DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on SmS2 by Materials Project

Abstract

SmS2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Sm3+ is bonded in a 9-coordinate geometry to nine S+1.50- atoms. There are a spread of Sm–S bond distances ranging from 2.82–3.12 Å. There are two inequivalent S+1.50- sites. In the first S+1.50- site, S+1.50- is bonded to five equivalent Sm3+ atoms to form a mixture of distorted edge and corner-sharing SSm5 trigonal bipyramids. In the second S+1.50- site, S+1.50- is bonded in a 5-coordinate geometry to four equivalent Sm3+ and one S+1.50- atom. The S–S bond length is 2.16 Å.

Publication Date:
Other Number(s):
mp-1232280
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; SmS2; S-Sm
OSTI Identifier:
1744737
DOI:
https://doi.org/10.17188/1744737

Citation Formats

The Materials Project. Materials Data on SmS2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1744737.
The Materials Project. Materials Data on SmS2 by Materials Project. United States. doi:https://doi.org/10.17188/1744737
The Materials Project. 2020. "Materials Data on SmS2 by Materials Project". United States. doi:https://doi.org/10.17188/1744737. https://www.osti.gov/servlets/purl/1744737. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1744737,
title = {Materials Data on SmS2 by Materials Project},
author = {The Materials Project},
abstractNote = {SmS2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Sm3+ is bonded in a 9-coordinate geometry to nine S+1.50- atoms. There are a spread of Sm–S bond distances ranging from 2.82–3.12 Å. There are two inequivalent S+1.50- sites. In the first S+1.50- site, S+1.50- is bonded to five equivalent Sm3+ atoms to form a mixture of distorted edge and corner-sharing SSm5 trigonal bipyramids. In the second S+1.50- site, S+1.50- is bonded in a 5-coordinate geometry to four equivalent Sm3+ and one S+1.50- atom. The S–S bond length is 2.16 Å.},
doi = {10.17188/1744737},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}