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Title: Materials Data on RbMnCuS2 by Materials Project

Abstract

RbMnCuS2 is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I-4m2 space group. The structure is three-dimensional. Rb1+ is bonded in a body-centered cubic geometry to eight equivalent S2- atoms. All Rb–S bond lengths are 3.50 Å. Mn2+ is bonded to four equivalent S2- atoms to form MnS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra and edges with four equivalent CuS4 tetrahedra. All Mn–S bond lengths are 2.43 Å. Cu1+ is bonded to four equivalent S2- atoms to form CuS4 tetrahedra that share corners with four equivalent CuS4 tetrahedra and edges with four equivalent MnS4 tetrahedra. All Cu–S bond lengths are 2.43 Å. S2- is bonded in a 4-coordinate geometry to four equivalent Rb1+, two equivalent Mn2+, and two equivalent Cu1+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1219557
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; RbMnCuS2; Cu-Mn-Rb-S
OSTI Identifier:
1679201
DOI:
https://doi.org/10.17188/1679201

Citation Formats

The Materials Project. Materials Data on RbMnCuS2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1679201.
The Materials Project. Materials Data on RbMnCuS2 by Materials Project. United States. doi:https://doi.org/10.17188/1679201
The Materials Project. 2020. "Materials Data on RbMnCuS2 by Materials Project". United States. doi:https://doi.org/10.17188/1679201. https://www.osti.gov/servlets/purl/1679201. Pub date:Sat May 09 00:00:00 EDT 2020
@article{osti_1679201,
title = {Materials Data on RbMnCuS2 by Materials Project},
author = {The Materials Project},
abstractNote = {RbMnCuS2 is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I-4m2 space group. The structure is three-dimensional. Rb1+ is bonded in a body-centered cubic geometry to eight equivalent S2- atoms. All Rb–S bond lengths are 3.50 Å. Mn2+ is bonded to four equivalent S2- atoms to form MnS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra and edges with four equivalent CuS4 tetrahedra. All Mn–S bond lengths are 2.43 Å. Cu1+ is bonded to four equivalent S2- atoms to form CuS4 tetrahedra that share corners with four equivalent CuS4 tetrahedra and edges with four equivalent MnS4 tetrahedra. All Cu–S bond lengths are 2.43 Å. S2- is bonded in a 4-coordinate geometry to four equivalent Rb1+, two equivalent Mn2+, and two equivalent Cu1+ atoms.},
doi = {10.17188/1679201},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}