U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZnCu2SnS4 by Materials Project
Abstract
Cu2ZnSnS4 is Stannite structured and crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Cu1+ is bonded to four equivalent S2- atoms to form CuS4 tetrahedra that share corners with four equivalent CuS4 tetrahedra, corners with four equivalent ZnS4 tetrahedra, and corners with four equivalent SnS4 tetrahedra. All Cu–S bond lengths are 2.31 Å. Zn2+ is bonded to four equivalent S2- atoms to form ZnS4 tetrahedra that share corners with four equivalent SnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Zn–S bond lengths are 2.37 Å. Sn4+ is bonded to four equivalent S2- atoms to form SnS4 tetrahedra that share corners with four equivalent ZnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Sn–S bond lengths are 2.47 Å. S2- is bonded to two equivalent Cu1+, one Zn2+, and one Sn4+ atom to form corner-sharing SZnCu2Sn tetrahedra.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1025500
- 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; ZnCu2SnS4; Cu-S-Sn-Zn
- OSTI Identifier:
- 1355298
- DOI:
- https://doi.org/10.17188/1355298
Citation Formats
The Materials Project. Materials Data on ZnCu2SnS4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1355298.
The Materials Project. Materials Data on ZnCu2SnS4 by Materials Project. United States. doi:https://doi.org/10.17188/1355298
The Materials Project. 2020.
"Materials Data on ZnCu2SnS4 by Materials Project". United States. doi:https://doi.org/10.17188/1355298. https://www.osti.gov/servlets/purl/1355298. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1355298,
title = {Materials Data on ZnCu2SnS4 by Materials Project},
author = {The Materials Project},
abstractNote = {Cu2ZnSnS4 is Stannite structured and crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Cu1+ is bonded to four equivalent S2- atoms to form CuS4 tetrahedra that share corners with four equivalent CuS4 tetrahedra, corners with four equivalent ZnS4 tetrahedra, and corners with four equivalent SnS4 tetrahedra. All Cu–S bond lengths are 2.31 Å. Zn2+ is bonded to four equivalent S2- atoms to form ZnS4 tetrahedra that share corners with four equivalent SnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Zn–S bond lengths are 2.37 Å. Sn4+ is bonded to four equivalent S2- atoms to form SnS4 tetrahedra that share corners with four equivalent ZnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Sn–S bond lengths are 2.47 Å. S2- is bonded to two equivalent Cu1+, one Zn2+, and one Sn4+ atom to form corner-sharing SZnCu2Sn tetrahedra.},
doi = {10.17188/1355298},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}