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Title: Materials Data on Zn11Ir2 by Materials Project

Abstract

Ir2Zn11 crystallizes in the cubic I-43m space group. The structure is three-dimensional. Ir is bonded in a distorted q6 geometry to twelve Zn atoms. There are a spread of Ir–Zn bond distances ranging from 2.61–2.80 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a distorted bent 150 degrees geometry to two equivalent Ir and five Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.66–3.02 Å. In the second Zn site, Zn is bonded in a 2-coordinate geometry to two equivalent Ir and eleven Zn atoms. There are one shorter (2.62 Å) and two longer (2.68 Å) Zn–Zn bond lengths. In the third Zn site, Zn is bonded in a 3-coordinate geometry to three equivalent Ir and nine Zn atoms. All Zn–Zn bond lengths are 2.72 Å.

Authors:
Publication Date:
Other Number(s):
mp-30747
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; Zn11Ir2; Ir-Zn
OSTI Identifier:
1205106
DOI:
https://doi.org/10.17188/1205106

Citation Formats

The Materials Project. Materials Data on Zn11Ir2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205106.
The Materials Project. Materials Data on Zn11Ir2 by Materials Project. United States. doi:https://doi.org/10.17188/1205106
The Materials Project. 2020. "Materials Data on Zn11Ir2 by Materials Project". United States. doi:https://doi.org/10.17188/1205106. https://www.osti.gov/servlets/purl/1205106. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1205106,
title = {Materials Data on Zn11Ir2 by Materials Project},
author = {The Materials Project},
abstractNote = {Ir2Zn11 crystallizes in the cubic I-43m space group. The structure is three-dimensional. Ir is bonded in a distorted q6 geometry to twelve Zn atoms. There are a spread of Ir–Zn bond distances ranging from 2.61–2.80 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a distorted bent 150 degrees geometry to two equivalent Ir and five Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.66–3.02 Å. In the second Zn site, Zn is bonded in a 2-coordinate geometry to two equivalent Ir and eleven Zn atoms. There are one shorter (2.62 Å) and two longer (2.68 Å) Zn–Zn bond lengths. In the third Zn site, Zn is bonded in a 3-coordinate geometry to three equivalent Ir and nine Zn atoms. All Zn–Zn bond lengths are 2.72 Å.},
doi = {10.17188/1205106},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}