U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on AlAgS2 by Materials Project
Abstract
AgAlS2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent S2- atoms to form AgS4 tetrahedra that share corners with four equivalent AgS4 tetrahedra and corners with eight equivalent AlS4 tetrahedra. All Ag–S bond lengths are 2.58 Å. Al3+ is bonded to four equivalent S2- atoms to form AlS4 tetrahedra that share corners with four equivalent AlS4 tetrahedra and corners with eight equivalent AgS4 tetrahedra. All Al–S bond lengths are 2.28 Å. S2- is bonded to two equivalent Ag1+ and two equivalent Al3+ atoms to form corner-sharing SAl2Ag2 tetrahedra.
- Publication Date:
- Other Number(s):
- mp-5782
- 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; Ag-Al-S; AlAgS2; crystal structure
- OSTI Identifier:
- 1272796
- DOI:
- https://doi.org/10.17188/1272796
Citation Formats
Materials Data on AlAgS2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1272796.
Materials Data on AlAgS2 by Materials Project. United States. doi:https://doi.org/10.17188/1272796
2020.
"Materials Data on AlAgS2 by Materials Project". United States. doi:https://doi.org/10.17188/1272796. https://www.osti.gov/servlets/purl/1272796. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1272796,
title = {Materials Data on AlAgS2 by Materials Project},
abstractNote = {AgAlS2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent S2- atoms to form AgS4 tetrahedra that share corners with four equivalent AgS4 tetrahedra and corners with eight equivalent AlS4 tetrahedra. All Ag–S bond lengths are 2.58 Å. Al3+ is bonded to four equivalent S2- atoms to form AlS4 tetrahedra that share corners with four equivalent AlS4 tetrahedra and corners with eight equivalent AgS4 tetrahedra. All Al–S bond lengths are 2.28 Å. S2- is bonded to two equivalent Ag1+ and two equivalent Al3+ atoms to form corner-sharing SAl2Ag2 tetrahedra.},
doi = {10.17188/1272796},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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