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Title: Materials Data on V2GaFe by Materials Project

Abstract

V2FeGa crystallizes in the orthorhombic Cmm2 space group. The structure is two-dimensional and consists of one V2FeGa sheet oriented in the (0, 0, 1) direction. there are two inequivalent V sites. In the first V site, V is bonded in a 8-coordinate geometry to four equivalent Ga atoms. There are two shorter (2.65 Å) and two longer (2.98 Å) V–Ga bond lengths. In the second V site, V is bonded in a 2-coordinate geometry to four equivalent Fe atoms. There are two shorter (2.48 Å) and two longer (2.83 Å) V–Fe bond lengths. Fe is bonded in a 12-coordinate geometry to four equivalent V, four equivalent Fe, and four equivalent Ga atoms. All Fe–Fe bond lengths are 2.60 Å. There are two shorter (2.51 Å) and two longer (2.85 Å) Fe–Ga bond lengths. Ga is bonded in a 12-coordinate geometry to four equivalent V, four equivalent Fe, and four equivalent Ga atoms. All Ga–Ga bond lengths are 2.60 Å.

Publication Date:
Other Number(s):
mp-1216782
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; V2GaFe; Fe-Ga-V
OSTI Identifier:
1728755
DOI:
https://doi.org/10.17188/1728755

Citation Formats

The Materials Project. Materials Data on V2GaFe by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1728755.
The Materials Project. Materials Data on V2GaFe by Materials Project. United States. doi:https://doi.org/10.17188/1728755
The Materials Project. 2020. "Materials Data on V2GaFe by Materials Project". United States. doi:https://doi.org/10.17188/1728755. https://www.osti.gov/servlets/purl/1728755. Pub date:Fri Jun 05 00:00:00 EDT 2020
@article{osti_1728755,
title = {Materials Data on V2GaFe by Materials Project},
author = {The Materials Project},
abstractNote = {V2FeGa crystallizes in the orthorhombic Cmm2 space group. The structure is two-dimensional and consists of one V2FeGa sheet oriented in the (0, 0, 1) direction. there are two inequivalent V sites. In the first V site, V is bonded in a 8-coordinate geometry to four equivalent Ga atoms. There are two shorter (2.65 Å) and two longer (2.98 Å) V–Ga bond lengths. In the second V site, V is bonded in a 2-coordinate geometry to four equivalent Fe atoms. There are two shorter (2.48 Å) and two longer (2.83 Å) V–Fe bond lengths. Fe is bonded in a 12-coordinate geometry to four equivalent V, four equivalent Fe, and four equivalent Ga atoms. All Fe–Fe bond lengths are 2.60 Å. There are two shorter (2.51 Å) and two longer (2.85 Å) Fe–Ga bond lengths. Ga is bonded in a 12-coordinate geometry to four equivalent V, four equivalent Fe, and four equivalent Ga atoms. All Ga–Ga bond lengths are 2.60 Å.},
doi = {10.17188/1728755},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {6}
}