U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on B13C2 by Materials Project
Abstract
B13C2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are three inequivalent B sites. In the first B site, B is bonded in a linear geometry to two equivalent C atoms. Both B–C bond lengths are 1.44 Å. In the second B site, B is bonded in a single-bond geometry to three equivalent B and one C atom. There is one shorter (1.79 Å) and two longer (1.82 Å) B–B bond length. The B–C bond length is 1.61 Å. In the third B site, B is bonded in a 6-coordinate geometry to six B atoms. There is one shorter (1.77 Å) and two longer (1.79 Å) B–B bond length. C is bonded to four B atoms to form corner-sharing CB4 trigonal pyramids.
- Publication Date:
- Other Number(s):
- mp-576
- 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; B-C; B13C2; crystal structure
- OSTI Identifier:
- 1276602
- DOI:
- https://doi.org/10.17188/1276602
Citation Formats
Materials Data on B13C2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1276602.
Materials Data on B13C2 by Materials Project. United States. doi:https://doi.org/10.17188/1276602
2020.
"Materials Data on B13C2 by Materials Project". United States. doi:https://doi.org/10.17188/1276602. https://www.osti.gov/servlets/purl/1276602. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1276602,
title = {Materials Data on B13C2 by Materials Project},
abstractNote = {B13C2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are three inequivalent B sites. In the first B site, B is bonded in a linear geometry to two equivalent C atoms. Both B–C bond lengths are 1.44 Å. In the second B site, B is bonded in a single-bond geometry to three equivalent B and one C atom. There is one shorter (1.79 Å) and two longer (1.82 Å) B–B bond length. The B–C bond length is 1.61 Å. In the third B site, B is bonded in a 6-coordinate geometry to six B atoms. There is one shorter (1.77 Å) and two longer (1.79 Å) B–B bond length. C is bonded to four B atoms to form corner-sharing CB4 trigonal pyramids.},
doi = {10.17188/1276602},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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