U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ta2CS2 by Materials Project
Abstract
Ta2S2C crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one Ta2S2C sheet oriented in the (0, 0, 1) direction. Ta4+ is bonded to three equivalent C4- and three equivalent S2- atoms to form a mixture of edge and corner-sharing TaC3S3 octahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–C bond lengths are 2.24 Å. All Ta–S bond lengths are 2.50 Å. C4- is bonded to six equivalent Ta4+ atoms to form edge-sharing CTa6 octahedra. S2- is bonded in a 3-coordinate geometry to three equivalent Ta4+ atoms.
- Publication Date:
- Other Number(s):
- mp-559976
- 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; C-S-Ta; Ta2CS2; crystal structure
- OSTI Identifier:
- 1271174
- DOI:
- https://doi.org/10.17188/1271174
Citation Formats
Materials Data on Ta2CS2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1271174.
Materials Data on Ta2CS2 by Materials Project. United States. doi:https://doi.org/10.17188/1271174
2020.
"Materials Data on Ta2CS2 by Materials Project". United States. doi:https://doi.org/10.17188/1271174. https://www.osti.gov/servlets/purl/1271174. Pub date:Wed Jul 15 04:00:00 UTC 2020
@article{osti_1271174,
title = {Materials Data on Ta2CS2 by Materials Project},
abstractNote = {Ta2S2C crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one Ta2S2C sheet oriented in the (0, 0, 1) direction. Ta4+ is bonded to three equivalent C4- and three equivalent S2- atoms to form a mixture of edge and corner-sharing TaC3S3 octahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–C bond lengths are 2.24 Å. All Ta–S bond lengths are 2.50 Å. C4- is bonded to six equivalent Ta4+ atoms to form edge-sharing CTa6 octahedra. S2- is bonded in a 3-coordinate geometry to three equivalent Ta4+ atoms.},
doi = {10.17188/1271174},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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