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Title: Materials Data on CsSi by Materials Project

Abstract

SiCs crystallizes in the tetragonal I4_1/acd space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 8-coordinate geometry to eight equivalent Si atoms. There are a spread of Cs–Si bond distances ranging from 3.75–4.08 Å. In the second Cs site, Cs is bonded in a 6-coordinate geometry to six equivalent Si atoms. There are a spread of Cs–Si bond distances ranging from 3.81–3.99 Å. Si is bonded in a 10-coordinate geometry to seven Cs and three equivalent Si atoms. There are two shorter (2.43 Å) and one longer (2.44 Å) Si–Si bond lengths.

Authors:
Publication Date:
Other Number(s):
mp-866482
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; CsSi; Cs-Si
OSTI Identifier:
1311576
DOI:
https://doi.org/10.17188/1311576

Citation Formats

The Materials Project. Materials Data on CsSi by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1311576.
The Materials Project. Materials Data on CsSi by Materials Project. United States. doi:https://doi.org/10.17188/1311576
The Materials Project. 2020. "Materials Data on CsSi by Materials Project". United States. doi:https://doi.org/10.17188/1311576. https://www.osti.gov/servlets/purl/1311576. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1311576,
title = {Materials Data on CsSi by Materials Project},
author = {The Materials Project},
abstractNote = {SiCs crystallizes in the tetragonal I4_1/acd space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 8-coordinate geometry to eight equivalent Si atoms. There are a spread of Cs–Si bond distances ranging from 3.75–4.08 Å. In the second Cs site, Cs is bonded in a 6-coordinate geometry to six equivalent Si atoms. There are a spread of Cs–Si bond distances ranging from 3.81–3.99 Å. Si is bonded in a 10-coordinate geometry to seven Cs and three equivalent Si atoms. There are two shorter (2.43 Å) and one longer (2.44 Å) Si–Si bond lengths.},
doi = {10.17188/1311576},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}