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Title: Materials Data on Zr2InAu2 by Materials Project

Abstract

Zr2Au2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Zr is bonded in a 6-coordinate geometry to six equivalent Au and four equivalent In atoms. There are two shorter (2.82 Å) and four longer (2.93 Å) Zr–Au bond lengths. All Zr–In bond lengths are 3.36 Å. Au is bonded in a 9-coordinate geometry to six equivalent Zr, one Au, and two equivalent In atoms. The Au–Au bond length is 2.79 Å. Both Au–In bond lengths are 3.00 Å. In is bonded to eight equivalent Zr and four equivalent Au atoms to form a mixture of distorted corner and face-sharing InZr8Au4 cuboctahedra.

Publication Date:
Other Number(s):
mp-1079489
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; Zr2InAu2; Au-In-Zr
OSTI Identifier:
1694574
DOI:
https://doi.org/10.17188/1694574

Citation Formats

The Materials Project. Materials Data on Zr2InAu2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1694574.
The Materials Project. Materials Data on Zr2InAu2 by Materials Project. United States. doi:https://doi.org/10.17188/1694574
The Materials Project. 2020. "Materials Data on Zr2InAu2 by Materials Project". United States. doi:https://doi.org/10.17188/1694574. https://www.osti.gov/servlets/purl/1694574. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1694574,
title = {Materials Data on Zr2InAu2 by Materials Project},
author = {The Materials Project},
abstractNote = {Zr2Au2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Zr is bonded in a 6-coordinate geometry to six equivalent Au and four equivalent In atoms. There are two shorter (2.82 Å) and four longer (2.93 Å) Zr–Au bond lengths. All Zr–In bond lengths are 3.36 Å. Au is bonded in a 9-coordinate geometry to six equivalent Zr, one Au, and two equivalent In atoms. The Au–Au bond length is 2.79 Å. Both Au–In bond lengths are 3.00 Å. In is bonded to eight equivalent Zr and four equivalent Au atoms to form a mixture of distorted corner and face-sharing InZr8Au4 cuboctahedra.},
doi = {10.17188/1694574},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}