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Title: Materials Data on H8PtO6 by Materials Project

Abstract

H2Pt(OH)6 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Pt4+ sites. In the first Pt4+ site, Pt4+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Pt–O bond distances ranging from 2.01–2.08 Å. In the second Pt4+ site, Pt4+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Pt–O bond distances ranging from 2.02–2.05 Å. There are sixteen 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 1.00 Å. In the second H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.06 Å) and one longer (1.54 Å) H–O bond length. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.01 Å. In the fourth H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.09 Å) and one longer (1.42 Å) H–O bond length. In the fifth H1+ site, H1+ is bonded in a distorted single-bond geometry tomore » one O2- atom. The H–O bond length is 1.03 Å. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the seventh H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.06 Å) and one longer (1.53 Å) H–O bond length. In the eighth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the ninth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the tenth H1+ site, H1+ is bonded in a distorted single-bond geometry to one O2- atom. The H–O bond length is 1.01 Å. In the eleventh H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.01 Å. In the twelfth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the thirteenth H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.01 Å) and one longer (1.63 Å) H–O bond length. In the fourteenth H1+ site, H1+ is bonded in a distorted single-bond geometry to one O2- atom. The H–O bond length is 1.02 Å. In the fifteenth H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.61 Å) H–O bond length. In the sixteenth H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.03 Å) and one longer (1.54 Å) H–O bond length. There are twelve inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom. In the second O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the third O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the fourth O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the fifth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom. In the sixth O2- site, O2- is bonded in a 4-coordinate geometry to one Pt4+ and three H1+ atoms. In the seventh O2- site, O2- is bonded in a 2-coordinate geometry to one Pt4+ and two H1+ atoms. In the eighth O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the ninth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and two H1+ atoms. In the tenth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and two H1+ atoms. In the eleventh O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and two H1+ atoms. In the twelfth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom.« less

Authors:
Publication Date:
Other Number(s):
mp-625113
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; H8PtO6; H-O-Pt
OSTI Identifier:
1278305
DOI:
https://doi.org/10.17188/1278305

Citation Formats

The Materials Project. Materials Data on H8PtO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1278305.
The Materials Project. Materials Data on H8PtO6 by Materials Project. United States. doi:https://doi.org/10.17188/1278305
The Materials Project. 2020. "Materials Data on H8PtO6 by Materials Project". United States. doi:https://doi.org/10.17188/1278305. https://www.osti.gov/servlets/purl/1278305. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1278305,
title = {Materials Data on H8PtO6 by Materials Project},
author = {The Materials Project},
abstractNote = {H2Pt(OH)6 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Pt4+ sites. In the first Pt4+ site, Pt4+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Pt–O bond distances ranging from 2.01–2.08 Å. In the second Pt4+ site, Pt4+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Pt–O bond distances ranging from 2.02–2.05 Å. There are sixteen 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 1.00 Å. In the second H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.06 Å) and one longer (1.54 Å) H–O bond length. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.01 Å. In the fourth H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.09 Å) and one longer (1.42 Å) H–O bond length. In the fifth H1+ site, H1+ is bonded in a distorted single-bond geometry to one O2- atom. The H–O bond length is 1.03 Å. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the seventh H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.06 Å) and one longer (1.53 Å) H–O bond length. In the eighth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the ninth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the tenth H1+ site, H1+ is bonded in a distorted single-bond geometry to one O2- atom. The H–O bond length is 1.01 Å. In the eleventh H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.01 Å. In the twelfth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the thirteenth H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.01 Å) and one longer (1.63 Å) H–O bond length. In the fourteenth H1+ site, H1+ is bonded in a distorted single-bond geometry to one O2- atom. The H–O bond length is 1.02 Å. In the fifteenth H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.61 Å) H–O bond length. In the sixteenth H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.03 Å) and one longer (1.54 Å) H–O bond length. There are twelve inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom. In the second O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the third O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the fourth O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the fifth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom. In the sixth O2- site, O2- is bonded in a 4-coordinate geometry to one Pt4+ and three H1+ atoms. In the seventh O2- site, O2- is bonded in a 2-coordinate geometry to one Pt4+ and two H1+ atoms. In the eighth O2- site, O2- is bonded in a distorted water-like geometry to one Pt4+ and two H1+ atoms. In the ninth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and two H1+ atoms. In the tenth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and two H1+ atoms. In the eleventh O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and two H1+ atoms. In the twelfth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom.},
doi = {10.17188/1278305},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat May 02 00:00:00 EDT 2020},
month = {Sat May 02 00:00:00 EDT 2020}
}