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Title: Materials Data on TbGa4Ni by Materials Project

Abstract

TbNiGa4 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Tb is bonded in a 1-coordinate geometry to two equivalent Ni and thirteen Ga atoms. Both Tb–Ni bond lengths are 3.16 Å. There are a spread of Tb–Ga bond distances ranging from 2.90–3.35 Å. Ni is bonded in a 9-coordinate geometry to two equivalent Tb and seven Ga atoms. There are a spread of Ni–Ga bond distances ranging from 2.34–2.52 Å. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a distorted q6 geometry to four equivalent Tb and six Ga atoms. There are two shorter (2.85 Å) and four longer (2.86 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a distorted linear geometry to three equivalent Tb, one Ni, and eight Ga atoms. All Ga–Ga bond lengths are 3.00 Å. In the third Ga site, Ga is bonded in a 12-coordinate geometry to three equivalent Tb, three equivalent Ni, and six Ga atoms. There are one shorter (2.60 Å) and two longer (2.94 Å) Ga–Ga bond lengths.

Publication Date:
Other Number(s):
mp-1102206
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; TbGa4Ni; Ga-Ni-Tb
OSTI Identifier:
1729616
DOI:
https://doi.org/10.17188/1729616

Citation Formats

The Materials Project. Materials Data on TbGa4Ni by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1729616.
The Materials Project. Materials Data on TbGa4Ni by Materials Project. United States. doi:https://doi.org/10.17188/1729616
The Materials Project. 2018. "Materials Data on TbGa4Ni by Materials Project". United States. doi:https://doi.org/10.17188/1729616. https://www.osti.gov/servlets/purl/1729616. Pub date:Wed Jul 18 00:00:00 EDT 2018
@article{osti_1729616,
title = {Materials Data on TbGa4Ni by Materials Project},
author = {The Materials Project},
abstractNote = {TbNiGa4 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Tb is bonded in a 1-coordinate geometry to two equivalent Ni and thirteen Ga atoms. Both Tb–Ni bond lengths are 3.16 Å. There are a spread of Tb–Ga bond distances ranging from 2.90–3.35 Å. Ni is bonded in a 9-coordinate geometry to two equivalent Tb and seven Ga atoms. There are a spread of Ni–Ga bond distances ranging from 2.34–2.52 Å. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a distorted q6 geometry to four equivalent Tb and six Ga atoms. There are two shorter (2.85 Å) and four longer (2.86 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a distorted linear geometry to three equivalent Tb, one Ni, and eight Ga atoms. All Ga–Ga bond lengths are 3.00 Å. In the third Ga site, Ga is bonded in a 12-coordinate geometry to three equivalent Tb, three equivalent Ni, and six Ga atoms. There are one shorter (2.60 Å) and two longer (2.94 Å) Ga–Ga bond lengths.},
doi = {10.17188/1729616},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}