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Title: Materials Data on Rb2PSO8 by Materials Project

Abstract

Rb2PSO8 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Rb–O bond distances ranging from 2.93–3.31 Å. In the second Rb site, Rb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Rb–O bond distances ranging from 2.91–3.38 Å. P is bonded in a tetrahedral geometry to four O atoms. There are a spread of P–O bond distances ranging from 1.53–1.55 Å. S is bonded in a tetrahedral geometry to four O atoms. There are a spread of S–O bond distances ranging from 1.48–1.50 Å. There are eight inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to three Rb and one P atom. In the second O site, O is bonded in a distorted single-bond geometry to three Rb and one S atom. In the third O site, O is bonded in a distorted single-bond geometry to two Rb and one P atom. In the fourth O site, O is bonded in a distorted single-bond geometry tomore » two Rb and one S atom. In the fifth O site, O is bonded in a single-bond geometry to two Rb and one P atom. In the sixth O site, O is bonded in a single-bond geometry to two Rb and one S atom. In the seventh O site, O is bonded in a distorted single-bond geometry to two Rb and one P atom. In the eighth O site, O is bonded in a distorted single-bond geometry to two Rb and one S atom.« less

Authors:
Publication Date:
Other Number(s):
mp-1219832
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; Rb2PSO8; O-P-Rb-S
OSTI Identifier:
1740283
DOI:
https://doi.org/10.17188/1740283

Citation Formats

The Materials Project. Materials Data on Rb2PSO8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1740283.
The Materials Project. Materials Data on Rb2PSO8 by Materials Project. United States. doi:https://doi.org/10.17188/1740283
The Materials Project. 2020. "Materials Data on Rb2PSO8 by Materials Project". United States. doi:https://doi.org/10.17188/1740283. https://www.osti.gov/servlets/purl/1740283. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1740283,
title = {Materials Data on Rb2PSO8 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb2PSO8 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Rb–O bond distances ranging from 2.93–3.31 Å. In the second Rb site, Rb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Rb–O bond distances ranging from 2.91–3.38 Å. P is bonded in a tetrahedral geometry to four O atoms. There are a spread of P–O bond distances ranging from 1.53–1.55 Å. S is bonded in a tetrahedral geometry to four O atoms. There are a spread of S–O bond distances ranging from 1.48–1.50 Å. There are eight inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to three Rb and one P atom. In the second O site, O is bonded in a distorted single-bond geometry to three Rb and one S atom. In the third O site, O is bonded in a distorted single-bond geometry to two Rb and one P atom. In the fourth O site, O is bonded in a distorted single-bond geometry to two Rb and one S atom. In the fifth O site, O is bonded in a single-bond geometry to two Rb and one P atom. In the sixth O site, O is bonded in a single-bond geometry to two Rb and one S atom. In the seventh O site, O is bonded in a distorted single-bond geometry to two Rb and one P atom. In the eighth O site, O is bonded in a distorted single-bond geometry to two Rb and one S atom.},
doi = {10.17188/1740283},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}