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Title: Materials Data on TbRh3C by Materials Project

Abstract

TbRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Tb is bonded to twelve equivalent Rh atoms to form TbRh12 cuboctahedra that share corners with twelve equivalent TbRh12 cuboctahedra, faces with six equivalent TbRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Tb–Rh bond lengths are 2.96 Å. Rh is bonded to four equivalent Tb and two equivalent C atoms to form a mixture of distorted corner, edge, and face-sharing RhTb4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.10 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 TbRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-542103
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; TbRh3C; C-Rh-Tb
OSTI Identifier:
1266393
DOI:
10.17188/1266393

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on TbRh3C by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1266393.
Persson, Kristin, & Project, Materials. Materials Data on TbRh3C by Materials Project. United States. doi:10.17188/1266393.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on TbRh3C by Materials Project". United States. doi:10.17188/1266393. https://www.osti.gov/servlets/purl/1266393. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1266393,
title = {Materials Data on TbRh3C by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {TbRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Tb is bonded to twelve equivalent Rh atoms to form TbRh12 cuboctahedra that share corners with twelve equivalent TbRh12 cuboctahedra, faces with six equivalent TbRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Tb–Rh bond lengths are 2.96 Å. Rh is bonded to four equivalent Tb and two equivalent C atoms to form a mixture of distorted corner, edge, and face-sharing RhTb4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.10 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 TbRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1266393},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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