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Title: Materials Data on ZrCo4Si by Materials Project

Abstract

ZrCo4Si crystallizes in the cubic F-43m space group. The structure is three-dimensional. Zr is bonded in a 12-coordinate geometry to twelve equivalent Co and four equivalent Si atoms. All Zr–Co bond lengths are 2.78 Å. All Zr–Si bond lengths are 2.90 Å. Co is bonded to three equivalent Zr, six equivalent Co, and three equivalent Si atoms to form a mixture of edge, corner, and face-sharing CoZr3Co6Si3 cuboctahedra. There are three shorter (2.34 Å) and three longer (2.40 Å) Co–Co bond lengths. All Co–Si bond lengths are 2.78 Å. Si is bonded in a 4-coordinate geometry to four equivalent Zr and twelve equivalent Co atoms.

Authors:
Publication Date:
Other Number(s):
mp-1215253
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; ZrCo4Si; Co-Si-Zr
OSTI Identifier:
1745872
DOI:
https://doi.org/10.17188/1745872

Citation Formats

The Materials Project. Materials Data on ZrCo4Si by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1745872.
The Materials Project. Materials Data on ZrCo4Si by Materials Project. United States. doi:https://doi.org/10.17188/1745872
The Materials Project. 2020. "Materials Data on ZrCo4Si by Materials Project". United States. doi:https://doi.org/10.17188/1745872. https://www.osti.gov/servlets/purl/1745872. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1745872,
title = {Materials Data on ZrCo4Si by Materials Project},
author = {The Materials Project},
abstractNote = {ZrCo4Si crystallizes in the cubic F-43m space group. The structure is three-dimensional. Zr is bonded in a 12-coordinate geometry to twelve equivalent Co and four equivalent Si atoms. All Zr–Co bond lengths are 2.78 Å. All Zr–Si bond lengths are 2.90 Å. Co is bonded to three equivalent Zr, six equivalent Co, and three equivalent Si atoms to form a mixture of edge, corner, and face-sharing CoZr3Co6Si3 cuboctahedra. There are three shorter (2.34 Å) and three longer (2.40 Å) Co–Co bond lengths. All Co–Si bond lengths are 2.78 Å. Si is bonded in a 4-coordinate geometry to four equivalent Zr and twelve equivalent Co atoms.},
doi = {10.17188/1745872},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}