skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on UPbO4 by Materials Project

Abstract

PbUO4 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. U6+ is bonded to six O2- atoms to form corner-sharing UO6 octahedra. The corner-sharing octahedra tilt angles range from 43–47°. There are a spread of U–O bond distances ranging from 1.93–2.22 Å. Pb2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Pb–O bond distances ranging from 2.45–3.10 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one U6+ and three equivalent Pb2+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent U6+ and two equivalent Pb2+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent U6+ and one Pb2+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-504922
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; UPbO4; O-Pb-U
OSTI Identifier:
1262130
DOI:
10.17188/1262130

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on UPbO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1262130.
Persson, Kristin, & Project, Materials. Materials Data on UPbO4 by Materials Project. United States. doi:10.17188/1262130.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on UPbO4 by Materials Project". United States. doi:10.17188/1262130. https://www.osti.gov/servlets/purl/1262130. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1262130,
title = {Materials Data on UPbO4 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {PbUO4 crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. U6+ is bonded to six O2- atoms to form corner-sharing UO6 octahedra. The corner-sharing octahedra tilt angles range from 43–47°. There are a spread of U–O bond distances ranging from 1.93–2.22 Å. Pb2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Pb–O bond distances ranging from 2.45–3.10 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one U6+ and three equivalent Pb2+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent U6+ and two equivalent Pb2+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent U6+ and one Pb2+ atom.},
doi = {10.17188/1262130},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

Dataset:

Save / Share: