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Title: Materials Data on P3(PbO3)4 by Materials Project

Abstract

Pb4(PO4)3 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Pb+2.50+ is bonded to six equivalent O2- atoms to form distorted PbO6 pentagonal pyramids that share corners with six equivalent PO4 tetrahedra and edges with three equivalent PbO6 pentagonal pyramids. There are three shorter (2.42 Å) and three longer (2.69 Å) Pb–O bond lengths. P+4.67+ is bonded to four equivalent O2- atoms to form PO4 tetrahedra that share corners with eight equivalent PbO6 pentagonal pyramids. All P–O bond lengths are 1.56 Å. O2- is bonded in a distorted single-bond geometry to two equivalent Pb+2.50+ and one P+4.67+ atom.

Publication Date:
Other Number(s):
mp-1209812
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; P3(PbO3)4; O-P-Pb
OSTI Identifier:
1651955
DOI:
https://doi.org/10.17188/1651955

Citation Formats

The Materials Project. Materials Data on P3(PbO3)4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1651955.
The Materials Project. Materials Data on P3(PbO3)4 by Materials Project. United States. doi:https://doi.org/10.17188/1651955
The Materials Project. 2020. "Materials Data on P3(PbO3)4 by Materials Project". United States. doi:https://doi.org/10.17188/1651955. https://www.osti.gov/servlets/purl/1651955. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1651955,
title = {Materials Data on P3(PbO3)4 by Materials Project},
author = {The Materials Project},
abstractNote = {Pb4(PO4)3 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Pb+2.50+ is bonded to six equivalent O2- atoms to form distorted PbO6 pentagonal pyramids that share corners with six equivalent PO4 tetrahedra and edges with three equivalent PbO6 pentagonal pyramids. There are three shorter (2.42 Å) and three longer (2.69 Å) Pb–O bond lengths. P+4.67+ is bonded to four equivalent O2- atoms to form PO4 tetrahedra that share corners with eight equivalent PbO6 pentagonal pyramids. All P–O bond lengths are 1.56 Å. O2- is bonded in a distorted single-bond geometry to two equivalent Pb+2.50+ and one P+4.67+ atom.},
doi = {10.17188/1651955},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}