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Title: Materials Data on InCo3SnS2 by Materials Project

Abstract

Co3SnInS2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Co is bonded in a distorted linear geometry to two equivalent In, two equivalent Sn, and two equivalent S atoms. Both Co–In bond lengths are 2.74 Å. Both Co–Sn bond lengths are 2.66 Å. Both Co–S bond lengths are 2.16 Å. In is bonded to six equivalent Co and six equivalent S atoms to form InCo6S6 cuboctahedra that share corners with six equivalent InCo6S6 cuboctahedra, edges with six equivalent InCo6S6 cuboctahedra, and faces with six equivalent SnCo6S2 hexagonal bipyramids. All In–S bond lengths are 3.16 Å. Sn is bonded to six equivalent Co and two equivalent S atoms to form SnCo6S2 hexagonal bipyramids that share corners with six equivalent SnCo6S2 hexagonal bipyramids and faces with six equivalent InCo6S6 cuboctahedra. Both Sn–S bond lengths are 3.03 Å. S is bonded in a 3-coordinate geometry to three equivalent Co, three equivalent In, and one Sn atom.

Authors:
Publication Date:
Other Number(s):
mp-1077901
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; InCo3SnS2; Co-In-S-Sn
OSTI Identifier:
1717135
DOI:
https://doi.org/10.17188/1717135

Citation Formats

The Materials Project. Materials Data on InCo3SnS2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1717135.
The Materials Project. Materials Data on InCo3SnS2 by Materials Project. United States. doi:https://doi.org/10.17188/1717135
The Materials Project. 2020. "Materials Data on InCo3SnS2 by Materials Project". United States. doi:https://doi.org/10.17188/1717135. https://www.osti.gov/servlets/purl/1717135. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1717135,
title = {Materials Data on InCo3SnS2 by Materials Project},
author = {The Materials Project},
abstractNote = {Co3SnInS2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Co is bonded in a distorted linear geometry to two equivalent In, two equivalent Sn, and two equivalent S atoms. Both Co–In bond lengths are 2.74 Å. Both Co–Sn bond lengths are 2.66 Å. Both Co–S bond lengths are 2.16 Å. In is bonded to six equivalent Co and six equivalent S atoms to form InCo6S6 cuboctahedra that share corners with six equivalent InCo6S6 cuboctahedra, edges with six equivalent InCo6S6 cuboctahedra, and faces with six equivalent SnCo6S2 hexagonal bipyramids. All In–S bond lengths are 3.16 Å. Sn is bonded to six equivalent Co and two equivalent S atoms to form SnCo6S2 hexagonal bipyramids that share corners with six equivalent SnCo6S2 hexagonal bipyramids and faces with six equivalent InCo6S6 cuboctahedra. Both Sn–S bond lengths are 3.03 Å. S is bonded in a 3-coordinate geometry to three equivalent Co, three equivalent In, and one Sn atom.},
doi = {10.17188/1717135},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}