skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on PrBRh3 by Materials Project

Abstract

PrRh3B is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pr is bonded to twelve equivalent Rh atoms to form PrRh12 cuboctahedra that share corners with twelve equivalent PrRh12 cuboctahedra, faces with six equivalent PrRh12 cuboctahedra, and faces with eight equivalent BRh6 octahedra. All Pr–Rh bond lengths are 3.02 Å. Rh is bonded to four equivalent Pr and two equivalent B atoms to form a mixture of distorted edge, face, and corner-sharing RhPr4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–B bond lengths are 2.14 Å. B is bonded to six equivalent Rh atoms to form BRh6 octahedra that share corners with six equivalent BRh6 octahedra and faces with eight equivalent PrRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Publication Date:
Other Number(s):
mp-5200
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; PrBRh3; B-Pr-Rh
OSTI Identifier:
1263141
DOI:
10.17188/1263141

Citation Formats

The Materials Project. Materials Data on PrBRh3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1263141.
The Materials Project. Materials Data on PrBRh3 by Materials Project. United States. doi:10.17188/1263141.
The Materials Project. 2020. "Materials Data on PrBRh3 by Materials Project". United States. doi:10.17188/1263141. https://www.osti.gov/servlets/purl/1263141. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1263141,
title = {Materials Data on PrBRh3 by Materials Project},
author = {The Materials Project},
abstractNote = {PrRh3B is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pr is bonded to twelve equivalent Rh atoms to form PrRh12 cuboctahedra that share corners with twelve equivalent PrRh12 cuboctahedra, faces with six equivalent PrRh12 cuboctahedra, and faces with eight equivalent BRh6 octahedra. All Pr–Rh bond lengths are 3.02 Å. Rh is bonded to four equivalent Pr and two equivalent B atoms to form a mixture of distorted edge, face, and corner-sharing RhPr4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–B bond lengths are 2.14 Å. B is bonded to six equivalent Rh atoms to form BRh6 octahedra that share corners with six equivalent BRh6 octahedra and faces with eight equivalent PrRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1263141},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

Dataset:

Save / Share: