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Title: Materials Data on RbP(HO2)2 by Materials Project

Abstract

RbH2PO4 crystallizes in the orthorhombic Fdd2 space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 3.03–3.11 Å. P5+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.53 Å) and two longer (1.59 Å) P–O bond length. H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.05 Å) and one longer (1.46 Å) H–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Rb1+, one P5+, and one H1+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Rb1+, one P5+, and one H1+ atom.

Authors:
Publication Date:
Other Number(s):
mp-23667
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(HO2)2; H-O-P-Rb
OSTI Identifier:
1199649
DOI:
https://doi.org/10.17188/1199649

Citation Formats

The Materials Project. Materials Data on RbP(HO2)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199649.
The Materials Project. Materials Data on RbP(HO2)2 by Materials Project. United States. doi:https://doi.org/10.17188/1199649
The Materials Project. 2020. "Materials Data on RbP(HO2)2 by Materials Project". United States. doi:https://doi.org/10.17188/1199649. https://www.osti.gov/servlets/purl/1199649. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1199649,
title = {Materials Data on RbP(HO2)2 by Materials Project},
author = {The Materials Project},
abstractNote = {RbH2PO4 crystallizes in the orthorhombic Fdd2 space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 3.03–3.11 Å. P5+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.53 Å) and two longer (1.59 Å) P–O bond length. H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.05 Å) and one longer (1.46 Å) H–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Rb1+, one P5+, and one H1+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Rb1+, one P5+, and one H1+ atom.},
doi = {10.17188/1199649},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Tue Jul 14 00:00:00 EDT 2020},
month = {Tue Jul 14 00:00:00 EDT 2020}
}