U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ag5SbS4 by Materials Project
Abstract
Ag5SbS4 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are three inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a 3-coordinate geometry to three S2- atoms. There are a spread of Ag–S bond distances ranging from 2.53–2.68 Å. In the second Ag1+ site, Ag1+ is bonded in a 3-coordinate geometry to four S2- atoms. There are a spread of Ag–S bond distances ranging from 2.54–3.20 Å. In the third Ag1+ site, Ag1+ is bonded in a distorted trigonal planar geometry to three S2- atoms. There are one shorter (2.48 Å) and two longer (2.56 Å) Ag–S bond lengths. Sb3+ is bonded in a distorted T-shaped geometry to three S2- atoms. There are two shorter (2.47 Å) and one longer (2.52 Å) Sb–S bond lengths. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 4-coordinate geometry to four Ag1+ and one Sb3+ atom. In the second S2- site, S2- is bonded in a 5-coordinate geometry to four Ag1+ and one Sb3+ atom. In the third S2- site, S2- is bonded in a 5-coordinate geometry to five Ag1+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-4004
- 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; Ag5SbS4; Ag-S-Sb
- OSTI Identifier:
- 1207721
- DOI:
- https://doi.org/10.17188/1207721
Citation Formats
The Materials Project. Materials Data on Ag5SbS4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1207721.
The Materials Project. Materials Data on Ag5SbS4 by Materials Project. United States. doi:https://doi.org/10.17188/1207721
The Materials Project. 2020.
"Materials Data on Ag5SbS4 by Materials Project". United States. doi:https://doi.org/10.17188/1207721. https://www.osti.gov/servlets/purl/1207721. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1207721,
title = {Materials Data on Ag5SbS4 by Materials Project},
author = {The Materials Project},
abstractNote = {Ag5SbS4 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are three inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a 3-coordinate geometry to three S2- atoms. There are a spread of Ag–S bond distances ranging from 2.53–2.68 Å. In the second Ag1+ site, Ag1+ is bonded in a 3-coordinate geometry to four S2- atoms. There are a spread of Ag–S bond distances ranging from 2.54–3.20 Å. In the third Ag1+ site, Ag1+ is bonded in a distorted trigonal planar geometry to three S2- atoms. There are one shorter (2.48 Å) and two longer (2.56 Å) Ag–S bond lengths. Sb3+ is bonded in a distorted T-shaped geometry to three S2- atoms. There are two shorter (2.47 Å) and one longer (2.52 Å) Sb–S bond lengths. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 4-coordinate geometry to four Ag1+ and one Sb3+ atom. In the second S2- site, S2- is bonded in a 5-coordinate geometry to four Ag1+ and one Sb3+ atom. In the third S2- site, S2- is bonded in a 5-coordinate geometry to five Ag1+ atoms.},
doi = {10.17188/1207721},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}