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Title: Materials Data on PuGa6 by Materials Project

Abstract

PuGa6 crystallizes in the tetragonal P4/nbm space group. The structure is three-dimensional. Pu is bonded to twelve Ga atoms to form a mixture of edge and face-sharing PuGa12 cuboctahedra. There are four shorter (3.10 Å) and eight longer (3.18 Å) Pu–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 4-coordinate geometry to one Pu and three Ga atoms. There are one shorter (2.56 Å) and two longer (2.62 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Pu and five Ga atoms. The Ga–Ga bond length is 2.41 Å.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-636291
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; PuGa6; Ga-Pu
OSTI Identifier:
1279572
DOI:
10.17188/1279572

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on PuGa6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279572.
Persson, Kristin, & Project, Materials. Materials Data on PuGa6 by Materials Project. United States. doi:10.17188/1279572.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on PuGa6 by Materials Project". United States. doi:10.17188/1279572. https://www.osti.gov/servlets/purl/1279572. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1279572,
title = {Materials Data on PuGa6 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {PuGa6 crystallizes in the tetragonal P4/nbm space group. The structure is three-dimensional. Pu is bonded to twelve Ga atoms to form a mixture of edge and face-sharing PuGa12 cuboctahedra. There are four shorter (3.10 Å) and eight longer (3.18 Å) Pu–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 4-coordinate geometry to one Pu and three Ga atoms. There are one shorter (2.56 Å) and two longer (2.62 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Pu and five Ga atoms. The Ga–Ga bond length is 2.41 Å.},
doi = {10.17188/1279572},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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