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Title: Materials Data on GaCo2Ni by Materials Project

Abstract

Co2NiGa is alpha La-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Co is bonded to four equivalent Co, four equivalent Ni, and four equivalent Ga atoms to form CoGa4Co4Ni4 cuboctahedra that share corners with twelve equivalent CoGa4Co4Ni4 cuboctahedra, edges with eight equivalent CoGa4Co4Ni4 cuboctahedra, edges with eight equivalent NiGa4Co8 cuboctahedra, edges with eight equivalent GaCo8Ni4 cuboctahedra, faces with four equivalent NiGa4Co8 cuboctahedra, faces with four equivalent GaCo8Ni4 cuboctahedra, and faces with ten equivalent CoGa4Co4Ni4 cuboctahedra. All Co–Co bond lengths are 2.54 Å. All Co–Ni bond lengths are 2.53 Å. All Co–Ga bond lengths are 2.53 Å. Ni is bonded to eight equivalent Co and four equivalent Ga atoms to form NiGa4Co8 cuboctahedra that share corners with four equivalent NiGa4Co8 cuboctahedra, corners with eight equivalent GaCo8Ni4 cuboctahedra, edges with eight equivalent NiGa4Co8 cuboctahedra, edges with sixteen equivalent CoGa4Co4Ni4 cuboctahedra, faces with four equivalent NiGa4Co8 cuboctahedra, faces with six equivalent GaCo8Ni4 cuboctahedra, and faces with eight equivalent CoGa4Co4Ni4 cuboctahedra. All Ni–Ga bond lengths are 2.54 Å. Ga is bonded to eight equivalent Co and four equivalent Ni atoms to form GaCo8Ni4 cuboctahedra that share corners with four equivalent GaCo8Ni4 cuboctahedra, corners with eight equivalent NiGa4Co8 cuboctahedra,more » edges with eight equivalent GaCo8Ni4 cuboctahedra, edges with sixteen equivalent CoGa4Co4Ni4 cuboctahedra, faces with four equivalent GaCo8Ni4 cuboctahedra, faces with six equivalent NiGa4Co8 cuboctahedra, and faces with eight equivalent CoGa4Co4Ni4 cuboctahedra.« less

Publication Date:
Other Number(s):
mp-1018060
DOE Contract Number:  
AC02-05CH11231
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Co-Ga-Ni; GaCo2Ni; crystal structure
OSTI Identifier:
1350105
DOI:
https://doi.org/10.17188/1350105

Citation Formats

Materials Data on GaCo2Ni by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1350105.
Materials Data on GaCo2Ni by Materials Project. United States. doi:https://doi.org/10.17188/1350105
2020. "Materials Data on GaCo2Ni by Materials Project". United States. doi:https://doi.org/10.17188/1350105. https://www.osti.gov/servlets/purl/1350105. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1350105,
title = {Materials Data on GaCo2Ni by Materials Project},
abstractNote = {Co2NiGa is alpha La-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Co is bonded to four equivalent Co, four equivalent Ni, and four equivalent Ga atoms to form CoGa4Co4Ni4 cuboctahedra that share corners with twelve equivalent CoGa4Co4Ni4 cuboctahedra, edges with eight equivalent CoGa4Co4Ni4 cuboctahedra, edges with eight equivalent NiGa4Co8 cuboctahedra, edges with eight equivalent GaCo8Ni4 cuboctahedra, faces with four equivalent NiGa4Co8 cuboctahedra, faces with four equivalent GaCo8Ni4 cuboctahedra, and faces with ten equivalent CoGa4Co4Ni4 cuboctahedra. All Co–Co bond lengths are 2.54 Å. All Co–Ni bond lengths are 2.53 Å. All Co–Ga bond lengths are 2.53 Å. Ni is bonded to eight equivalent Co and four equivalent Ga atoms to form NiGa4Co8 cuboctahedra that share corners with four equivalent NiGa4Co8 cuboctahedra, corners with eight equivalent GaCo8Ni4 cuboctahedra, edges with eight equivalent NiGa4Co8 cuboctahedra, edges with sixteen equivalent CoGa4Co4Ni4 cuboctahedra, faces with four equivalent NiGa4Co8 cuboctahedra, faces with six equivalent GaCo8Ni4 cuboctahedra, and faces with eight equivalent CoGa4Co4Ni4 cuboctahedra. All Ni–Ga bond lengths are 2.54 Å. Ga is bonded to eight equivalent Co and four equivalent Ni atoms to form GaCo8Ni4 cuboctahedra that share corners with four equivalent GaCo8Ni4 cuboctahedra, corners with eight equivalent NiGa4Co8 cuboctahedra, edges with eight equivalent GaCo8Ni4 cuboctahedra, edges with sixteen equivalent CoGa4Co4Ni4 cuboctahedra, faces with four equivalent GaCo8Ni4 cuboctahedra, faces with six equivalent NiGa4Co8 cuboctahedra, and faces with eight equivalent CoGa4Co4Ni4 cuboctahedra.},
doi = {10.17188/1350105},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}