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Title: Materials Data on PuRh3C by Materials Project

Abstract

PuRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pu is bonded to twelve equivalent Rh atoms to form PuRh12 cuboctahedra that share corners with twelve equivalent PuRh12 cuboctahedra, faces with six equivalent PuRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Pu–Rh bond lengths are 2.98 Å. Rh is bonded to four equivalent Pu and two equivalent C atoms to form a mixture of distorted face, edge, and corner-sharing RhPu4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.11 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent PuRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Publication Date:
Other Number(s):
mp-510492
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; PuRh3C; C-Pu-Rh
OSTI Identifier:
1262974
DOI:
https://doi.org/10.17188/1262974

Citation Formats

The Materials Project. Materials Data on PuRh3C by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1262974.
The Materials Project. Materials Data on PuRh3C by Materials Project. United States. doi:https://doi.org/10.17188/1262974
The Materials Project. 2020. "Materials Data on PuRh3C by Materials Project". United States. doi:https://doi.org/10.17188/1262974. https://www.osti.gov/servlets/purl/1262974. Pub date:Mon Aug 03 00:00:00 EDT 2020
@article{osti_1262974,
title = {Materials Data on PuRh3C by Materials Project},
author = {The Materials Project},
abstractNote = {PuRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pu is bonded to twelve equivalent Rh atoms to form PuRh12 cuboctahedra that share corners with twelve equivalent PuRh12 cuboctahedra, faces with six equivalent PuRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Pu–Rh bond lengths are 2.98 Å. Rh is bonded to four equivalent Pu and two equivalent C atoms to form a mixture of distorted face, edge, and corner-sharing RhPu4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.11 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent PuRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1262974},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}