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Title: Materials Data on ZrAl3 by Materials Project

Abstract

Al3Zr is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zr is bonded to twelve equivalent Al atoms to form ZrAl12 cuboctahedra that share corners with twelve equivalent ZrAl12 cuboctahedra, edges with twenty-four equivalent AlZr4Al8 cuboctahedra, faces with six equivalent ZrAl12 cuboctahedra, and faces with twelve equivalent AlZr4Al8 cuboctahedra. All Zr–Al bond lengths are 2.90 Å. Al is bonded to four equivalent Zr and eight equivalent Al atoms to form AlZr4Al8 cuboctahedra that share corners with twelve equivalent AlZr4Al8 cuboctahedra, edges with eight equivalent ZrAl12 cuboctahedra, edges with sixteen equivalent AlZr4Al8 cuboctahedra, faces with four equivalent ZrAl12 cuboctahedra, and faces with fourteen equivalent AlZr4Al8 cuboctahedra. All Al–Al bond lengths are 2.90 Å.

Publication Date:
Other Number(s):
mp-569775
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; ZrAl3; Al-Zr
OSTI Identifier:
1275249
DOI:
10.17188/1275249

Citation Formats

The Materials Project. Materials Data on ZrAl3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1275249.
The Materials Project. Materials Data on ZrAl3 by Materials Project. United States. doi:10.17188/1275249.
The Materials Project. 2020. "Materials Data on ZrAl3 by Materials Project". United States. doi:10.17188/1275249. https://www.osti.gov/servlets/purl/1275249. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1275249,
title = {Materials Data on ZrAl3 by Materials Project},
author = {The Materials Project},
abstractNote = {Al3Zr is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zr is bonded to twelve equivalent Al atoms to form ZrAl12 cuboctahedra that share corners with twelve equivalent ZrAl12 cuboctahedra, edges with twenty-four equivalent AlZr4Al8 cuboctahedra, faces with six equivalent ZrAl12 cuboctahedra, and faces with twelve equivalent AlZr4Al8 cuboctahedra. All Zr–Al bond lengths are 2.90 Å. Al is bonded to four equivalent Zr and eight equivalent Al atoms to form AlZr4Al8 cuboctahedra that share corners with twelve equivalent AlZr4Al8 cuboctahedra, edges with eight equivalent ZrAl12 cuboctahedra, edges with sixteen equivalent AlZr4Al8 cuboctahedra, faces with four equivalent ZrAl12 cuboctahedra, and faces with fourteen equivalent AlZr4Al8 cuboctahedra. All Al–Al bond lengths are 2.90 Å.},
doi = {10.17188/1275249},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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