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Title: Materials Data on YRh5 by Materials Project

Abstract

YRh5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Y is bonded in a distorted hexagonal planar geometry to eighteen Rh atoms. There are six shorter (3.03 Å) and twelve longer (3.40 Å) Y–Rh bond lengths. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 12-coordinate geometry to three equivalent Y and nine Rh atoms. There are six shorter (2.64 Å) and three longer (3.03 Å) Rh–Rh bond lengths. In the second Rh site, Rh is bonded to four equivalent Y and eight Rh atoms to form a mixture of edge, face, and corner-sharing RhY4Rh8 cuboctahedra. All Rh–Rh bond lengths are 2.63 Å.

Publication Date:
Other Number(s):
mp-11565
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; YRh5; Rh-Y
OSTI Identifier:
1188070
DOI:
https://doi.org/10.17188/1188070

Citation Formats

The Materials Project. Materials Data on YRh5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1188070.
The Materials Project. Materials Data on YRh5 by Materials Project. United States. doi:https://doi.org/10.17188/1188070
The Materials Project. 2020. "Materials Data on YRh5 by Materials Project". United States. doi:https://doi.org/10.17188/1188070. https://www.osti.gov/servlets/purl/1188070. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1188070,
title = {Materials Data on YRh5 by Materials Project},
author = {The Materials Project},
abstractNote = {YRh5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Y is bonded in a distorted hexagonal planar geometry to eighteen Rh atoms. There are six shorter (3.03 Å) and twelve longer (3.40 Å) Y–Rh bond lengths. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 12-coordinate geometry to three equivalent Y and nine Rh atoms. There are six shorter (2.64 Å) and three longer (3.03 Å) Rh–Rh bond lengths. In the second Rh site, Rh is bonded to four equivalent Y and eight Rh atoms to form a mixture of edge, face, and corner-sharing RhY4Rh8 cuboctahedra. All Rh–Rh bond lengths are 2.63 Å.},
doi = {10.17188/1188070},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}