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Title: Materials Data on Bi4Ir by Materials Project

Abstract

IrBi4 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 8-coordinate geometry to eight Bi atoms. There are a spread of Ir–Bi bond distances ranging from 2.85–2.89 Å. In the second Ir site, Ir is bonded in a body-centered cubic geometry to eight Bi atoms. There are four shorter (2.88 Å) and four longer (2.90 Å) Ir–Bi bond lengths. There are four inequivalent Bi sites. In the first Bi site, Bi is bonded in a distorted water-like geometry to two Ir atoms. In the second Bi site, Bi is bonded in a distorted water-like geometry to two Ir atoms. In the third Bi site, Bi is bonded in a distorted water-like geometry to two equivalent Ir atoms. In the fourth Bi site, Bi is bonded in a distorted water-like geometry to two equivalent Ir atoms.

Publication Date:
Other Number(s):
mp-1194918
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; Bi4Ir; Bi-Ir
OSTI Identifier:
1759298
DOI:
https://doi.org/10.17188/1759298

Citation Formats

The Materials Project. Materials Data on Bi4Ir by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1759298.
The Materials Project. Materials Data on Bi4Ir by Materials Project. United States. doi:https://doi.org/10.17188/1759298
The Materials Project. 2020. "Materials Data on Bi4Ir by Materials Project". United States. doi:https://doi.org/10.17188/1759298. https://www.osti.gov/servlets/purl/1759298. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1759298,
title = {Materials Data on Bi4Ir by Materials Project},
author = {The Materials Project},
abstractNote = {IrBi4 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 8-coordinate geometry to eight Bi atoms. There are a spread of Ir–Bi bond distances ranging from 2.85–2.89 Å. In the second Ir site, Ir is bonded in a body-centered cubic geometry to eight Bi atoms. There are four shorter (2.88 Å) and four longer (2.90 Å) Ir–Bi bond lengths. There are four inequivalent Bi sites. In the first Bi site, Bi is bonded in a distorted water-like geometry to two Ir atoms. In the second Bi site, Bi is bonded in a distorted water-like geometry to two Ir atoms. In the third Bi site, Bi is bonded in a distorted water-like geometry to two equivalent Ir atoms. In the fourth Bi site, Bi is bonded in a distorted water-like geometry to two equivalent Ir atoms.},
doi = {10.17188/1759298},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}