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Title: Materials Data on LaSO by Materials Project

Abstract

LaSO crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. La3+ is bonded in a 8-coordinate geometry to four S1- and four O2- atoms. There are a spread of La–S bond distances ranging from 3.16–3.21 Å. There are a spread of La–O bond distances ranging from 2.39–2.44 Å. There are two inequivalent S1- sites. In the first S1- site, S1- is bonded in a 5-coordinate geometry to four equivalent La3+ and one S1- atom. The S–S bond length is 2.11 Å. In the second S1- site, S1- is bonded in a 5-coordinate geometry to four equivalent La3+ and one S1- atom. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent La3+ atoms to form a mixture of distorted edge and corner-sharing OLa4 tetrahedra. In the second O2- site, O2- is bonded to four equivalent La3+ atoms to form a mixture of edge and corner-sharing OLa4 tetrahedra.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-557722
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; LaSO; La-O-S
OSTI Identifier:
1269973
DOI:
10.17188/1269973

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on LaSO by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1269973.
Persson, Kristin, & Project, Materials. Materials Data on LaSO by Materials Project. United States. doi:10.17188/1269973.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on LaSO by Materials Project". United States. doi:10.17188/1269973. https://www.osti.gov/servlets/purl/1269973. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1269973,
title = {Materials Data on LaSO by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {LaSO crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. La3+ is bonded in a 8-coordinate geometry to four S1- and four O2- atoms. There are a spread of La–S bond distances ranging from 3.16–3.21 Å. There are a spread of La–O bond distances ranging from 2.39–2.44 Å. There are two inequivalent S1- sites. In the first S1- site, S1- is bonded in a 5-coordinate geometry to four equivalent La3+ and one S1- atom. The S–S bond length is 2.11 Å. In the second S1- site, S1- is bonded in a 5-coordinate geometry to four equivalent La3+ and one S1- atom. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent La3+ atoms to form a mixture of distorted edge and corner-sharing OLa4 tetrahedra. In the second O2- site, O2- is bonded to four equivalent La3+ atoms to form a mixture of edge and corner-sharing OLa4 tetrahedra.},
doi = {10.17188/1269973},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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