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Title: Materials Data on Yb2(Ga3Ir)3 by Materials Project

Abstract

Yb2(IrGa3)3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 11-coordinate geometry to eleven Ga atoms. There are a spread of Yb–Ga bond distances ranging from 3.05–3.13 Å. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 8-coordinate geometry to eight Ga atoms. There are a spread of Ir–Ga bond distances ranging from 2.56–2.63 Å. In the second Ir site, Ir is bonded in a 8-coordinate geometry to eight Ga atoms. There are four shorter (2.60 Å) and four longer (2.62 Å) Ir–Ga bond lengths. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent Yb, two equivalent Ir, and six Ga atoms. There are two shorter (2.76 Å) and four longer (2.78 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 3-coordinate geometry to three equivalent Yb, three Ir, and five Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.79–2.92 Å. In the third Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent Yb, three Ir, and five Ga atoms. There aremore » one shorter (2.76 Å) and two longer (2.86 Å) Ga–Ga bond lengths. In the fourth Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent Yb, two equivalent Ir, and six Ga atoms. The Ga–Ga bond length is 2.74 Å.« less

Publication Date:
Other Number(s):
mp-1207617
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; Ga-Ir-Yb; Yb2(Ga3Ir)3; crystal structure
OSTI Identifier:
1655077
DOI:
https://doi.org/10.17188/1655077

Citation Formats

Materials Data on Yb2(Ga3Ir)3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1655077.
Materials Data on Yb2(Ga3Ir)3 by Materials Project. United States. doi:https://doi.org/10.17188/1655077
2020. "Materials Data on Yb2(Ga3Ir)3 by Materials Project". United States. doi:https://doi.org/10.17188/1655077. https://www.osti.gov/servlets/purl/1655077. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1655077,
title = {Materials Data on Yb2(Ga3Ir)3 by Materials Project},
abstractNote = {Yb2(IrGa3)3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 11-coordinate geometry to eleven Ga atoms. There are a spread of Yb–Ga bond distances ranging from 3.05–3.13 Å. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 8-coordinate geometry to eight Ga atoms. There are a spread of Ir–Ga bond distances ranging from 2.56–2.63 Å. In the second Ir site, Ir is bonded in a 8-coordinate geometry to eight Ga atoms. There are four shorter (2.60 Å) and four longer (2.62 Å) Ir–Ga bond lengths. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent Yb, two equivalent Ir, and six Ga atoms. There are two shorter (2.76 Å) and four longer (2.78 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 3-coordinate geometry to three equivalent Yb, three Ir, and five Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.79–2.92 Å. In the third Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent Yb, three Ir, and five Ga atoms. There are one shorter (2.76 Å) and two longer (2.86 Å) Ga–Ga bond lengths. In the fourth Ga site, Ga is bonded in a 10-coordinate geometry to two equivalent Yb, two equivalent Ir, and six Ga atoms. The Ga–Ga bond length is 2.74 Å.},
doi = {10.17188/1655077},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Apr 29 00:00:00 EDT 2020},
month = {Wed Apr 29 00:00:00 EDT 2020}
}