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Title: Materials Data on Cs2Pd3S4 by Materials Project

Abstract

Cs2Pd3S4 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight equivalent S2- atoms. There are a spread of Cs–S bond distances ranging from 3.68–3.81 Å. There are three inequivalent Pd2+ sites. In the first Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.37 Å. In the second Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.38 Å. In the third Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.38 Å. S2- is bonded in a 7-coordinate geometry to four equivalent Cs1+ and three Pd2+ atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-510268
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; Cs2Pd3S4; Cs-Pd-S
OSTI Identifier:
1262865
DOI:
10.17188/1262865

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Cs2Pd3S4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1262865.
Persson, Kristin, & Project, Materials. Materials Data on Cs2Pd3S4 by Materials Project. United States. doi:10.17188/1262865.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Cs2Pd3S4 by Materials Project". United States. doi:10.17188/1262865. https://www.osti.gov/servlets/purl/1262865. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1262865,
title = {Materials Data on Cs2Pd3S4 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Cs2Pd3S4 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight equivalent S2- atoms. There are a spread of Cs–S bond distances ranging from 3.68–3.81 Å. There are three inequivalent Pd2+ sites. In the first Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.37 Å. In the second Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.38 Å. In the third Pd2+ site, Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.38 Å. S2- is bonded in a 7-coordinate geometry to four equivalent Cs1+ and three Pd2+ atoms.},
doi = {10.17188/1262865},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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