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

Title: Materials Data on U3(Si3Pd10)2 by Materials Project

Abstract

U3Pd20Si6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a distorted tetrahedral geometry to four equivalent Pd atoms. All U–Pd bond lengths are 2.86 Å. In the second U site, U is bonded in a cuboctahedral geometry to twelve equivalent Pd atoms. All U–Pd bond lengths are 3.03 Å. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 2-coordinate geometry to one U and two equivalent Si atoms. Both Pd–Si bond lengths are 2.44 Å. In the second Pd site, Pd is bonded to one U and three equivalent Si atoms to form a mixture of edge and corner-sharing PdUSi3 tetrahedra. All Pd–Si bond lengths are 2.50 Å. Si is bonded in a 8-coordinate geometry to eight Pd atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-630265
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; U3(Si3Pd10)2; Pd-Si-U
OSTI Identifier:
1278978
DOI:
10.17188/1278978

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on U3(Si3Pd10)2 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1278978.
Persson, Kristin, & Project, Materials. Materials Data on U3(Si3Pd10)2 by Materials Project. United States. doi:10.17188/1278978.
Persson, Kristin, and Project, Materials. 2017. "Materials Data on U3(Si3Pd10)2 by Materials Project". United States. doi:10.17188/1278978. https://www.osti.gov/servlets/purl/1278978. Pub date:Fri Jun 23 00:00:00 EDT 2017
@article{osti_1278978,
title = {Materials Data on U3(Si3Pd10)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {U3Pd20Si6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a distorted tetrahedral geometry to four equivalent Pd atoms. All U–Pd bond lengths are 2.86 Å. In the second U site, U is bonded in a cuboctahedral geometry to twelve equivalent Pd atoms. All U–Pd bond lengths are 3.03 Å. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 2-coordinate geometry to one U and two equivalent Si atoms. Both Pd–Si bond lengths are 2.44 Å. In the second Pd site, Pd is bonded to one U and three equivalent Si atoms to form a mixture of edge and corner-sharing PdUSi3 tetrahedra. All Pd–Si bond lengths are 2.50 Å. Si is bonded in a 8-coordinate geometry to eight Pd atoms.},
doi = {10.17188/1278978},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {6}
}

Dataset:

Save / Share: