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Title: Materials Data on Zr3Fe by Materials Project

Abstract

Zr3Fe crystallizes in the orthorhombic Cmcm space group. The structure is one-dimensional and consists of four Zr3Fe ribbons oriented in the (1, 0, 0) direction. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 2-coordinate geometry to two equivalent Fe atoms. Both Zr–Fe bond lengths are 2.60 Å. In the second Zr site, Zr is bonded in a 2-coordinate geometry to two equivalent Fe atoms. Both Zr–Fe bond lengths are 2.65 Å. Fe is bonded in a 6-coordinate geometry to six Zr atoms.

Publication Date:
Other Number(s):
mp-31205
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; Zr3Fe; Fe-Zr
OSTI Identifier:
1205505
DOI:
10.17188/1205505

Citation Formats

The Materials Project. Materials Data on Zr3Fe by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205505.
The Materials Project. Materials Data on Zr3Fe by Materials Project. United States. doi:10.17188/1205505.
The Materials Project. 2020. "Materials Data on Zr3Fe by Materials Project". United States. doi:10.17188/1205505. https://www.osti.gov/servlets/purl/1205505. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1205505,
title = {Materials Data on Zr3Fe by Materials Project},
author = {The Materials Project},
abstractNote = {Zr3Fe crystallizes in the orthorhombic Cmcm space group. The structure is one-dimensional and consists of four Zr3Fe ribbons oriented in the (1, 0, 0) direction. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 2-coordinate geometry to two equivalent Fe atoms. Both Zr–Fe bond lengths are 2.60 Å. In the second Zr site, Zr is bonded in a 2-coordinate geometry to two equivalent Fe atoms. Both Zr–Fe bond lengths are 2.65 Å. Fe is bonded in a 6-coordinate geometry to six Zr atoms.},
doi = {10.17188/1205505},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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