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Title: Materials Data on Ho6ReO12 by Materials Project

Abstract

Ho6ReO12 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ho3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Ho–O bond distances ranging from 2.20–2.68 Å. Re6+ is bonded in an octahedral geometry to six equivalent O2- atoms. All Re–O bond lengths are 1.96 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent Ho3+ and one Re6+ atom. In the second O2- site, O2- is bonded to four equivalent Ho3+ atoms to form a mixture of edge and corner-sharing OHo4 tetrahedra.

Publication Date:
Other Number(s):
mp-753766
DOE Contract Number:  
AC02-05CH11231
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Ho-O-Re; Ho6ReO12; crystal structure
OSTI Identifier:
1289126
DOI:
https://doi.org/10.17188/1289126

Citation Formats

Materials Data on Ho6ReO12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1289126.
Materials Data on Ho6ReO12 by Materials Project. United States. doi:https://doi.org/10.17188/1289126
2020. "Materials Data on Ho6ReO12 by Materials Project". United States. doi:https://doi.org/10.17188/1289126. https://www.osti.gov/servlets/purl/1289126. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1289126,
title = {Materials Data on Ho6ReO12 by Materials Project},
abstractNote = {Ho6ReO12 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ho3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Ho–O bond distances ranging from 2.20–2.68 Å. Re6+ is bonded in an octahedral geometry to six equivalent O2- atoms. All Re–O bond lengths are 1.96 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent Ho3+ and one Re6+ atom. In the second O2- site, O2- is bonded to four equivalent Ho3+ atoms to form a mixture of edge and corner-sharing OHo4 tetrahedra.},
doi = {10.17188/1289126},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}