U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cu2SnHgS4 by Materials Project
Abstract
Cu2HgSnS4 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 HgS4 tetrahedra, and corners with four equivalent SnS4 tetrahedra. All Cu–S bond lengths are 2.32 Å. Hg2+ is bonded to four equivalent S2- atoms to form HgS4 tetrahedra that share corners with four equivalent SnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Hg–S bond lengths are 2.59 Å. Sn4+ is bonded to four equivalent S2- atoms to form SnS4 tetrahedra that share corners with four equivalent HgS4 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 Hg2+, and one Sn4+ atom to form corner-sharing SCu2SnHg tetrahedra.
- Publication Date:
- Other Number(s):
- mp-1025467
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Cu-Hg-S-Sn; Cu2SnHgS4; crystal structure
- OSTI Identifier:
- 1355321
- DOI:
- https://doi.org/10.17188/1355321
Citation Formats
Materials Data on Cu2SnHgS4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1355321.
Materials Data on Cu2SnHgS4 by Materials Project. United States. doi:https://doi.org/10.17188/1355321
2020.
"Materials Data on Cu2SnHgS4 by Materials Project". United States. doi:https://doi.org/10.17188/1355321. https://www.osti.gov/servlets/purl/1355321. Pub date:Wed Jul 15 04:00:00 UTC 2020
@article{osti_1355321,
title = {Materials Data on Cu2SnHgS4 by Materials Project},
abstractNote = {Cu2HgSnS4 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 HgS4 tetrahedra, and corners with four equivalent SnS4 tetrahedra. All Cu–S bond lengths are 2.32 Å. Hg2+ is bonded to four equivalent S2- atoms to form HgS4 tetrahedra that share corners with four equivalent SnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. All Hg–S bond lengths are 2.59 Å. Sn4+ is bonded to four equivalent S2- atoms to form SnS4 tetrahedra that share corners with four equivalent HgS4 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 Hg2+, and one Sn4+ atom to form corner-sharing SCu2SnHg tetrahedra.},
doi = {10.17188/1355321},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}