Materials Data on AgAsS2 by Materials Project
Abstract
AgAsS2 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ag1+ is bonded in a 6-coordinate geometry to six S2- atoms. There are a spread of Ag–S bond distances ranging from 2.64–3.37 Å. As3+ is bonded in a distorted T-shaped geometry to three S2- atoms. There are a spread of As–S bond distances ranging from 2.25–2.35 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a 5-coordinate geometry to three equivalent Ag1+ and two equivalent As3+ atoms. In the second S2- site, S2- is bonded to three equivalent Ag1+ and one As3+ atom to form distorted corner-sharing SAg3As tetrahedra.
- Authors:
- Publication Date:
- Other Number(s):
- mp-13740
- 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; AgAsS2; Ag-As-S
- OSTI Identifier:
- 1189737
- DOI:
- https://doi.org/10.17188/1189737
Citation Formats
The Materials Project. Materials Data on AgAsS2 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1189737.
The Materials Project. Materials Data on AgAsS2 by Materials Project. United States. doi:https://doi.org/10.17188/1189737
The Materials Project. 2017.
"Materials Data on AgAsS2 by Materials Project". United States. doi:https://doi.org/10.17188/1189737. https://www.osti.gov/servlets/purl/1189737. Pub date:Thu May 11 00:00:00 EDT 2017
@article{osti_1189737,
title = {Materials Data on AgAsS2 by Materials Project},
author = {The Materials Project},
abstractNote = {AgAsS2 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Ag1+ is bonded in a 6-coordinate geometry to six S2- atoms. There are a spread of Ag–S bond distances ranging from 2.64–3.37 Å. As3+ is bonded in a distorted T-shaped geometry to three S2- atoms. There are a spread of As–S bond distances ranging from 2.25–2.35 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a 5-coordinate geometry to three equivalent Ag1+ and two equivalent As3+ atoms. In the second S2- site, S2- is bonded to three equivalent Ag1+ and one As3+ atom to form distorted corner-sharing SAg3As tetrahedra.},
doi = {10.17188/1189737},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu May 11 00:00:00 EDT 2017},
month = {Thu May 11 00:00:00 EDT 2017}
}
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