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Title: Materials Data on Bi2Pd3PtO8 by Materials Project

Abstract

PtPd3Bi2O8 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Pt4+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Pt–O bond distances ranging from 2.09–2.25 Å. There are three inequivalent Pd2+ sites. In the first Pd2+ site, Pd2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Pd–O bond lengths are 1.26 Å. In the second Pd2+ site, Pd2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Pd–O bond lengths are 1.65 Å. In the third Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (1.97 Å) and two longer (2.31 Å) Pd–O bond lengths. Bi3+ is bonded in a 2-coordinate geometry to three O2- atoms. There are a spread of Bi–O bond distances ranging from 1.91–2.75 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted T-shaped geometry to two Pd2+ and one Bi3+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to one Pt4+, one Pd2+, and one O2- atom. The O–O bond length is 1.56 Å. In the thirdmore » O2- site, O2- is bonded in a 3-coordinate geometry to one Pt4+, one Bi3+, and one O2- atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+, one Pd2+, and one Bi3+ atom.« less

Publication Date:
Other Number(s):
mp-1227497
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Bi2Pd3PtO8; Bi-O-Pd-Pt
OSTI Identifier:
1655611
DOI:
https://doi.org/10.17188/1655611

Citation Formats

The Materials Project. Materials Data on Bi2Pd3PtO8 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1655611.
The Materials Project. Materials Data on Bi2Pd3PtO8 by Materials Project. United States. doi:https://doi.org/10.17188/1655611
The Materials Project. 2019. "Materials Data on Bi2Pd3PtO8 by Materials Project". United States. doi:https://doi.org/10.17188/1655611. https://www.osti.gov/servlets/purl/1655611. Pub date:Sun Jan 13 00:00:00 EST 2019
@article{osti_1655611,
title = {Materials Data on Bi2Pd3PtO8 by Materials Project},
author = {The Materials Project},
abstractNote = {PtPd3Bi2O8 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Pt4+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Pt–O bond distances ranging from 2.09–2.25 Å. There are three inequivalent Pd2+ sites. In the first Pd2+ site, Pd2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Pd–O bond lengths are 1.26 Å. In the second Pd2+ site, Pd2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Pd–O bond lengths are 1.65 Å. In the third Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (1.97 Å) and two longer (2.31 Å) Pd–O bond lengths. Bi3+ is bonded in a 2-coordinate geometry to three O2- atoms. There are a spread of Bi–O bond distances ranging from 1.91–2.75 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted T-shaped geometry to two Pd2+ and one Bi3+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to one Pt4+, one Pd2+, and one O2- atom. The O–O bond length is 1.56 Å. In the third O2- site, O2- is bonded in a 3-coordinate geometry to one Pt4+, one Bi3+, and one O2- atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to one Pt4+, one Pd2+, and one Bi3+ atom.},
doi = {10.17188/1655611},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}