Materials Data on RbP(OF)2 by Materials Project
Abstract
RbP(OF)2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to six equivalent O2- and two F1- atoms. There are a spread of Rb–O bond distances ranging from 2.94–3.20 Å. There are one shorter (3.07 Å) and one longer (3.31 Å) Rb–F bond lengths. P5+ is bonded in a tetrahedral geometry to two equivalent O2- and two F1- atoms. Both P–O bond lengths are 1.49 Å. Both P–F bond lengths are 1.60 Å. O2- is bonded in a distorted single-bond geometry to three equivalent Rb1+ and one P5+ atom. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Rb1+ and one P5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Rb1+ and one P5+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-558162
- 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; RbP(OF)2; F-O-P-Rb
- OSTI Identifier:
- 1270193
- DOI:
- https://doi.org/10.17188/1270193
Citation Formats
The Materials Project. Materials Data on RbP(OF)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1270193.
The Materials Project. Materials Data on RbP(OF)2 by Materials Project. United States. doi:https://doi.org/10.17188/1270193
The Materials Project. 2020.
"Materials Data on RbP(OF)2 by Materials Project". United States. doi:https://doi.org/10.17188/1270193. https://www.osti.gov/servlets/purl/1270193. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1270193,
title = {Materials Data on RbP(OF)2 by Materials Project},
author = {The Materials Project},
abstractNote = {RbP(OF)2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to six equivalent O2- and two F1- atoms. There are a spread of Rb–O bond distances ranging from 2.94–3.20 Å. There are one shorter (3.07 Å) and one longer (3.31 Å) Rb–F bond lengths. P5+ is bonded in a tetrahedral geometry to two equivalent O2- and two F1- atoms. Both P–O bond lengths are 1.49 Å. Both P–F bond lengths are 1.60 Å. O2- is bonded in a distorted single-bond geometry to three equivalent Rb1+ and one P5+ atom. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Rb1+ and one P5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Rb1+ and one P5+ atom.},
doi = {10.17188/1270193},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}