U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Na3SbTe3 by Materials Project
Abstract
Na3SbTe3 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. there are three inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded to six equivalent Te2- atoms to form a mixture of edge, face, and corner-sharing NaTe6 octahedra. The corner-sharing octahedra tilt angles range from 38–56°. There are three shorter (3.29 Å) and three longer (3.50 Å) Na–Te bond lengths. In the second Na1+ site, Na1+ is bonded to six equivalent Te2- atoms to form a mixture of distorted edge, face, and corner-sharing NaTe6 octahedra. The corner-sharing octahedra tilt angles range from 20–47°. There are three shorter (3.24 Å) and three longer (3.45 Å) Na–Te bond lengths. In the third Na1+ site, Na1+ is bonded to six equivalent Te2- atoms to form a mixture of distorted edge, face, and corner-sharing NaTe6 octahedra. The corner-sharing octahedra tilt angles range from 20–48°. There are three shorter (3.25 Å) and three longer (3.40 Å) Na–Te bond lengths. Sb3+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent Te2- atoms. All Sb–Te bond lengths are 2.84 Å. Te2- is bonded to six Na1+ and one Sb3+ atom to form a mixture of distorted edge, face, and corner-sharing TeNa6Sbmore »
- Publication Date:
- Other Number(s):
- mp-9191
- 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; Na-Sb-Te; Na3SbTe3; crystal structure
- OSTI Identifier:
- 1313036
- DOI:
- https://doi.org/10.17188/1313036
Citation Formats
Materials Data on Na3SbTe3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1313036.
Materials Data on Na3SbTe3 by Materials Project. United States. doi:https://doi.org/10.17188/1313036
2020.
"Materials Data on Na3SbTe3 by Materials Project". United States. doi:https://doi.org/10.17188/1313036. https://www.osti.gov/servlets/purl/1313036. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1313036,
title = {Materials Data on Na3SbTe3 by Materials Project},
abstractNote = {Na3SbTe3 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. there are three inequivalent Na1+ sites. In the first Na1+ site, Na1+ is bonded to six equivalent Te2- atoms to form a mixture of edge, face, and corner-sharing NaTe6 octahedra. The corner-sharing octahedra tilt angles range from 38–56°. There are three shorter (3.29 Å) and three longer (3.50 Å) Na–Te bond lengths. In the second Na1+ site, Na1+ is bonded to six equivalent Te2- atoms to form a mixture of distorted edge, face, and corner-sharing NaTe6 octahedra. The corner-sharing octahedra tilt angles range from 20–47°. There are three shorter (3.24 Å) and three longer (3.45 Å) Na–Te bond lengths. In the third Na1+ site, Na1+ is bonded to six equivalent Te2- atoms to form a mixture of distorted edge, face, and corner-sharing NaTe6 octahedra. The corner-sharing octahedra tilt angles range from 20–48°. There are three shorter (3.25 Å) and three longer (3.40 Å) Na–Te bond lengths. Sb3+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent Te2- atoms. All Sb–Te bond lengths are 2.84 Å. Te2- is bonded to six Na1+ and one Sb3+ atom to form a mixture of distorted edge, face, and corner-sharing TeNa6Sb pentagonal bipyramids.},
doi = {10.17188/1313036},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}