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Title: Materials Data on Pr3IrBr3 by Materials Project

Abstract

Pr3IrBr3 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. Pr is bonded to two equivalent Ir and four equivalent Br atoms to form a mixture of edge and corner-sharing PrIr2Br4 octahedra. The corner-sharing octahedra tilt angles range from 6–8°. Both Pr–Ir bond lengths are 2.86 Å. There are two shorter (3.13 Å) and two longer (3.26 Å) Pr–Br bond lengths. Ir is bonded to six equivalent Pr atoms to form edge-sharing IrPr6 octahedra. Br is bonded in a rectangular see-saw-like geometry to four equivalent Pr atoms.

Authors:
Publication Date:
Other Number(s):
mp-1209858
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; Pr3IrBr3; Br-Ir-Pr
OSTI Identifier:
1681683
DOI:
https://doi.org/10.17188/1681683

Citation Formats

The Materials Project. Materials Data on Pr3IrBr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1681683.
The Materials Project. Materials Data on Pr3IrBr3 by Materials Project. United States. doi:https://doi.org/10.17188/1681683
The Materials Project. 2020. "Materials Data on Pr3IrBr3 by Materials Project". United States. doi:https://doi.org/10.17188/1681683. https://www.osti.gov/servlets/purl/1681683. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1681683,
title = {Materials Data on Pr3IrBr3 by Materials Project},
author = {The Materials Project},
abstractNote = {Pr3IrBr3 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. Pr is bonded to two equivalent Ir and four equivalent Br atoms to form a mixture of edge and corner-sharing PrIr2Br4 octahedra. The corner-sharing octahedra tilt angles range from 6–8°. Both Pr–Ir bond lengths are 2.86 Å. There are two shorter (3.13 Å) and two longer (3.26 Å) Pr–Br bond lengths. Ir is bonded to six equivalent Pr atoms to form edge-sharing IrPr6 octahedra. Br is bonded in a rectangular see-saw-like geometry to four equivalent Pr atoms.},
doi = {10.17188/1681683},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}