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Title: Materials Data on CsC8 by Materials Project

Abstract

CsC8 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Cs1+ is bonded to twelve C+0.12- atoms to form face-sharing CsC12 cuboctahedra. All Cs–C bond lengths are 3.38 Å. There are five inequivalent C+0.12- sites. In the first C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. All C–C bond lengths are 1.44 Å. In the second C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. Both C–C bond lengths are 1.44 Å. In the third C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. The C–C bond length is 1.44 Å. In the fourth C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. All C–C bond lengths are 1.44 Å. In the fifth C+0.12- site, C+0.12- is bonded in a trigonal planar geometry to three C+0.12- atoms.

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:
1202941
Report Number(s):
mp-28861
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; CsC8; C-Cs

Citation Formats

The Materials Project. Materials Data on CsC8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1202941.
The Materials Project. Materials Data on CsC8 by Materials Project. United States. https://doi.org/10.17188/1202941
The Materials Project. 2020. "Materials Data on CsC8 by Materials Project". United States. https://doi.org/10.17188/1202941. https://www.osti.gov/servlets/purl/1202941.
@article{osti_1202941,
title = {Materials Data on CsC8 by Materials Project},
author = {The Materials Project},
abstractNote = {CsC8 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Cs1+ is bonded to twelve C+0.12- atoms to form face-sharing CsC12 cuboctahedra. All Cs–C bond lengths are 3.38 Å. There are five inequivalent C+0.12- sites. In the first C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. All C–C bond lengths are 1.44 Å. In the second C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. Both C–C bond lengths are 1.44 Å. In the third C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. The C–C bond length is 1.44 Å. In the fourth C+0.12- site, C+0.12- is bonded in a distorted trigonal planar geometry to two equivalent Cs1+ and three C+0.12- atoms. All C–C bond lengths are 1.44 Å. In the fifth C+0.12- site, C+0.12- is bonded in a trigonal planar geometry to three C+0.12- atoms.},
doi = {10.17188/1202941},
url = {https://www.osti.gov/biblio/1202941}, journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri Jul 17 00:00:00 EDT 2020},
month = {Fri Jul 17 00:00:00 EDT 2020}
}