U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Sn3S7 by Materials Project
Abstract
Sn3S7 crystallizes in the monoclinic Cc space group. The structure is two-dimensional and consists of two Sn3S7 sheets oriented in the (0, 0, 1) direction. there are six inequivalent Sn2+ sites. In the first Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.45–2.66 Å. In the second Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.63 Å. In the third Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.45–2.65 Å. In the fourth Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.64 Å. In the fifth Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.64 Å. In the sixth Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. Theremore »
- Publication Date:
- Other Number(s):
- mp-1203031
- 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; S-Sn; Sn3S7; crystal structure
- OSTI Identifier:
- 1744912
- DOI:
- https://doi.org/10.17188/1744912
Citation Formats
Materials Data on Sn3S7 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1744912.
Materials Data on Sn3S7 by Materials Project. United States. doi:https://doi.org/10.17188/1744912
2020.
"Materials Data on Sn3S7 by Materials Project". United States. doi:https://doi.org/10.17188/1744912. https://www.osti.gov/servlets/purl/1744912. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1744912,
title = {Materials Data on Sn3S7 by Materials Project},
abstractNote = {Sn3S7 crystallizes in the monoclinic Cc space group. The structure is two-dimensional and consists of two Sn3S7 sheets oriented in the (0, 0, 1) direction. there are six inequivalent Sn2+ sites. In the first Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.45–2.66 Å. In the second Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.63 Å. In the third Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.45–2.65 Å. In the fourth Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.64 Å. In the fifth Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.64 Å. In the sixth Sn2+ site, Sn2+ is bonded to five S+0.86- atoms to form edge-sharing SnS5 trigonal bipyramids. There are a spread of Sn–S bond distances ranging from 2.44–2.67 Å. There are fourteen inequivalent S+0.86- sites. In the first S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the second S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the third S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the fourth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the fifth S+0.86- site, S+0.86- is bonded in a distorted T-shaped geometry to three Sn2+ atoms. In the sixth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the seventh S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the eighth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the ninth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the tenth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the eleventh S+0.86- site, S+0.86- is bonded in a 3-coordinate geometry to three Sn2+ atoms. In the twelfth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the thirteenth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms. In the fourteenth S+0.86- site, S+0.86- is bonded in an L-shaped geometry to two Sn2+ atoms.},
doi = {10.17188/1744912},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}