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Title: Materials Data on LaScSi by Materials Project

Abstract

LaScSi crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La2+ is bonded to five equivalent Si4- atoms to form a mixture of distorted corner and edge-sharing LaSi5 trigonal bipyramids. There are four shorter (3.22 Å) and one longer (3.33 Å) La–Si bond lengths. Sc2+ is bonded in a square co-planar geometry to four equivalent Si4- atoms. All Sc–Si bond lengths are 2.90 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent La2+ and four equivalent Sc2+ atoms.

Publication Date:
Other Number(s):
mp-1024951
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; La-Sc-Si; LaScSi; crystal structure
OSTI Identifier:
1355226
DOI:
https://doi.org/10.17188/1355226

Citation Formats

Materials Data on LaScSi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1355226.
Materials Data on LaScSi by Materials Project. United States. doi:https://doi.org/10.17188/1355226
2020. "Materials Data on LaScSi by Materials Project". United States. doi:https://doi.org/10.17188/1355226. https://www.osti.gov/servlets/purl/1355226. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1355226,
title = {Materials Data on LaScSi by Materials Project},
abstractNote = {LaScSi crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La2+ is bonded to five equivalent Si4- atoms to form a mixture of distorted corner and edge-sharing LaSi5 trigonal bipyramids. There are four shorter (3.22 Å) and one longer (3.33 Å) La–Si bond lengths. Sc2+ is bonded in a square co-planar geometry to four equivalent Si4- atoms. All Sc–Si bond lengths are 2.90 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent La2+ and four equivalent Sc2+ atoms.},
doi = {10.17188/1355226},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}