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Title: Materials Data on Y3(ZnAu2)2 by Materials Project

Abstract

Y3(Au2Zn)2 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 7-coordinate geometry to seven Au atoms. There are a spread of Y–Au bond distances ranging from 3.02–3.11 Å. In the second Y site, Y is bonded in a 7-coordinate geometry to seven Au and four equivalent Zn atoms. There are a spread of Y–Au bond distances ranging from 2.99–3.16 Å. There are two shorter (3.23 Å) and two longer (3.35 Å) Y–Zn bond lengths. There are three inequivalent Au sites. In the first Au site, Au is bonded in a 8-coordinate geometry to six Y, one Au, and two equivalent Zn atoms. The Au–Au bond length is 2.96 Å. There are one shorter (2.79 Å) and one longer (2.81 Å) Au–Zn bond lengths. In the second Au site, Au is bonded in a 7-coordinate geometry to three Y, two equivalent Au, and four equivalent Zn atoms. Both Au–Au bond lengths are 2.98 Å. All Au–Zn bond lengths are 2.71 Å. In the third Au site, Au is bonded in a 10-coordinate geometry to six Y and four Au atoms. Zn is bondedmore » in a 4-coordinate geometry to four equivalent Y and four Au atoms.« less

Authors:
Publication Date:
Other Number(s):
mp-1216085
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Y3(ZnAu2)2; Au-Y-Zn
OSTI Identifier:
1712078
DOI:
https://doi.org/10.17188/1712078

Citation Formats

The Materials Project. Materials Data on Y3(ZnAu2)2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1712078.
The Materials Project. Materials Data on Y3(ZnAu2)2 by Materials Project. United States. doi:https://doi.org/10.17188/1712078
The Materials Project. 2019. "Materials Data on Y3(ZnAu2)2 by Materials Project". United States. doi:https://doi.org/10.17188/1712078. https://www.osti.gov/servlets/purl/1712078. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1712078,
title = {Materials Data on Y3(ZnAu2)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Y3(Au2Zn)2 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 7-coordinate geometry to seven Au atoms. There are a spread of Y–Au bond distances ranging from 3.02–3.11 Å. In the second Y site, Y is bonded in a 7-coordinate geometry to seven Au and four equivalent Zn atoms. There are a spread of Y–Au bond distances ranging from 2.99–3.16 Å. There are two shorter (3.23 Å) and two longer (3.35 Å) Y–Zn bond lengths. There are three inequivalent Au sites. In the first Au site, Au is bonded in a 8-coordinate geometry to six Y, one Au, and two equivalent Zn atoms. The Au–Au bond length is 2.96 Å. There are one shorter (2.79 Å) and one longer (2.81 Å) Au–Zn bond lengths. In the second Au site, Au is bonded in a 7-coordinate geometry to three Y, two equivalent Au, and four equivalent Zn atoms. Both Au–Au bond lengths are 2.98 Å. All Au–Zn bond lengths are 2.71 Å. In the third Au site, Au is bonded in a 10-coordinate geometry to six Y and four Au atoms. Zn is bonded in a 4-coordinate geometry to four equivalent Y and four Au atoms.},
doi = {10.17188/1712078},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}