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Title: Materials Data on ZrVSi by Materials Project

Abstract

SiVZr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr2+ is bonded to five equivalent Si4- atoms to form a mixture of distorted edge and corner-sharing ZrSi5 trigonal bipyramids. There are four shorter (2.74 Å) and one longer (2.87 Å) Zr–Si bond lengths. V2+ is bonded in a 4-coordinate geometry to four equivalent Si4- atoms. All V–Si bond lengths are 2.56 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Zr2+ and four equivalent V2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-5541
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; ZrVSi; Si-V-Zr
OSTI Identifier:
1267738
DOI:
https://doi.org/10.17188/1267738

Citation Formats

The Materials Project. Materials Data on ZrVSi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1267738.
The Materials Project. Materials Data on ZrVSi by Materials Project. United States. doi:https://doi.org/10.17188/1267738
The Materials Project. 2020. "Materials Data on ZrVSi by Materials Project". United States. doi:https://doi.org/10.17188/1267738. https://www.osti.gov/servlets/purl/1267738. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1267738,
title = {Materials Data on ZrVSi by Materials Project},
author = {The Materials Project},
abstractNote = {SiVZr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr2+ is bonded to five equivalent Si4- atoms to form a mixture of distorted edge and corner-sharing ZrSi5 trigonal bipyramids. There are four shorter (2.74 Å) and one longer (2.87 Å) Zr–Si bond lengths. V2+ is bonded in a 4-coordinate geometry to four equivalent Si4- atoms. All V–Si bond lengths are 2.56 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Zr2+ and four equivalent V2+ atoms.},
doi = {10.17188/1267738},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}