Materials Data on CBr4 by Materials Project
Abstract
CBr4 is Iron carbide-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of thirty-two carbon tetrabromide molecules. C4+ is bonded in a tetrahedral geometry to four Br1- atoms. There is two shorter (1.95 Å) and two longer (1.97 Å) C–Br bond length. There are four inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom. In the second Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom. In the third Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom. In the fourth Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom.
- Authors:
- Publication Date:
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Contributing Org.:
- MIT; UC Berkeley; Duke; U Louvain
- OSTI Identifier:
- 1283630
- Report Number(s):
- mp-680422
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Resource Type:
- Data
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; CBr4; Br-C
Citation Formats
The Materials Project. Materials Data on CBr4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1283630.
The Materials Project. Materials Data on CBr4 by Materials Project. United States. https://doi.org/10.17188/1283630
The Materials Project. 2020.
"Materials Data on CBr4 by Materials Project". United States. https://doi.org/10.17188/1283630. https://www.osti.gov/servlets/purl/1283630.
@article{osti_1283630,
title = {Materials Data on CBr4 by Materials Project},
author = {The Materials Project},
abstractNote = {CBr4 is Iron carbide-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of thirty-two carbon tetrabromide molecules. C4+ is bonded in a tetrahedral geometry to four Br1- atoms. There is two shorter (1.95 Å) and two longer (1.97 Å) C–Br bond length. There are four inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom. In the second Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom. In the third Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom. In the fourth Br1- site, Br1- is bonded in a single-bond geometry to one C4+ atom.},
doi = {10.17188/1283630},
url = {https://www.osti.gov/biblio/1283630},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat May 02 00:00:00 EDT 2020},
month = {Sat May 02 00:00:00 EDT 2020}
}
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