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Title: Materials Data on MnCrRe by Materials Project

Abstract

CrReMn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Cr is bonded to four equivalent Re and six equivalent Mn atoms to form distorted CrMn6Re4 tetrahedra that share corners with four equivalent MnCr6Re4 tetrahedra, corners with six equivalent CrMn6Re4 tetrahedra, edges with six equivalent MnCr6Re4 tetrahedra, and faces with twelve equivalent CrMn6Re4 tetrahedra. All Cr–Re bond lengths are 2.48 Å. All Cr–Mn bond lengths are 2.87 Å. Re is bonded in a body-centered cubic geometry to four equivalent Cr and four equivalent Mn atoms. All Re–Mn bond lengths are 2.48 Å. Mn is bonded to six equivalent Cr and four equivalent Re atoms to form distorted MnCr6Re4 tetrahedra that share corners with four equivalent CrMn6Re4 tetrahedra, corners with six equivalent MnCr6Re4 tetrahedra, edges with six equivalent CrMn6Re4 tetrahedra, and faces with twelve equivalent MnCr6Re4 tetrahedra.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-631383
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; MnCrRe; Cr-Mn-Re
OSTI Identifier:
1279112
DOI:
10.17188/1279112

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on MnCrRe by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279112.
Persson, Kristin, & Project, Materials. Materials Data on MnCrRe by Materials Project. United States. doi:10.17188/1279112.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on MnCrRe by Materials Project". United States. doi:10.17188/1279112. https://www.osti.gov/servlets/purl/1279112. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1279112,
title = {Materials Data on MnCrRe by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {CrReMn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Cr is bonded to four equivalent Re and six equivalent Mn atoms to form distorted CrMn6Re4 tetrahedra that share corners with four equivalent MnCr6Re4 tetrahedra, corners with six equivalent CrMn6Re4 tetrahedra, edges with six equivalent MnCr6Re4 tetrahedra, and faces with twelve equivalent CrMn6Re4 tetrahedra. All Cr–Re bond lengths are 2.48 Å. All Cr–Mn bond lengths are 2.87 Å. Re is bonded in a body-centered cubic geometry to four equivalent Cr and four equivalent Mn atoms. All Re–Mn bond lengths are 2.48 Å. Mn is bonded to six equivalent Cr and four equivalent Re atoms to form distorted MnCr6Re4 tetrahedra that share corners with four equivalent CrMn6Re4 tetrahedra, corners with six equivalent MnCr6Re4 tetrahedra, edges with six equivalent CrMn6Re4 tetrahedra, and faces with twelve equivalent MnCr6Re4 tetrahedra.},
doi = {10.17188/1279112},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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