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Title: Materials Data on CeSiBIr3 by Materials Project

Abstract

CeIr3BSi crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to twelve equivalent Ir, three equivalent B, and three equivalent Si atoms. All Ce–Ir bond lengths are 3.27 Å. All Ce–B bond lengths are 3.20 Å. All Ce–Si bond lengths are 3.20 Å. Ir is bonded in a distorted rectangular see-saw-like geometry to four equivalent Ce, two equivalent B, and two equivalent Si atoms. Both Ir–B bond lengths are 2.32 Å. Both Ir–Si bond lengths are 2.41 Å. B is bonded in a 9-coordinate geometry to three equivalent Ce and six equivalent Ir atoms. Si is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent Ir atoms.

Publication Date:
Other Number(s):
mp-1226531
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-Ce-Ir-Si; CeSiBIr3; crystal structure
OSTI Identifier:
1707628
DOI:
https://doi.org/10.17188/1707628

Citation Formats

Materials Data on CeSiBIr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1707628.
Materials Data on CeSiBIr3 by Materials Project. United States. doi:https://doi.org/10.17188/1707628
2020. "Materials Data on CeSiBIr3 by Materials Project". United States. doi:https://doi.org/10.17188/1707628. https://www.osti.gov/servlets/purl/1707628. Pub date:Sun May 03 04:00:00 UTC 2020
@article{osti_1707628,
title = {Materials Data on CeSiBIr3 by Materials Project},
abstractNote = {CeIr3BSi crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to twelve equivalent Ir, three equivalent B, and three equivalent Si atoms. All Ce–Ir bond lengths are 3.27 Å. All Ce–B bond lengths are 3.20 Å. All Ce–Si bond lengths are 3.20 Å. Ir is bonded in a distorted rectangular see-saw-like geometry to four equivalent Ce, two equivalent B, and two equivalent Si atoms. Both Ir–B bond lengths are 2.32 Å. Both Ir–Si bond lengths are 2.41 Å. B is bonded in a 9-coordinate geometry to three equivalent Ce and six equivalent Ir atoms. Si is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent Ir atoms.},
doi = {10.17188/1707628},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}