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Title: Materials Data on B2IrCl by Materials Project

Abstract

IrB2Cl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ir is bonded in a 8-coordinate geometry to eight equivalent B and six equivalent Cl atoms. All Ir–B bond lengths are 2.47 Å. All Ir–Cl bond lengths are 2.85 Å. B is bonded in a body-centered cubic geometry to four equivalent Ir and four equivalent Cl atoms. All B–Cl bond lengths are 2.47 Å. Cl is bonded in a distorted body-centered cubic geometry to six equivalent Ir and eight equivalent B atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-631586
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; B2IrCl; B-Cl-Ir
OSTI Identifier:
1279270
DOI:
10.17188/1279270

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on B2IrCl by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1279270.
Persson, Kristin, & Project, Materials. Materials Data on B2IrCl by Materials Project. United States. doi:10.17188/1279270.
Persson, Kristin, and Project, Materials. 2017. "Materials Data on B2IrCl by Materials Project". United States. doi:10.17188/1279270. https://www.osti.gov/servlets/purl/1279270. Pub date:Wed May 10 00:00:00 EDT 2017
@article{osti_1279270,
title = {Materials Data on B2IrCl by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {IrB2Cl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ir is bonded in a 8-coordinate geometry to eight equivalent B and six equivalent Cl atoms. All Ir–B bond lengths are 2.47 Å. All Ir–Cl bond lengths are 2.85 Å. B is bonded in a body-centered cubic geometry to four equivalent Ir and four equivalent Cl atoms. All B–Cl bond lengths are 2.47 Å. Cl is bonded in a distorted body-centered cubic geometry to six equivalent Ir and eight equivalent B atoms.},
doi = {10.17188/1279270},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}

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