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Title: Materials Data on Rb3SbS4 by Materials Project

Abstract

Rb3SbS4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven S2- atoms. There are a spread of Rb–S bond distances ranging from 3.32–3.86 Å. In the second Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven S2- atoms. There are a spread of Rb–S bond distances ranging from 3.37–3.90 Å. Sb5+ is bonded in a tetrahedral geometry to four S2- atoms. There are two shorter (2.36 Å) and two longer (2.37 Å) Sb–S bond lengths. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 1-coordinate geometry to five Rb1+ and one Sb5+ atom. In the second S2- site, S2- is bonded in a 7-coordinate geometry to six Rb1+ and one Sb5+ atom. In the third S2- site, S2- is bonded to five Rb1+ and one Sb5+ atom to form edge-sharing SRb5Sb octahedra.

Authors:
Publication Date:
Other Number(s):
mp-17154
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Rb3SbS4; Rb-S-Sb
OSTI Identifier:
1192360
DOI:
https://doi.org/10.17188/1192360

Citation Formats

The Materials Project. Materials Data on Rb3SbS4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192360.
The Materials Project. Materials Data on Rb3SbS4 by Materials Project. United States. doi:https://doi.org/10.17188/1192360
The Materials Project. 2020. "Materials Data on Rb3SbS4 by Materials Project". United States. doi:https://doi.org/10.17188/1192360. https://www.osti.gov/servlets/purl/1192360. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1192360,
title = {Materials Data on Rb3SbS4 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb3SbS4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven S2- atoms. There are a spread of Rb–S bond distances ranging from 3.32–3.86 Å. In the second Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven S2- atoms. There are a spread of Rb–S bond distances ranging from 3.37–3.90 Å. Sb5+ is bonded in a tetrahedral geometry to four S2- atoms. There are two shorter (2.36 Å) and two longer (2.37 Å) Sb–S bond lengths. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 1-coordinate geometry to five Rb1+ and one Sb5+ atom. In the second S2- site, S2- is bonded in a 7-coordinate geometry to six Rb1+ and one Sb5+ atom. In the third S2- site, S2- is bonded to five Rb1+ and one Sb5+ atom to form edge-sharing SRb5Sb octahedra.},
doi = {10.17188/1192360},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}