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Title: Materials Data on Sc2Ni2Sn by Materials Project

Abstract

Sc2Ni2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Sc is bonded in a 6-coordinate geometry to six equivalent Ni and four equivalent Sn atoms. There are two shorter (2.68 Å) and four longer (2.70 Å) Sc–Ni bond lengths. All Sc–Sn bond lengths are 3.14 Å. Ni is bonded in a 6-coordinate geometry to six equivalent Sc, one Ni, and two equivalent Sn atoms. The Ni–Ni bond length is 2.50 Å. Both Ni–Sn bond lengths are 2.83 Å. Sn is bonded to eight equivalent Sc and four equivalent Ni atoms to form a mixture of distorted corner and face-sharing SnSc8Ni4 cuboctahedra.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-3363
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; Sc2Ni2Sn; Ni-Sc-Sn
OSTI Identifier:
1206618
DOI:
10.17188/1206618

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Sc2Ni2Sn by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1206618.
Persson, Kristin, & Project, Materials. Materials Data on Sc2Ni2Sn by Materials Project. United States. doi:10.17188/1206618.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Sc2Ni2Sn by Materials Project". United States. doi:10.17188/1206618. https://www.osti.gov/servlets/purl/1206618. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1206618,
title = {Materials Data on Sc2Ni2Sn by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Sc2Ni2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Sc is bonded in a 6-coordinate geometry to six equivalent Ni and four equivalent Sn atoms. There are two shorter (2.68 Å) and four longer (2.70 Å) Sc–Ni bond lengths. All Sc–Sn bond lengths are 3.14 Å. Ni is bonded in a 6-coordinate geometry to six equivalent Sc, one Ni, and two equivalent Sn atoms. The Ni–Ni bond length is 2.50 Å. Both Ni–Sn bond lengths are 2.83 Å. Sn is bonded to eight equivalent Sc and four equivalent Ni atoms to form a mixture of distorted corner and face-sharing SnSc8Ni4 cuboctahedra.},
doi = {10.17188/1206618},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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