U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on In2AgSe4 by Materials Project
Abstract
AgIn2Se4 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. Ag2+ is bonded to four equivalent Se2- atoms to form AgSe4 tetrahedra that share corners with eight InSe4 tetrahedra. All Ag–Se bond lengths are 2.64 Å. There are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded to four equivalent Se2- atoms to form InSe4 tetrahedra that share corners with four equivalent AgSe4 tetrahedra and corners with four equivalent InSe4 tetrahedra. All In–Se bond lengths are 2.64 Å. In the second In3+ site, In3+ is bonded to four equivalent Se2- atoms to form InSe4 tetrahedra that share corners with four equivalent AgSe4 tetrahedra and corners with four equivalent InSe4 tetrahedra. All In–Se bond lengths are 2.64 Å. Se2- is bonded in a trigonal non-coplanar geometry to one Ag2+ and two In3+ atoms.
- Publication Date:
- Other Number(s):
- mp-1025331
- 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-In-Se; In2AgSe4; crystal structure
- OSTI Identifier:
- 1355228
- DOI:
- https://doi.org/10.17188/1355228
Citation Formats
Materials Data on In2AgSe4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1355228.
Materials Data on In2AgSe4 by Materials Project. United States. doi:https://doi.org/10.17188/1355228
2020.
"Materials Data on In2AgSe4 by Materials Project". United States. doi:https://doi.org/10.17188/1355228. https://www.osti.gov/servlets/purl/1355228. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1355228,
title = {Materials Data on In2AgSe4 by Materials Project},
abstractNote = {AgIn2Se4 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. Ag2+ is bonded to four equivalent Se2- atoms to form AgSe4 tetrahedra that share corners with eight InSe4 tetrahedra. All Ag–Se bond lengths are 2.64 Å. There are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded to four equivalent Se2- atoms to form InSe4 tetrahedra that share corners with four equivalent AgSe4 tetrahedra and corners with four equivalent InSe4 tetrahedra. All In–Se bond lengths are 2.64 Å. In the second In3+ site, In3+ is bonded to four equivalent Se2- atoms to form InSe4 tetrahedra that share corners with four equivalent AgSe4 tetrahedra and corners with four equivalent InSe4 tetrahedra. All In–Se bond lengths are 2.64 Å. Se2- is bonded in a trigonal non-coplanar geometry to one Ag2+ and two In3+ atoms.},
doi = {10.17188/1355228},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}