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Title: Materials Data on AlAu4 by Materials Project

Abstract

Au4Al crystallizes in the cubic P2_13 space group. The structure is three-dimensional. there are two inequivalent Au sites. In the first Au site, Au is bonded in a 12-coordinate geometry to nine Au and three equivalent Al atoms. There are a spread of Au–Au bond distances ranging from 2.90–3.01 Å. There are a spread of Au–Al bond distances ranging from 2.76–3.11 Å. In the second Au site, Au is bonded in a distorted trigonal planar geometry to nine equivalent Au and three equivalent Al atoms. All Au–Al bond lengths are 2.63 Å. Al is bonded to twelve Au atoms to form a mixture of distorted face and corner-sharing AlAu12 cuboctahedra.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-1490
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; AlAu4; Al-Au
OSTI Identifier:
1190960
DOI:
10.17188/1190960

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on AlAu4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1190960.
Persson, Kristin, & Project, Materials. Materials Data on AlAu4 by Materials Project. United States. doi:10.17188/1190960.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on AlAu4 by Materials Project". United States. doi:10.17188/1190960. https://www.osti.gov/servlets/purl/1190960. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1190960,
title = {Materials Data on AlAu4 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Au4Al crystallizes in the cubic P2_13 space group. The structure is three-dimensional. there are two inequivalent Au sites. In the first Au site, Au is bonded in a 12-coordinate geometry to nine Au and three equivalent Al atoms. There are a spread of Au–Au bond distances ranging from 2.90–3.01 Å. There are a spread of Au–Al bond distances ranging from 2.76–3.11 Å. In the second Au site, Au is bonded in a distorted trigonal planar geometry to nine equivalent Au and three equivalent Al atoms. All Au–Al bond lengths are 2.63 Å. Al is bonded to twelve Au atoms to form a mixture of distorted face and corner-sharing AlAu12 cuboctahedra.},
doi = {10.17188/1190960},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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