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Title: Materials Data on Y(HO)3 by Materials Project

Abstract

Y(OH)3 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are two inequivalent Y3+ sites. In the first Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.40–2.64 Å. In the second Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.40–2.62 Å. There are six inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the sixth H1+ site,more » H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the fifth O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the sixth O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom.« less

Publication Date:
Other Number(s):
mp-625718
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; H-O-Y; Y(HO)3; crystal structure
OSTI Identifier:
1278455
DOI:
https://doi.org/10.17188/1278455

Citation Formats

Materials Data on Y(HO)3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1278455.
Materials Data on Y(HO)3 by Materials Project. United States. doi:https://doi.org/10.17188/1278455
2020. "Materials Data on Y(HO)3 by Materials Project". United States. doi:https://doi.org/10.17188/1278455. https://www.osti.gov/servlets/purl/1278455. Pub date:Sat Jul 18 04:00:00 UTC 2020
@article{osti_1278455,
title = {Materials Data on Y(HO)3 by Materials Project},
abstractNote = {Y(OH)3 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are two inequivalent Y3+ sites. In the first Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.40–2.64 Å. In the second Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.40–2.62 Å. There are six inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.97 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the fifth O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom. In the sixth O2- site, O2- is bonded in a single-bond geometry to three Y3+ and one H1+ atom.},
doi = {10.17188/1278455},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}