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Title: Materials Data on V2Ga8Cu3 by Materials Project

Abstract

V2Cu3Ga8 crystallizes in the cubic I-43d space group. The structure is three-dimensional. V is bonded in a 11-coordinate geometry to three equivalent Cu and eight Ga atoms. All V–Cu bond lengths are 2.83 Å. There are a spread of V–Ga bond distances ranging from 2.55–2.58 Å. Cu is bonded in a 11-coordinate geometry to two equivalent V, one Cu, and eight Ga atoms. The Cu–Cu bond length is 2.85 Å. There are a spread of Cu–Ga bond distances ranging from 2.57–2.69 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 5-coordinate geometry to two equivalent V, three equivalent Cu, and one Ga atom. The Ga–Ga bond length is 2.72 Å. In the second Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent V, three equivalent Cu, and three equivalent Ga atoms.

Publication Date:
Other Number(s):
mp-570621
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; V2Ga8Cu3; Cu-Ga-V
OSTI Identifier:
1275820
DOI:
10.17188/1275820

Citation Formats

The Materials Project. Materials Data on V2Ga8Cu3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1275820.
The Materials Project. Materials Data on V2Ga8Cu3 by Materials Project. United States. doi:10.17188/1275820.
The Materials Project. 2020. "Materials Data on V2Ga8Cu3 by Materials Project". United States. doi:10.17188/1275820. https://www.osti.gov/servlets/purl/1275820. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1275820,
title = {Materials Data on V2Ga8Cu3 by Materials Project},
author = {The Materials Project},
abstractNote = {V2Cu3Ga8 crystallizes in the cubic I-43d space group. The structure is three-dimensional. V is bonded in a 11-coordinate geometry to three equivalent Cu and eight Ga atoms. All V–Cu bond lengths are 2.83 Å. There are a spread of V–Ga bond distances ranging from 2.55–2.58 Å. Cu is bonded in a 11-coordinate geometry to two equivalent V, one Cu, and eight Ga atoms. The Cu–Cu bond length is 2.85 Å. There are a spread of Cu–Ga bond distances ranging from 2.57–2.69 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 5-coordinate geometry to two equivalent V, three equivalent Cu, and one Ga atom. The Ga–Ga bond length is 2.72 Å. In the second Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent V, three equivalent Cu, and three equivalent Ga atoms.},
doi = {10.17188/1275820},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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