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Title: Materials Data on Zn3In by Materials Project

Abstract

Zn3In crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to six equivalent Zn and four equivalent In atoms. There are two shorter (2.82 Å) and four longer (2.83 Å) Zn–Zn bond lengths. There are two shorter (2.98 Å) and two longer (3.03 Å) Zn–In bond lengths. In the second Zn site, Zn is bonded in a 10-coordinate geometry to six Zn and four equivalent In atoms. There are one shorter (2.76 Å) and two longer (2.86 Å) Zn–Zn bond lengths. There are a spread of Zn–In bond distances ranging from 2.99–3.07 Å. In is bonded to twelve Zn atoms to form a mixture of face and corner-sharing InZn12 cuboctahedra.

Authors:
Publication Date:
Other Number(s):
mp-972175
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; Zn3In; In-Zn
OSTI Identifier:
1313741
DOI:
https://doi.org/10.17188/1313741

Citation Formats

The Materials Project. Materials Data on Zn3In by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1313741.
The Materials Project. Materials Data on Zn3In by Materials Project. United States. doi:https://doi.org/10.17188/1313741
The Materials Project. 2020. "Materials Data on Zn3In by Materials Project". United States. doi:https://doi.org/10.17188/1313741. https://www.osti.gov/servlets/purl/1313741. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1313741,
title = {Materials Data on Zn3In by Materials Project},
author = {The Materials Project},
abstractNote = {Zn3In crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to six equivalent Zn and four equivalent In atoms. There are two shorter (2.82 Å) and four longer (2.83 Å) Zn–Zn bond lengths. There are two shorter (2.98 Å) and two longer (3.03 Å) Zn–In bond lengths. In the second Zn site, Zn is bonded in a 10-coordinate geometry to six Zn and four equivalent In atoms. There are one shorter (2.76 Å) and two longer (2.86 Å) Zn–Zn bond lengths. There are a spread of Zn–In bond distances ranging from 2.99–3.07 Å. In is bonded to twelve Zn atoms to form a mixture of face and corner-sharing InZn12 cuboctahedra.},
doi = {10.17188/1313741},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}