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Title: Materials Data on MnCu2SnS4 by Materials Project

Abstract

Cu2MnSnS4 is Stannite structured and crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Mn2+ is bonded to four equivalent S2- atoms to form MnS4 tetrahedra that share corners with four equivalent SnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Mn–S bond lengths are 2.40 Å. Cu1+ is bonded to four equivalent S2- atoms to form CuS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra, corners with four equivalent CuS4 tetrahedra, and corners with four equivalent SnS4 tetrahedra. All Cu–S bond lengths are 2.31 Å. Sn4+ is bonded to four equivalent S2- atoms to form SnS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Sn–S bond lengths are 2.47 Å. S2- is bonded to one Mn2+, two equivalent Cu1+, and one Sn4+ atom to form corner-sharing SMnCu2Sn tetrahedra.

Publication Date:
Other Number(s):
mp-19722
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; MnCu2SnS4; Cu-Mn-S-Sn
OSTI Identifier:
1194930
DOI:
https://doi.org/10.17188/1194930

Citation Formats

The Materials Project. Materials Data on MnCu2SnS4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1194930.
The Materials Project. Materials Data on MnCu2SnS4 by Materials Project. United States. doi:https://doi.org/10.17188/1194930
The Materials Project. 2020. "Materials Data on MnCu2SnS4 by Materials Project". United States. doi:https://doi.org/10.17188/1194930. https://www.osti.gov/servlets/purl/1194930. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1194930,
title = {Materials Data on MnCu2SnS4 by Materials Project},
author = {The Materials Project},
abstractNote = {Cu2MnSnS4 is Stannite structured and crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Mn2+ is bonded to four equivalent S2- atoms to form MnS4 tetrahedra that share corners with four equivalent SnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Mn–S bond lengths are 2.40 Å. Cu1+ is bonded to four equivalent S2- atoms to form CuS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra, corners with four equivalent CuS4 tetrahedra, and corners with four equivalent SnS4 tetrahedra. All Cu–S bond lengths are 2.31 Å. Sn4+ is bonded to four equivalent S2- atoms to form SnS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Sn–S bond lengths are 2.47 Å. S2- is bonded to one Mn2+, two equivalent Cu1+, and one Sn4+ atom to form corner-sharing SMnCu2Sn tetrahedra.},
doi = {10.17188/1194930},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}