U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TbRe2SiC by Materials Project
Abstract
TbRe2SiC crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Tb is bonded in a 4-coordinate geometry to three equivalent Si and four C atoms. There are one shorter (3.03 Å) and two longer (3.14 Å) Tb–Si bond lengths. All Tb–C bond lengths are 2.74 Å. There are two inequivalent Re sites. In the first Re site, Re is bonded in a single-bond geometry to three equivalent Si and one C atom. There are one shorter (2.49 Å) and two longer (2.51 Å) Re–Si bond lengths. The Re–C bond length is 1.95 Å. In the second Re site, Re is bonded in a single-bond geometry to three equivalent Si and one C atom. There are one shorter (2.48 Å) and two longer (2.50 Å) Re–Si bond lengths. The Re–C bond length is 1.95 Å. Si is bonded in a 9-coordinate geometry to three equivalent Tb and six Re atoms. There are two inequivalent C sites. In the first C site, C is bonded to four equivalent Tb and two equivalent Re atoms to form a mixture of edge and corner-sharing CTb4Re2 octahedra. The corner-sharing octahedral tilt angles are 20°. In the second C site, C is bonded tomore »
- Publication Date:
- Other Number(s):
- mp-569505
- 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-Re-Si-Tb; TbRe2SiC; crystal structure
- OSTI Identifier:
- 1275126
- DOI:
- https://doi.org/10.17188/1275126
Citation Formats
Materials Data on TbRe2SiC by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1275126.
Materials Data on TbRe2SiC by Materials Project. United States. doi:https://doi.org/10.17188/1275126
2020.
"Materials Data on TbRe2SiC by Materials Project". United States. doi:https://doi.org/10.17188/1275126. https://www.osti.gov/servlets/purl/1275126. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1275126,
title = {Materials Data on TbRe2SiC by Materials Project},
abstractNote = {TbRe2SiC crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Tb is bonded in a 4-coordinate geometry to three equivalent Si and four C atoms. There are one shorter (3.03 Å) and two longer (3.14 Å) Tb–Si bond lengths. All Tb–C bond lengths are 2.74 Å. There are two inequivalent Re sites. In the first Re site, Re is bonded in a single-bond geometry to three equivalent Si and one C atom. There are one shorter (2.49 Å) and two longer (2.51 Å) Re–Si bond lengths. The Re–C bond length is 1.95 Å. In the second Re site, Re is bonded in a single-bond geometry to three equivalent Si and one C atom. There are one shorter (2.48 Å) and two longer (2.50 Å) Re–Si bond lengths. The Re–C bond length is 1.95 Å. Si is bonded in a 9-coordinate geometry to three equivalent Tb and six Re atoms. There are two inequivalent C sites. In the first C site, C is bonded to four equivalent Tb and two equivalent Re atoms to form a mixture of edge and corner-sharing CTb4Re2 octahedra. The corner-sharing octahedral tilt angles are 20°. In the second C site, C is bonded to four equivalent Tb and two equivalent Re atoms to form a mixture of edge and corner-sharing CTb4Re2 octahedra. The corner-sharing octahedral tilt angles are 20°.},
doi = {10.17188/1275126},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}