of V–O bond distances ranging from 1.63–1.95 Å. S is bonded to four O atoms to form SO4 tetrahedra that share a cornercorner with one VO5 trigonal bipyramid. There are a spread of S–O bond distances ranging from 1.47–1.53 Å. There are eight inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one S atom. In the second O site, O is bonded in a single-bond geometry to one S atom. In the third O site, O is bonded in a single-bond geometry to one V atom. In the fourth O site, O is bonded in a single-bond geometry to one S atom. In the fifth O site, O is bonded in a single-bond geometry to one V atom. In the sixth O site, O is bonded in a single-bond geometry to one V atom. In the seventh O site, O ismore »
- Publication Date:
- Other Number(s):
- mp-1196443
- DOE Contract Number:
- AC02-05CH11231;
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; O-S-V; VSO10
- OSTI Identifier:
- 1674652
- DOI:
- https://doi.org/10.17188/1674652
Citation Formats
Materials Data on VSO10 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1674652.
Materials Data on VSO10 by Materials Project. United States. doi:https://doi.org/10.17188/1674652
2020.
"Materials Data on VSO10 by Materials Project". United States. doi:https://doi.org/10.17188/1674652. https://www.osti.gov/servlets/purl/1674652. Pub date:Thu Apr 30 20:00:00 EDT 2020
@article{osti_1674652,
title = {Materials Data on VSO10 by Materials Project},
abstractNote = {VSO8O2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four oxygen molecules and four VSO8 clusters. In each VSO8 cluster, V is bonded to five O atoms to form distorted VO5 trigonal bipyramids that share a cornercorner with one SO4 tetrahedra. There are a spread of V–O bond distances ranging from 1.63–1.95 Å. S is bonded to four O atoms to form SO4 tetrahedra that share a cornercorner with one VO5 trigonal bipyramid. There are a spread of S–O bond distances ranging from 1.47–1.53 Å. There are eight inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one S atom. In the second O site, O is bonded in a single-bond geometry to one S atom. In the third O site, O is bonded in a single-bond geometry to one V atom. In the fourth O site, O is bonded in a single-bond geometry to one S atom. In the fifth O site, O is bonded in a single-bond geometry to one V atom. In the sixth O site, O is bonded in a single-bond geometry to one V atom. In the seventh O site, O is bonded in a single-bond geometry to one V atom. In the eighth O site, O is bonded in a distorted bent 150 degrees geometry to one V and one S atom.},
doi = {10.17188/1674652},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}