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Title: Materials Data on Rb3HoO3 by Materials Project

Abstract

Rb3HoO3 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 1-coordinate geometry to five O2- atoms. There are a spread of Rb–O bond distances ranging from 2.68–3.21 Å. In the second Rb1+ site, Rb1+ is bonded in a 4-coordinate geometry to four equivalent O2- atoms. There are two shorter (2.84 Å) and two longer (3.24 Å) Rb–O bond lengths. In the third Rb1+ site, Rb1+ is bonded in a 4-coordinate geometry to four equivalent O2- atoms. There are two shorter (2.93 Å) and two longer (3.21 Å) Rb–O bond lengths. Ho3+ is bonded to four O2- atoms to form edge-sharing HoO4 tetrahedra. There are a spread of Ho–O bond distances ranging from 2.11–2.19 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to one Rb1+ and two equivalent Ho3+ atoms. In the second O2- site, O2- is bonded in a 7-coordinate geometry to six Rb1+ and one Ho3+ atom.

Authors:
Publication Date:
Other Number(s):
mp-754161
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; Rb3HoO3; Ho-O-Rb
OSTI Identifier:
1289273
DOI:
https://doi.org/10.17188/1289273

Citation Formats

The Materials Project. Materials Data on Rb3HoO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1289273.
The Materials Project. Materials Data on Rb3HoO3 by Materials Project. United States. doi:https://doi.org/10.17188/1289273
The Materials Project. 2020. "Materials Data on Rb3HoO3 by Materials Project". United States. doi:https://doi.org/10.17188/1289273. https://www.osti.gov/servlets/purl/1289273. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1289273,
title = {Materials Data on Rb3HoO3 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb3HoO3 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 1-coordinate geometry to five O2- atoms. There are a spread of Rb–O bond distances ranging from 2.68–3.21 Å. In the second Rb1+ site, Rb1+ is bonded in a 4-coordinate geometry to four equivalent O2- atoms. There are two shorter (2.84 Å) and two longer (3.24 Å) Rb–O bond lengths. In the third Rb1+ site, Rb1+ is bonded in a 4-coordinate geometry to four equivalent O2- atoms. There are two shorter (2.93 Å) and two longer (3.21 Å) Rb–O bond lengths. Ho3+ is bonded to four O2- atoms to form edge-sharing HoO4 tetrahedra. There are a spread of Ho–O bond distances ranging from 2.11–2.19 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to one Rb1+ and two equivalent Ho3+ atoms. In the second O2- site, O2- is bonded in a 7-coordinate geometry to six Rb1+ and one Ho3+ atom.},
doi = {10.17188/1289273},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}