Materials Data on SbPO6 by Materials Project
Abstract
SbPO6 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one SbPO6 sheet oriented in the (0, 0, 1) direction. Sb is bonded in a distorted rectangular see-saw-like geometry to four O atoms. There are a spread of Sb–O bond distances ranging from 1.97–2.43 Å. P is bonded in a distorted trigonal planar geometry to four O atoms. There are a spread of P–O bond distances ranging from 1.47–2.38 Å. There are six inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one Sb and one P atom. In the second O site, O is bonded in a bent 120 degrees geometry to one P and one O atom. The O–O bond length is 1.23 Å. In the third O site, O is bonded in a single-bond geometry to one P atom. In the fourth O site, O is bonded in a distorted bent 120 degrees geometry to one Sb and one P atom. In the fifth O site, O is bonded in a bent 120 degrees geometry to two equivalent Sb atoms. In the sixth O site, O is bonded in a single-bond geometry to onemore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-1204861
- 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; SbPO6; O-P-Sb
- OSTI Identifier:
- 1717213
- DOI:
- https://doi.org/10.17188/1717213
Citation Formats
The Materials Project. Materials Data on SbPO6 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1717213.
The Materials Project. Materials Data on SbPO6 by Materials Project. United States. doi:https://doi.org/10.17188/1717213
The Materials Project. 2019.
"Materials Data on SbPO6 by Materials Project". United States. doi:https://doi.org/10.17188/1717213. https://www.osti.gov/servlets/purl/1717213. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1717213,
title = {Materials Data on SbPO6 by Materials Project},
author = {The Materials Project},
abstractNote = {SbPO6 crystallizes in the monoclinic P2_1/c space group. The structure is two-dimensional and consists of one SbPO6 sheet oriented in the (0, 0, 1) direction. Sb is bonded in a distorted rectangular see-saw-like geometry to four O atoms. There are a spread of Sb–O bond distances ranging from 1.97–2.43 Å. P is bonded in a distorted trigonal planar geometry to four O atoms. There are a spread of P–O bond distances ranging from 1.47–2.38 Å. There are six inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one Sb and one P atom. In the second O site, O is bonded in a bent 120 degrees geometry to one P and one O atom. The O–O bond length is 1.23 Å. In the third O site, O is bonded in a single-bond geometry to one P atom. In the fourth O site, O is bonded in a distorted bent 120 degrees geometry to one Sb and one P atom. In the fifth O site, O is bonded in a bent 120 degrees geometry to two equivalent Sb atoms. In the sixth O site, O is bonded in a single-bond geometry to one O atom.},
doi = {10.17188/1717213},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}